#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2b39 s PRO 31 N 0.00 -1.04 -0.01 -0.78 0.04 -1.26 -2.18 135.00 129.76 2b39 s PRO 31 Ca 0.00 0.63 -0.19 0.00 0.04 0.00 0.00 61.00 61.48 2b39 s PRO 31 Cb 0.00 -1.56 -0.11 0.00 0.04 0.00 0.00 34.50 32.88 2b39 s PRO 31 CO 0.00 -3.75 0.82 -0.91 0.04 0.00 0.00 177.00 173.20 2b39 h ASN 32 N -2.63 -0.59 -3.49 6.66 -0.26 0.25 -3.41 115.58 112.10 2b39 h ASN 32 Ca -0.59 0.02 -0.67 0.00 -0.56 0.00 0.00 56.30 54.51 2b39 h ASN 32 Cb 1.34 0.15 -0.20 0.00 -1.06 0.00 0.00 38.32 38.55 2b39 h ASN 32 CO 0.49 -0.20 -0.68 -0.63 -1.06 0.00 0.00 177.43 175.36 2b39 s ILE 33 N -3.82 3.80 0.00 2.81 1.01 -1.26 -3.48 121.20 120.26 2b39 s ILE 33 Ca -0.10 -0.42 0.00 0.00 0.00 0.00 0.00 60.65 60.13 2b39 s ILE 33 Cb 0.01 -2.60 0.00 0.00 0.01 0.00 0.00 42.46 39.88 2b39 s ILE 33 CO 0.30 0.56 0.00 0.18 0.00 0.00 0.00 174.94 175.99 2b39 n LEU 34 N 2.70 0.00 -3.64 2.97 4.77 -0.01 -4.95 117.00 118.84 2b39 n LEU 34 Ca -0.18 0.00 -0.07 0.00 -0.03 0.00 0.00 56.01 55.73 2b39 n LEU 34 Cb 0.53 0.00 -0.07 0.00 -2.33 0.00 0.00 43.42 41.55 2b39 n LEU 34 CO 0.29 0.00 0.65 -0.60 -1.33 0.00 0.00 177.39 176.40 2b39 s ARG 35 N 2.63 0.52 0.09 3.23 3.52 -1.26 -4.10 118.95 123.58 2b39 s ARG 35 Ca 0.00 0.73 -0.28 0.00 -0.13 0.00 0.00 55.73 56.05 2b39 s ARG 35 Cb 0.00 0.19 -0.06 0.00 -1.56 0.00 0.00 34.95 33.53 2b39 s ARG 35 CO 0.00 -0.08 0.86 -0.51 -0.81 0.00 0.00 175.30 174.76 2b39 s LEU 36 N 0.75 4.49 -1.26 -0.88 1.43 -1.25 -3.79 118.68 118.18 2b39 s LEU 36 Ca -0.02 1.65 -0.01 0.00 -1.03 0.00 0.00 54.13 54.71 2b39 s LEU 36 Cb -0.05 -3.42 0.00 0.00 0.03 0.00 0.00 46.19 42.76 2b39 s LEU 36 CO -0.10 0.00 0.91 -0.62 0.23 0.00 0.00 176.35 176.77 2b39 n GLU 37 N 2.63 -6.07 0.00 1.70 -0.58 0.44 -4.89 120.64 113.87 2b39 n GLU 37 Ca -0.01 0.76 0.00 0.00 -0.42 0.00 0.00 57.16 57.49 2b39 n GLU 37 Cb 0.49 -5.61 0.00 0.00 -0.57 0.00 0.00 31.44 25.75 2b39 n GLU 37 CO 0.00 0.00 0.00 -1.13 -0.48 0.00 0.00 177.13 175.52 2b39 n SER 38 N -3.09 0.00 -3.22 1.62 3.41 -1.25 -4.90 113.62 106.20 2b39 n SER 38 Ca -0.26 0.00 -0.02 0.00 -0.26 0.00 0.00 58.87 58.33 2b39 n SER 38 Cb 0.66 0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 64.59 2b39 n SER 38 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 2b39 s GLU 39 N 4.76 0.60 0.44 4.33 0.41 -1.25 -4.42 118.70 123.56 2b39 s GLU 39 Ca 0.00 0.11 0.07 0.00 -0.41 0.00 0.00 54.97 54.74 2b39 s GLU 39 Cb 0.00 -0.01 -0.03 0.00 -1.78 0.00 0.00 34.13 32.31 2b39 s GLU 39 CO 0.00 -1.10 0.29 -1.21 -0.49 0.00 0.00 175.26 172.75 2b39 s GLU 40 N 2.38 2.35 0.01 1.61 0.41 -0.83 -4.91 118.70 119.71 2b39 s GLU 40 Ca 0.12 -1.76 0.01 0.00 -0.41 0.00 0.00 54.97 52.93 2b39 s GLU 40 Cb -0.09 -2.15 -0.01 0.00 -1.78 0.00 0.00 34.13 30.10 2b39 s GLU 40 CO -0.20 -0.23 -0.03 0.95 -0.49 0.00 0.00 175.26 175.26 2b39 s THR 41 N -2.58 0.19 0.32 3.63 -4.23 -1.26 -1.01 115.64 110.70 2b39 s THR 41 Ca 0.42 -0.46 0.06 0.00 -1.18 0.00 0.00 61.69 60.53 2b39 s THR 41 Cb 0.00 -0.23 -0.01 0.00 1.34 0.00 0.00 72.50 73.59 2b39 s THR 41 CO 0.24 -0.18 0.46 -0.69 -0.54 0.00 0.00 174.62 173.92 2b39 s VAL 42 N -0.65 4.35 -0.34 2.29 1.01 -0.76 -4.08 120.40 122.23 2b39 s VAL 42 Ca -0.06 -0.95 -0.01 0.00 0.00 0.00 0.00 61.98 60.97 2b39 s VAL 42 Cb -0.05 -3.52 0.12 0.00 0.00 0.00 0.00 36.38 32.93 2b39 s VAL 42 CO -0.00 -0.22 0.16 -0.69 0.00 0.00 0.00 175.10 174.36 2b39 s VAL 43 N -2.16 0.53 0.01 2.92 1.01 -1.26 -3.54 120.40 117.90 2b39 s VAL 43 Ca 0.43 -1.54 -0.16 0.00 0.00 0.00 0.00 61.98 60.71 2b39 s VAL 43 Cb -0.09 -1.40 -0.06 0.00 0.00 0.00 0.00 36.38 34.83 2b39 s VAL 43 CO 0.31 -0.82 0.44 -0.76 0.00 0.00 0.00 175.10 174.27 2b39 s LEU 44 N 1.35 4.48 -0.03 3.92 1.02 -1.24 -4.82 118.68 123.36 2b39 s LEU 44 Ca 0.13 1.01 -0.03 0.00 0.02 0.00 0.00 54.13 55.27 2b39 s LEU 44 Cb -0.20 -2.64 0.01 0.00 0.02 0.00 0.00 46.19 43.38 2b39 s LEU 44 CO -0.16 0.31 0.08 -1.61 0.02 0.00 0.00 176.35 174.99 2b39 s GLU 45 N -1.04 0.10 -0.91 1.70 2.02 -1.26 -4.30 118.70 115.01 2b39 s GLU 45 Ca 0.25 0.10 -0.01 0.00 0.02 0.00 0.00 54.97 55.33 2b39 s GLU 45 Cb -0.17 0.05 0.27 0.00 0.10 0.00 0.00 34.13 34.38 2b39 s GLU 45 CO 0.14 -0.01 1.12 0.00 0.02 0.00 0.00 175.26 176.53 2b39 n ALA 46 N 3.01 4.56 -1.50 5.21 0.00 -1.26 -5.03 120.51 125.50 2b39 n ALA 46 Ca -0.12 -4.76 -0.42 0.00 0.00 0.00 0.00 53.44 48.14 2b39 n ALA 46 Cb 0.59 -1.77 -0.10 0.00 0.00 0.00 0.00 19.45 18.18 2b39 n ALA 46 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 2b39 n HIS 47 N 1.36 1.02 -2.23 0.00 8.25 -1.26 0.32 115.22 122.68 2b39 n HIS 47 Ca 0.27 0.30 -0.06 0.00 -0.26 0.00 0.00 57.72 57.97 2b39 n HIS 47 Cb 0.37 -2.48 0.03 0.00 1.12 0.00 0.00 29.99 29.02 2b39 n HIS 47 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2b39 n GLY 48 N 6.40 0.10 3.90 -1.41 0.00 -1.26 -5.01 105.19 107.91 2b39 n GLY 48 Ca 0.52 0.03 -0.28 0.00 0.00 0.00 0.00 46.02 46.30 2b39 n GLY 48 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2b39 s GLY 49 N -3.20 1.55 0.02 -0.02 0.00 0.15 -5.09 107.32 100.73 2b39 s GLY 49 Ca 0.16 -0.49 -0.00 0.00 0.00 0.00 0.00 44.72 44.38 2b39 s GLY 49 CO 0.29 -0.28 0.03 0.61 0.00 0.00 0.00 173.10 173.75 2b39 n GLN 50 N -2.43 -0.21 -0.29 2.90 10.64 -1.26 -4.96 117.38 121.78 2b39 n GLN 50 Ca 0.02 -0.04 -0.11 0.00 -1.83 0.00 0.00 57.00 55.04 2b39 n GLN 50 Cb 0.56 -0.03 -0.09 0.00 -0.86 0.00 0.00 30.24 29.82 2b39 n GLN 50 CO 0.00 0.00 0.00 0.78 -1.83 0.00 0.00 177.06 176.01 2b39 h GLY 51 N -0.13 -0.82 -5.33 2.61 0.00 -1.98 -3.43 103.07 93.98 2b39 h GLY 51 Ca -0.01 0.73 -0.03 0.00 0.00 0.00 0.00 47.33 48.02 2b39 h GLY 51 CO 0.01 -0.05 -0.16 -0.51 0.00 0.00 0.00 176.54 175.83 2b39 s THR 52 N -5.61 -0.25 0.22 4.70 -4.23 -1.26 -3.38 115.64 105.82 2b39 s THR 52 Ca -0.13 0.05 0.10 0.00 -1.18 0.00 0.00 61.69 60.54 2b39 s THR 52 Cb 0.11 -0.83 -0.04 0.00 1.34 0.00 0.00 72.50 73.07 2b39 s THR 52 CO 0.63 0.02 -0.15 -0.63 -0.54 0.00 0.00 174.62 173.95 2b39 s ILE 53 N 1.89 2.82 -0.16 2.99 1.09 -0.84 -4.96 121.20 124.03 2b39 s ILE 53 Ca -0.08 -1.96 -0.00 0.00 -1.10 0.00 0.00 60.65 57.50 2b39 s ILE 53 Cb -0.08 -2.42 0.04 0.00 -1.06 0.00 0.00 42.46 38.94 2b39 s ILE 53 CO -0.17 -0.21 -0.06 -1.58 -0.10 0.00 0.00 174.94 172.82 2b39 s GLN 54 N -3.04 1.52 0.21 2.79 0.74 -1.26 0.22 119.66 120.83 2b39 s GLN 54 Ca 0.26 -0.50 0.05 0.00 0.05 0.00 0.00 55.36 55.21 2b39 s GLN 54 Cb -0.07 -1.98 -0.03 0.00 1.10 0.00 0.00 33.01 32.03 2b39 s GLN 54 CO 0.14 -0.40 0.27 0.14 -0.55 0.00 0.00 175.29 174.89 2b39 s VAL 55 N 1.62 4.97 0.02 1.34 -7.23 -1.11 -4.08 120.40 115.93 2b39 s VAL 55 Ca 0.01 -1.03 0.04 0.00 -1.81 0.00 0.00 61.98 59.19 2b39 s VAL 55 Cb -0.15 -3.64 -0.02 0.00 0.56 0.00 0.00 36.38 33.13 2b39 s VAL 55 CO -0.08 -0.25 -0.11 -0.94 -0.31 0.00 0.00 175.10 173.41 2b39 s SER 56 N -3.65 1.31 -0.07 4.85 1.04 0.58 -3.57 113.70 114.19 2b39 s SER 56 Ca 0.33 -0.36 0.04 0.00 0.48 0.00 0.00 55.95 56.44 2b39 s SER 56 Cb -0.09 -0.09 -0.02 0.00 0.10 0.00 0.00 66.02 65.92 2b39 s SER 56 CO 0.27 0.02 -0.18 -0.69 0.98 0.00 0.00 173.24 173.64 2b39 s VAL 57 N -0.70 2.65 -0.28 5.02 1.01 -1.21 -0.97 120.40 125.92 2b39 s VAL 57 Ca 0.00 -0.85 -0.02 0.00 0.00 0.00 0.00 61.98 61.11 2b39 s VAL 57 Cb -0.07 -2.03 0.12 0.00 0.00 0.00 0.00 36.38 34.40 2b39 s VAL 57 CO 0.01 0.57 0.22 0.42 0.00 0.00 0.00 175.10 176.32 2b39 s THR 58 N -0.26 -0.27 0.40 3.92 -4.23 -0.02 -3.79 115.64 111.38 2b39 s THR 58 Ca 0.01 -0.56 -0.24 0.00 -1.18 0.00 0.00 61.69 59.71 2b39 s THR 58 Cb -0.13 -0.96 -0.09 0.00 1.34 0.00 0.00 72.50 72.66 2b39 s THR 58 CO 0.03 -0.55 1.05 -0.69 -0.54 0.00 0.00 174.62 173.92 2b39 s VAL 59 N 2.26 3.72 0.25 2.29 1.01 -1.24 -2.34 120.40 126.36 2b39 s VAL 59 Ca 0.09 1.32 -0.09 0.00 0.00 0.00 0.00 61.98 63.31 2b39 s VAL 59 Cb -0.15 -3.69 -0.01 0.00 0.00 0.00 0.00 36.38 32.53 2b39 s VAL 59 CO -0.33 0.01 0.40 -1.00 0.00 0.00 0.00 175.10 174.19 2b39 s HIS 60 N -1.65 0.65 0.13 5.22 3.76 0.27 -1.87 115.29 121.79 2b39 s HIS 60 Ca 0.57 -0.96 -0.30 0.00 -0.15 0.00 0.00 55.06 54.22 2b39 s HIS 60 Cb -0.22 -0.01 -0.07 0.00 1.11 0.00 0.00 32.58 33.38 2b39 s HIS 60 CO 0.28 -0.94 1.24 -0.51 -0.85 0.00 0.00 174.74 173.95 2b39 s ASP 61 N -3.08 7.03 0.41 1.40 1.01 -1.26 -0.33 116.67 121.84 2b39 s ASP 61 Ca 0.27 2.18 0.16 0.00 0.71 0.00 0.00 52.55 55.87 2b39 s ASP 61 Cb 0.01 -2.59 1.03 0.00 1.01 0.00 0.00 42.92 42.38 2b39 s ASP 61 CO 0.12 -0.46 1.87 2.19 0.21 0.00 0.00 175.17 179.09 2b39 h PHE 62 N 6.06 0.58 0.00 4.23 -5.15 -1.85 -3.26 116.94 117.55 2b39 h PHE 62 Ca -0.43 0.02 0.00 0.00 -0.20 0.00 0.00 57.97 57.36 2b39 h PHE 62 Cb 1.21 -0.18 0.00 0.00 0.22 0.00 0.00 35.95 37.20 2b39 h PHE 62 CO 0.64 0.18 0.00 -0.35 -2.00 0.00 0.00 178.31 176.78 2b39 n PRO 63 N -4.52 0.00 -4.15 6.09 -0.04 -1.26 -4.87 135.00 126.26 2b39 n PRO 63 Ca 0.18 0.01 -0.27 0.00 -0.04 0.00 0.00 63.50 63.38 2b39 n PRO 63 Cb 0.63 -0.51 -0.17 0.00 -0.04 0.00 0.00 33.50 33.41 2b39 n PRO 63 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2b39 s ALA 64 N -3.97 1.50 -0.90 0.55 0.00 -1.25 -5.05 121.76 112.63 2b39 s ALA 64 Ca 0.00 -0.63 -0.23 0.00 0.00 0.00 0.00 51.96 51.09 2b39 s ALA 64 Cb 0.00 -0.87 -0.15 0.00 0.00 0.00 0.00 23.12 22.10 2b39 s ALA 64 CO 0.00 -0.25 1.91 1.63 0.00 0.00 0.00 175.76 179.05 2b39 n LYS 65 N 4.57 1.33 0.00 0.00 5.02 -1.23 -4.64 118.16 123.20 2b39 n LYS 65 Ca -0.16 -2.03 0.07 0.00 -2.02 0.00 0.00 58.31 54.17 2b39 n LYS 65 Cb 0.51 -3.29 0.40 0.00 -0.02 0.00 0.00 35.03 32.62 2b39 n LYS 65 CO 0.00 0.00 0.00 0.36 -0.52 0.00 0.00 177.40 177.24 2b39 n LYS 66 N 7.71 0.29 -3.85 1.97 2.85 -1.26 -4.78 118.16 121.08 2b39 n LYS 66 Ca 0.47 0.10 -0.09 0.00 -1.05 0.00 0.00 58.31 57.74 2b39 n LYS 66 Cb 0.44 -1.50 -0.07 0.00 -0.65 0.00 0.00 35.03 33.24 2b39 n LYS 66 CO 0.00 0.00 0.00 -0.65 -0.05 0.00 0.00 177.40 176.70 2b39 s GLN 67 N -2.41 0.84 -0.27 -1.58 -0.21 -1.26 -5.11 119.66 109.67 2b39 s GLN 67 Ca 0.17 -0.95 -0.14 0.00 0.02 0.00 0.00 55.36 54.46 2b39 s GLN 67 Cb 0.10 0.34 -0.04 0.00 1.00 0.00 0.00 33.01 34.41 2b39 s GLN 67 CO 0.21 -0.27 0.32 0.54 -2.12 0.00 0.00 175.29 173.98 2b39 s VAL 68 N -3.84 5.21 -0.21 1.09 0.11 -1.26 -4.45 120.40 117.05 2b39 s VAL 68 Ca 0.05 0.47 -0.12 0.00 -2.93 0.00 0.00 61.98 59.45 2b39 s VAL 68 Cb 0.05 -3.65 -0.09 0.00 -1.53 0.00 0.00 36.38 31.15 2b39 s VAL 68 CO -0.11 0.19 -0.29 0.18 -3.33 0.00 0.00 175.10 171.74 2b39 n LEU 69 N 5.17 1.65 -4.61 2.54 4.77 -0.78 -5.00 117.00 120.73 2b39 n LEU 69 Ca -0.10 0.28 -0.24 0.00 -0.03 0.00 0.00 56.01 55.92 2b39 n LEU 69 Cb 0.51 -0.67 -0.08 0.00 -2.33 0.00 0.00 43.42 40.84 2b39 n LEU 69 CO 0.36 0.31 -0.33 -0.94 -1.33 0.00 0.00 177.39 175.46 2b39 s SER 70 N -6.83 4.19 0.00 -1.43 1.04 -1.26 -4.96 113.70 104.45 2b39 s SER 70 Ca -0.30 -0.90 0.00 0.00 0.48 0.00 0.00 55.95 55.22 2b39 s SER 70 Cb 0.10 -0.58 0.00 0.00 0.10 0.00 0.00 66.02 65.64 2b39 s SER 70 CO 0.39 -0.13 0.00 0.59 0.98 0.00 0.00 173.24 175.07 2b39 n ASN 71 N -0.89 0.07 -3.36 7.02 3.02 -1.25 -3.60 115.26 116.27 2b39 n ASN 71 Ca -0.05 -0.02 -0.47 0.00 -0.03 0.00 0.00 54.58 54.01 2b39 n ASN 71 Cb 0.61 0.05 -0.07 0.00 -0.61 0.00 0.00 39.78 39.76 2b39 n ASN 71 CO 0.00 0.00 0.00 1.21 -2.62 0.00 0.00 177.26 175.85 2b39 n GLU 72 N -0.05 0.00 -4.04 3.52 4.07 -1.26 -4.14 120.64 118.74 2b39 n GLU 72 Ca 0.00 0.00 -0.12 0.00 -0.06 0.00 0.00 57.16 56.98 2b39 n GLU 72 Cb 0.00 -1.07 -0.11 0.00 -0.06 0.00 0.00 31.44 30.19 2b39 n GLU 72 CO 0.00 0.00 0.00 0.54 -0.06 0.00 0.00 177.13 177.61 2b39 s ASN 73 N 1.69 0.66 0.17 4.31 4.22 -1.26 -3.32 114.94 121.40 2b39 s ASN 73 Ca 0.73 -0.53 0.03 0.00 -2.14 0.00 0.00 52.86 50.95 2b39 s ASN 73 Cb -1.04 0.05 -0.01 0.00 1.28 0.00 0.00 41.25 41.54 2b39 s ASN 73 CO 0.55 -0.23 0.10 1.07 -2.04 0.00 0.00 177.10 176.55 2b39 n THR 74 N 1.53 0.00 -4.30 0.54 5.66 -1.23 -5.04 114.28 111.43 2b39 n THR 74 Ca -0.23 -1.11 -0.19 0.00 -3.05 0.00 0.00 64.05 59.48 2b39 n THR 74 Cb 0.55 0.48 -0.11 0.00 -1.55 0.00 0.00 70.33 69.70 2b39 n THR 74 CO 0.00 0.00 0.00 -1.10 -3.05 0.00 0.00 175.07 170.92 2b39 s GLN 75 N -2.67 1.21 -1.05 1.09 -0.21 -1.26 -2.74 119.66 114.02 2b39 s GLN 75 Ca 0.14 -1.44 -0.11 0.00 0.02 0.00 0.00 55.36 53.97 2b39 s GLN 75 Cb 0.01 -1.06 0.25 0.00 1.00 0.00 0.00 33.01 33.21 2b39 s GLN 75 CO 0.10 0.19 1.07 -0.51 -2.12 0.00 0.00 175.29 174.02 2b39 s LEU 76 N -2.92 6.26 -0.84 2.90 1.43 0.58 -4.78 118.68 121.31 2b39 s LEU 76 Ca 0.17 -3.28 -0.09 0.00 -1.03 0.00 0.00 54.13 49.90 2b39 s LEU 76 Cb -0.03 -2.24 0.22 0.00 0.03 0.00 0.00 46.19 44.17 2b39 s LEU 76 CO 0.05 -0.43 0.75 0.20 0.23 0.00 0.00 176.35 177.15 2b39 s ASN 77 N 1.75 6.38 0.00 2.29 -0.87 -1.26 -2.00 114.94 121.23 2b39 s ASN 77 Ca 0.29 -3.02 0.00 0.00 -1.57 0.00 0.00 52.86 48.56 2b39 s ASN 77 Cb -0.09 -2.08 0.00 0.00 -0.02 0.00 0.00 41.25 39.06 2b39 s ASN 77 CO -0.07 -0.42 0.00 -1.54 -2.57 0.00 0.00 177.10 172.49 2b39 n SER 78 N 3.42 0.00 0.31 -1.22 3.41 -1.22 -3.42 113.62 114.90 2b39 n SER 78 Ca 0.15 0.00 0.19 0.00 -0.26 0.00 0.00 58.87 58.95 2b39 n SER 78 Cb 0.42 0.00 1.01 0.00 -0.26 0.00 0.00 64.21 65.38 2b39 n SER 78 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 2b39 h ASN 79 N 0.00 0.00 0.74 4.04 -1.07 -1.94 -2.38 115.58 114.97 2b39 h ASN 79 Ca 0.00 0.00 -0.23 0.00 0.07 0.00 0.00 56.30 56.14 2b39 h ASN 79 Cb 0.00 0.00 -0.01 0.00 -2.07 0.00 0.00 38.32 36.24 2b39 h ASN 79 CO 0.00 0.00 -1.03 0.78 0.07 0.00 0.00 177.43 177.25 2b39 h ASN 80 N 0.00 0.22 0.00 6.14 2.35 -1.94 -3.49 115.58 118.87 2b39 h ASN 80 Ca 0.02 -0.22 0.00 0.00 -0.55 0.00 0.00 56.30 55.55 2b39 h ASN 80 Cb 0.31 -0.07 0.00 0.00 0.05 0.00 0.00 38.32 38.61 2b39 h ASN 80 CO -0.00 1.12 0.00 0.61 -1.65 0.00 0.00 177.43 177.51 2b39 n GLY 81 N 1.24 2.04 0.00 2.83 0.00 -0.90 -4.25 105.19 106.15 2b39 n GLY 81 Ca -0.04 -0.68 0.00 0.00 0.00 0.00 0.00 46.02 45.30 2b39 n GLY 81 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 173.32 174.90 2b39 n TYR 82 N 0.00 0.00 -2.15 1.61 0.18 -1.26 -4.68 117.16 110.86 2b39 n TYR 82 Ca 0.00 0.00 -0.34 0.00 1.88 0.00 0.00 57.90 59.44 2b39 n TYR 82 Cb 0.00 0.01 -0.04 0.00 -0.38 0.00 0.00 39.34 38.94 2b39 n TYR 82 CO 0.00 0.00 0.00 -1.17 -2.08 0.00 0.00 176.86 173.61 2b39 s LEU 83 N 0.00 3.25 -0.36 -3.48 2.96 -1.26 -4.28 118.68 115.50 2b39 s LEU 83 Ca 0.00 -0.40 0.00 0.00 -0.22 0.00 0.00 54.13 53.51 2b39 s LEU 83 Cb 0.00 -2.55 0.12 0.00 0.50 0.00 0.00 46.19 44.26 2b39 s LEU 83 CO 0.00 -2.40 0.18 -0.94 -1.32 0.00 0.00 176.35 171.87 2b39 s SER 84 N 7.33 3.54 -0.31 3.68 1.04 -1.26 -4.98 113.70 122.75 2b39 s SER 84 Ca 0.63 -2.09 -0.15 0.00 0.48 0.00 0.00 55.95 54.82 2b39 s SER 84 Cb -0.08 -0.73 -0.03 0.00 0.10 0.00 0.00 66.02 65.28 2b39 s SER 84 CO 0.07 -0.34 0.36 0.42 0.98 0.00 0.00 173.24 174.73 2b39 s THR 85 N 1.09 5.17 -0.56 2.02 -4.23 -1.26 -3.67 115.64 114.20 2b39 s THR 85 Ca 0.15 0.31 -0.20 0.00 -1.18 0.00 0.00 61.69 60.76 2b39 s THR 85 Cb -0.21 -3.75 0.07 0.00 1.34 0.00 0.00 72.50 69.94 2b39 s THR 85 CO -0.10 0.04 0.75 -0.69 -0.54 0.00 0.00 174.62 174.08 2b39 s VAL 86 N 2.04 4.69 0.18 2.29 1.01 -1.23 -4.92 120.40 124.45 2b39 s VAL 86 Ca 0.13 -0.47 -0.30 0.00 0.00 0.00 0.00 61.98 61.35 2b39 s VAL 86 Cb -0.16 -4.45 -0.08 0.00 0.00 0.00 0.00 36.38 31.69 2b39 s VAL 86 CO 0.11 -1.05 1.06 0.42 0.00 0.00 0.00 175.10 175.64 2b39 s THR 87 N 3.10 3.98 0.03 3.92 -4.23 -1.26 -1.83 115.64 119.35 2b39 s THR 87 Ca 0.18 1.74 0.01 0.00 -1.18 0.00 0.00 61.69 62.44 2b39 s THR 87 Cb -0.19 -4.11 -0.02 0.00 1.34 0.00 0.00 72.50 69.52 2b39 s THR 87 CO 0.11 0.31 -0.05 -0.63 -0.54 0.00 0.00 174.62 173.83 2b39 s ILE 88 N -0.35 0.31 -0.06 2.99 1.01 -0.18 -4.88 121.20 120.05 2b39 s ILE 88 Ca 0.48 -0.88 0.05 0.00 0.00 0.00 0.00 60.65 60.30 2b39 s ILE 88 Cb -0.28 -0.40 -0.02 0.00 0.01 0.00 0.00 42.46 41.77 2b39 s ILE 88 CO 0.34 -0.38 -0.22 -0.75 0.00 0.00 0.00 174.94 173.93 2b39 s LYS 89 N -1.33 2.55 -0.32 2.79 2.20 -1.26 -1.97 119.74 122.41 2b39 s LYS 89 Ca -0.11 -0.85 -0.00 0.00 -0.36 0.00 0.00 55.97 54.64 2b39 s LYS 89 Cb -0.09 -2.22 0.10 0.00 -1.51 0.00 0.00 37.83 34.11 2b39 s LYS 89 CO -0.00 0.43 0.09 0.42 -0.36 0.00 0.00 175.35 175.93 2b39 s ILE 90 N -0.28 1.09 0.24 5.43 1.01 -1.26 -4.76 121.20 122.68 2b39 s ILE 90 Ca 0.00 -1.55 -0.00 0.00 0.00 0.00 0.00 60.65 59.10 2b39 s ILE 90 Cb -0.13 -1.82 0.05 0.00 0.01 0.00 0.00 42.46 40.57 2b39 s ILE 90 CO 0.03 -0.67 0.33 -2.65 0.00 0.00 0.00 174.94 171.98 2b39 n PRO 91 N 4.75 0.34 -2.71 2.79 -0.02 -1.26 0.17 135.00 139.05 2b39 n PRO 91 Ca -0.01 -0.88 -0.06 0.00 -2.02 0.00 0.00 63.50 60.54 2b39 n PRO 91 Cb 0.42 -0.23 0.05 0.00 -0.02 0.00 0.00 33.50 33.72 2b39 n PRO 91 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2b39 n ALA 92 N -2.99 -2.55 0.84 3.55 0.00 -1.26 -4.84 120.51 113.27 2b39 n ALA 92 Ca -0.05 -0.79 0.02 0.00 0.00 0.00 0.00 53.44 52.62 2b39 n ALA 92 Cb 0.19 -2.29 0.14 0.00 0.00 0.00 0.00 19.45 17.49 2b39 n ALA 92 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2b39 n SER 93 N 1.83 0.00 -1.26 0.00 3.41 -1.26 -2.96 113.62 113.37 2b39 n SER 93 Ca 0.07 -0.70 -0.01 0.00 -0.26 0.00 0.00 58.87 57.97 2b39 n SER 93 Cb 0.65 0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 64.58 2b39 n SER 93 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 175.04 176.05 2b39 n LYS 94 N -0.67 0.00 -2.72 4.33 3.00 -1.26 -4.92 118.16 115.93 2b39 n LYS 94 Ca 0.03 -1.52 -0.03 0.00 -0.00 0.00 0.00 58.31 56.79 2b39 n LYS 94 Cb 0.02 0.24 0.10 0.00 0.00 0.00 0.00 35.03 35.38 2b39 n LYS 94 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.40 177.79 2b39 n GLU 95 N 0.26 1.41 -2.42 1.64 -0.58 -1.16 -5.08 120.64 114.72 2b39 n GLU 95 Ca -0.10 -2.06 -0.43 0.00 -0.42 0.00 0.00 57.16 54.14 2b39 n GLU 95 Cb 0.93 -0.30 -0.02 0.00 -0.57 0.00 0.00 31.44 31.48 2b39 n GLU 95 CO 0.00 0.00 0.00 -1.17 -0.48 0.00 0.00 177.13 175.48 2b39 s LEU 96 N -3.79 3.78 0.48 -4.62 2.96 -1.26 -4.97 118.68 111.26 2b39 s LEU 96 Ca 0.17 1.05 -0.24 0.00 -0.22 0.00 0.00 54.13 54.89 2b39 s LEU 96 Cb 0.41 -3.54 -0.07 0.00 0.50 0.00 0.00 46.19 43.49 2b39 s LEU 96 CO -0.09 -1.19 1.39 -1.59 -1.32 0.00 0.00 176.35 173.55 2b39 s LYS 97 N 4.40 3.53 0.69 1.98 -2.85 -1.26 -5.02 119.74 121.20 2b39 s LYS 97 Ca 0.57 2.32 -0.03 0.00 -1.00 0.00 0.00 55.97 57.83 2b39 s LYS 97 Cb -0.15 -2.52 0.09 0.00 -2.06 0.00 0.00 37.83 33.19 2b39 s LYS 97 CO 0.26 -0.91 0.96 -1.54 0.10 0.00 0.00 175.35 174.23 2b39 s SER 98 N -0.70 4.60 0.44 0.03 1.04 -1.26 -4.97 113.70 112.88 2b39 s SER 98 Ca 0.64 -0.06 0.29 0.00 0.48 0.00 0.00 55.95 57.31 2b39 s SER 98 Cb -0.42 -0.49 1.60 0.00 0.10 0.00 0.00 66.02 66.81 2b39 s SER 98 CO 0.52 -1.68 1.90 0.44 0.98 0.00 0.00 173.24 175.40 2b39 h ASP 99 N -0.46 0.00 0.00 7.02 3.32 -2.02 -2.98 116.42 121.30 2b39 h ASP 99 Ca -0.40 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.65 2b39 h ASP 99 Cb 1.28 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.83 2b39 h ASP 99 CO 0.47 0.00 -1.20 2.29 -1.72 0.00 0.00 179.24 179.09 2b39 n LYS 100 N -2.53 1.09 -1.43 3.56 0.00 -1.26 -5.07 118.16 112.52 2b39 n LYS 100 Ca -0.02 -0.06 0.00 0.00 -0.00 0.00 0.00 58.31 58.23 2b39 n LYS 100 Cb 0.05 -1.15 0.00 0.00 -0.00 0.00 0.00 35.03 33.93 2b39 n LYS 100 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2b39 n GLY 101 N 1.83 3.96 0.00 2.58 0.00 -1.13 -5.16 105.19 107.27 2b39 n GLY 101 Ca -0.01 -2.16 0.00 0.00 0.00 0.00 0.00 46.02 43.85 2b39 n GLY 101 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 2b39 n HIS 102 N -0.25 0.00 -3.65 1.61 1.44 -1.26 -4.51 115.22 108.60 2b39 n HIS 102 Ca 0.00 0.00 -0.02 0.00 -2.01 0.00 0.00 57.72 55.69 2b39 n HIS 102 Cb 0.00 0.00 -0.07 0.00 0.12 0.00 0.00 29.99 30.04 2b39 n HIS 102 CO 0.00 0.00 0.00 0.15 -2.81 0.00 0.00 176.34 173.68 2b39 s LYS 103 N 0.65 0.24 0.00 -1.40 1.02 -1.26 -4.82 119.74 114.17 2b39 s LYS 103 Ca 0.00 0.36 0.00 0.00 0.02 0.00 0.00 55.97 56.35 2b39 s LYS 103 Cb 0.00 0.08 0.00 0.00 -0.52 0.00 0.00 37.83 37.39 2b39 s LYS 103 CO 0.00 -0.04 0.00 1.19 -0.92 0.00 0.00 175.35 175.58 2b39 n PHE 104 N 2.80 0.00 -3.64 3.18 3.72 -1.26 -3.36 117.46 118.90 2b39 n PHE 104 Ca -0.15 0.00 -0.09 0.00 -0.05 0.00 0.00 57.45 57.16 2b39 n PHE 104 Cb 0.57 0.00 -0.07 0.00 -0.94 0.00 0.00 39.48 39.04 2b39 n PHE 104 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 176.76 176.79 2b39 s VAL 105 N 1.99 0.00 0.05 -4.37 1.01 -1.08 -3.92 120.40 114.07 2b39 s VAL 105 Ca 0.00 0.00 0.02 0.00 0.00 0.00 0.00 61.98 62.00 2b39 s VAL 105 Cb 0.00 -1.00 -0.04 0.00 0.00 0.00 0.00 36.38 35.34 2b39 s VAL 105 CO 0.00 0.00 0.09 0.42 0.00 0.00 0.00 175.10 175.61 2b39 s THR 106 N 0.22 4.65 -0.08 3.92 -4.23 0.55 0.28 115.64 120.95 2b39 s THR 106 Ca 0.03 -0.62 0.02 0.00 -1.18 0.00 0.00 61.69 59.94 2b39 s THR 106 Cb -0.05 -3.20 -0.02 0.00 1.34 0.00 0.00 72.50 70.56 2b39 s THR 106 CO -0.07 0.20 -0.13 -0.69 -0.54 0.00 0.00 174.62 173.40 2b39 s VAL 107 N -1.33 3.14 -0.28 2.29 1.01 0.23 -0.56 120.40 124.90 2b39 s VAL 107 Ca 0.27 -0.67 -0.02 0.00 0.00 0.00 0.00 61.98 61.56 2b39 s VAL 107 Cb -0.12 -2.27 0.09 0.00 0.00 0.00 0.00 36.38 34.09 2b39 s VAL 107 CO 0.20 0.57 0.10 -0.69 0.00 0.00 0.00 175.10 175.28 2b39 s VAL 108 N -0.38 0.44 -0.14 2.92 1.01 -0.99 -1.17 120.40 122.10 2b39 s VAL 108 Ca 0.04 -1.01 -0.01 0.00 0.00 0.00 0.00 61.98 61.00 2b39 s VAL 108 Cb -0.12 -1.29 -0.02 0.00 0.00 0.00 0.00 36.38 34.95 2b39 s VAL 108 CO 0.02 -0.62 -0.10 0.00 0.00 0.00 0.00 175.10 174.40 2b39 s ALA 109 N 1.85 2.75 0.01 5.51 0.00 -1.20 -0.84 121.76 129.84 2b39 s ALA 109 Ca 0.08 -0.87 -0.01 0.00 0.00 0.00 0.00 51.96 51.16 2b39 s ALA 109 Cb -0.17 -1.32 -0.01 0.00 0.00 0.00 0.00 23.12 21.62 2b39 s ALA 109 CO -0.27 0.25 -0.00 -0.08 0.00 0.00 0.00 175.76 175.66 2b39 s THR 110 N 0.31 0.07 -0.14 0.00 -1.32 -0.14 -1.09 115.64 113.32 2b39 s THR 110 Ca -0.08 -0.60 -0.02 0.00 -1.21 0.00 0.00 61.69 59.78 2b39 s THR 110 Cb -0.15 -0.20 0.04 0.00 -1.51 0.00 0.00 72.50 70.68 2b39 s THR 110 CO 0.05 -0.33 0.00 0.72 -2.21 0.00 0.00 174.62 172.85 2b39 s PHE 111 N -0.98 1.00 0.00 9.09 -0.12 -0.77 -0.31 117.98 125.90 2b39 s PHE 111 Ca -0.11 -0.62 0.00 0.00 -0.05 0.00 0.00 56.93 56.16 2b39 s PHE 111 Cb -0.07 -0.99 0.00 0.00 -0.63 0.00 0.00 43.02 41.33 2b39 s PHE 111 CO -0.00 -0.50 0.00 0.41 -0.05 0.00 0.00 175.22 175.08 2b39 n GLY 112 N 5.06 0.03 1.43 1.99 0.00 -1.26 -2.80 105.19 109.64 2b39 n GLY 112 Ca -0.09 -0.98 0.00 0.00 0.00 0.00 0.00 46.02 44.95 2b39 n GLY 112 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2b39 n ASN 113 N -1.59 4.74 -3.62 1.61 4.05 -1.26 -4.64 115.26 114.55 2b39 n ASN 113 Ca 0.00 -2.28 -0.28 0.00 0.45 0.00 0.00 54.58 52.48 2b39 n ASN 113 Cb 0.00 -0.98 -0.16 0.00 1.23 0.00 0.00 39.78 39.87 2b39 n ASN 113 CO 0.00 0.00 0.00 -0.69 -3.05 0.00 0.00 177.26 173.52 2b39 s VAL 114 N 0.08 0.11 0.20 3.44 1.01 -1.12 -5.12 120.40 118.99 2b39 s VAL 114 Ca 0.00 -0.56 0.09 0.00 0.00 0.00 0.00 61.98 61.51 2b39 s VAL 114 Cb 0.00 -0.90 -0.04 0.00 0.00 0.00 0.00 36.38 35.44 2b39 s VAL 114 CO 0.00 -0.47 -0.06 0.00 0.00 0.00 0.00 175.10 174.57 2b39 s GLN 115 N 2.03 2.18 -0.20 2.72 -2.07 -1.26 -1.85 119.66 121.21 2b39 s GLN 115 Ca 0.05 -1.28 -0.01 0.00 -1.82 0.00 0.00 55.36 52.30 2b39 s GLN 115 Cb -0.16 -2.19 0.06 0.00 -1.09 0.00 0.00 33.01 29.62 2b39 s GLN 115 CO -0.21 0.42 -0.02 0.08 -1.32 0.00 0.00 175.29 174.24 2b39 s VAL 116 N -1.88 1.06 0.36 3.63 1.01 -0.25 -4.97 120.40 119.36 2b39 s VAL 116 Ca 0.27 -0.84 0.07 0.00 0.00 0.00 0.00 61.98 61.49 2b39 s VAL 116 Cb -0.08 -1.39 -0.01 0.00 0.00 0.00 0.00 36.38 34.90 2b39 s VAL 116 CO 0.17 -0.09 0.45 -1.61 0.00 0.00 0.00 175.10 174.03 2b39 s GLU 117 N 1.62 2.93 -0.30 2.72 2.02 -1.25 -3.21 118.70 123.23 2b39 s GLU 117 Ca -0.03 -1.16 -0.22 0.00 0.02 0.00 0.00 54.97 53.58 2b39 s GLU 117 Cb -0.17 -2.71 0.20 0.00 0.10 0.00 0.00 34.13 31.55 2b39 s GLU 117 CO -0.07 -0.03 1.41 0.15 0.02 0.00 0.00 175.26 176.74 2b39 s LYS 118 N -4.18 0.02 0.32 1.61 -0.14 -0.32 -4.92 119.74 112.13 2b39 s LYS 118 Ca 0.47 0.03 -0.23 0.00 -1.36 0.00 0.00 55.97 54.88 2b39 s LYS 118 Cb -0.08 0.01 -0.10 0.00 -1.68 0.00 0.00 37.83 35.98 2b39 s LYS 118 CO 0.30 -0.00 0.88 0.08 -0.76 0.00 0.00 175.35 175.85 2b39 s VAL 119 N 0.33 4.35 0.12 3.17 1.01 -1.26 0.77 120.40 128.89 2b39 s VAL 119 Ca 0.03 1.59 0.01 0.00 0.00 0.00 0.00 61.98 63.60 2b39 s VAL 119 Cb -0.04 -3.88 -0.00 0.00 0.00 0.00 0.00 36.38 32.45 2b39 s VAL 119 CO -0.14 0.06 0.03 0.52 0.00 0.00 0.00 175.10 175.57 2b39 n VAL 120 N 0.34 0.00 -4.10 2.92 0.31 0.81 -4.72 118.33 113.89 2b39 n VAL 120 Ca 0.02 -0.64 -0.28 0.00 -0.01 0.00 0.00 64.34 63.42 2b39 n VAL 120 Cb 0.51 0.21 -0.07 0.00 -0.91 0.00 0.00 33.84 33.59 2b39 n VAL 120 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 2b39 s LEU 121 N 0.00 3.67 -0.06 7.52 1.02 -1.23 -2.65 118.68 126.95 2b39 s LEU 121 Ca 0.05 -0.14 0.02 0.00 0.02 0.00 0.00 54.13 54.08 2b39 s LEU 121 Cb 0.00 -2.33 0.01 0.00 0.02 0.00 0.00 46.19 43.89 2b39 s LEU 121 CO 0.03 0.12 -0.13 -0.63 0.02 0.00 0.00 176.35 175.77 2b39 s ILE 122 N -1.55 1.19 -0.20 -0.59 -1.09 -1.21 -0.83 121.20 116.92 2b39 s ILE 122 Ca 0.29 -0.51 -0.02 0.00 -2.23 0.00 0.00 60.65 58.18 2b39 s ILE 122 Cb -0.11 -1.08 0.06 0.00 -1.58 0.00 0.00 42.46 39.75 2b39 s ILE 122 CO 0.21 0.37 0.01 -0.55 -1.23 0.00 0.00 174.94 173.75 2b39 s SER 123 N 0.61 3.06 -1.19 3.58 0.15 -1.26 -4.77 113.70 113.88 2b39 s SER 123 Ca -0.14 -0.87 -0.07 0.00 0.70 0.00 0.00 55.95 55.57 2b39 s SER 123 Cb -0.16 -0.73 -0.01 0.00 -1.71 0.00 0.00 66.02 63.41 2b39 s SER 123 CO 0.04 -0.28 2.79 -0.11 1.20 0.00 0.00 173.24 176.88 2b39 n LEU 124 N 4.96 7.84 -3.94 3.45 7.94 -1.26 -3.75 117.00 132.25 2b39 n LEU 124 Ca -0.10 -4.41 -0.43 0.00 -1.11 0.00 0.00 56.01 49.97 2b39 n LEU 124 Cb 0.47 -1.43 0.01 0.00 0.53 0.00 0.00 43.42 43.00 2b39 n LEU 124 CO 0.14 1.99 1.25 1.67 -1.11 0.00 0.00 177.39 181.34 2b39 n GLN 125 N 2.42 4.56 0.00 1.96 -0.06 -1.26 -4.88 117.38 120.12 2b39 n GLN 125 Ca 0.65 -4.48 0.00 0.00 -2.00 0.00 0.00 57.00 51.17 2b39 n GLN 125 Cb 0.35 -2.54 0.00 0.00 -4.06 0.00 0.00 30.24 23.99 2b39 n GLN 125 CO 0.00 0.00 0.00 0.43 -0.20 0.00 0.00 177.06 177.29 2b39 n SER 126 N 1.32 0.00 0.00 1.69 7.64 -1.26 -4.89 113.62 118.12 2b39 n SER 126 Ca 0.30 0.00 0.00 0.00 1.01 0.00 0.00 58.87 60.18 2b39 n SER 126 Cb 0.32 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.52 2b39 n SER 126 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2b39 n GLY 127 N -0.72 -0.69 3.22 0.23 0.00 -1.26 -4.39 105.19 101.57 2b39 n GLY 127 Ca 0.00 -0.47 -0.13 0.00 0.00 0.00 0.00 46.02 45.42 2b39 n GLY 127 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2b39 s TYR 128 N -3.89 -0.14 -0.13 1.61 1.51 0.13 -4.75 117.35 111.70 2b39 s TYR 128 Ca 0.00 0.18 -0.05 0.00 -1.01 0.00 0.00 57.07 56.19 2b39 s TYR 128 Cb 0.00 0.07 0.06 0.00 -0.11 0.00 0.00 41.96 41.98 2b39 s TYR 128 CO 0.00 -0.38 0.27 -0.51 -1.11 0.00 0.00 175.55 173.82 2b39 s LEU 129 N -1.36 -0.11 -0.19 -1.29 1.43 -1.26 -1.06 118.68 114.84 2b39 s LEU 129 Ca -0.14 0.60 0.00 0.00 -1.03 0.00 0.00 54.13 53.56 2b39 s LEU 129 Cb -0.06 0.75 0.02 0.00 0.03 0.00 0.00 46.19 46.93 2b39 s LEU 129 CO 0.04 -0.22 -0.17 -0.36 0.23 0.00 0.00 176.35 175.87 2b39 s PHE 130 N 2.07 2.86 -0.20 0.29 0.08 -1.11 -4.93 117.98 117.03 2b39 s PHE 130 Ca -0.02 -1.61 -0.09 0.00 0.12 0.00 0.00 56.93 55.33 2b39 s PHE 130 Cb -0.11 -1.95 -0.04 0.00 -0.57 0.00 0.00 43.02 40.34 2b39 s PHE 130 CO -0.09 -0.78 0.10 0.42 -0.10 0.00 0.00 175.22 174.77 2b39 s ILE 131 N 1.30 5.05 -0.22 0.64 1.01 -1.26 -1.44 121.20 126.28 2b39 s ILE 131 Ca 0.04 0.06 -0.02 0.00 0.00 0.00 0.00 60.65 60.73 2b39 s ILE 131 Cb -0.14 -3.30 0.01 0.00 0.01 0.00 0.00 42.46 39.04 2b39 s ILE 131 CO -0.11 0.43 -0.09 -1.58 0.00 0.00 0.00 174.94 173.59 2b39 s GLN 132 N 0.56 3.09 -0.00 2.79 0.74 0.12 -4.95 119.66 122.01 2b39 s GLN 132 Ca 0.05 -0.80 -0.14 0.00 0.05 0.00 0.00 55.36 54.53 2b39 s GLN 132 Cb -0.12 -2.88 -0.06 0.00 1.10 0.00 0.00 33.01 31.05 2b39 s GLN 132 CO 0.01 -0.27 0.39 0.95 -0.55 0.00 0.00 175.29 175.81 2b39 s THR 133 N 1.38 5.07 0.00 -0.34 -4.23 -1.26 -1.37 115.64 114.89 2b39 s THR 133 Ca 0.04 0.76 0.00 0.00 -1.18 0.00 0.00 61.69 61.31 2b39 s THR 133 Cb -0.15 -3.68 0.00 0.00 1.34 0.00 0.00 72.50 70.01 2b39 s THR 133 CO -0.06 0.56 0.59 -0.67 -0.54 0.00 0.00 174.62 174.49 2b39 n ASP 134 N 1.76 0.00 -0.71 3.99 -0.08 0.32 -4.79 116.55 117.04 2b39 n ASP 134 Ca -0.14 0.59 0.00 0.00 -1.51 0.00 0.00 54.79 53.73 2b39 n ASP 134 Cb 0.53 -0.09 0.00 0.00 2.34 0.00 0.00 41.12 43.90 2b39 n ASP 134 CO 0.00 0.00 0.00 0.29 0.12 0.00 0.00 177.20 177.61 2b39 n LYS 135 N -1.31 2.84 0.00 -0.67 5.02 -1.26 -5.05 118.16 117.72 2b39 n LYS 135 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 2b39 n LYS 135 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.01 2b39 n LYS 135 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 2b39 n THR 136 N -0.16 0.00 -3.49 -0.18 -2.24 -1.26 -4.96 114.28 101.99 2b39 n THR 136 Ca 0.00 -0.30 -0.18 0.00 -2.27 0.00 0.00 64.05 61.30 2b39 n THR 136 Cb 0.00 1.40 -0.13 0.00 -2.10 0.00 0.00 70.33 69.50 2b39 n THR 136 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 2b39 s ILE 137 N -0.00 -0.33 0.27 2.28 1.01 -1.25 -0.62 121.20 122.56 2b39 s ILE 137 Ca 0.00 -0.13 0.09 0.00 0.00 0.00 0.00 60.65 60.62 2b39 s ILE 137 Cb 0.00 -0.69 -0.04 0.00 0.01 0.00 0.00 42.46 41.74 2b39 s ILE 137 CO 0.00 -0.21 0.01 -0.31 0.00 0.00 0.00 174.94 174.43 2b39 s TYR 138 N 2.33 2.69 -0.06 3.97 2.02 0.22 -4.94 117.35 123.58 2b39 s TYR 138 Ca 0.07 -0.24 0.03 0.00 -0.37 0.00 0.00 57.07 56.57 2b39 s TYR 138 Cb -0.16 -1.24 -0.02 0.00 -0.40 0.00 0.00 41.96 40.15 2b39 s TYR 138 CO -0.13 0.60 -0.16 0.95 -1.57 0.00 0.00 175.55 175.24 2b39 s THR 139 N -2.34 2.89 0.00 -0.71 -4.23 -1.26 -0.58 115.64 109.41 2b39 s THR 139 Ca 0.32 -0.77 0.00 0.00 -1.18 0.00 0.00 61.69 60.06 2b39 s THR 139 Cb -0.06 -2.13 0.00 0.00 1.34 0.00 0.00 72.50 71.65 2b39 s THR 139 CO 0.20 0.58 0.00 -2.65 -0.54 0.00 0.00 174.62 172.21 2b39 n PRO 140 N 2.61 0.00 0.02 3.99 -0.02 -1.25 -0.79 135.00 139.55 2b39 n PRO 140 Ca -0.17 0.00 -0.00 0.00 -2.02 0.00 0.00 63.50 61.30 2b39 n PRO 140 Cb 0.52 0.00 0.29 0.00 -0.02 0.00 0.00 33.50 34.29 2b39 n PRO 140 CO 0.00 0.00 0.00 0.78 1.98 0.00 0.00 175.50 178.26 2b39 h GLY 141 N 0.00 0.50 -2.81 -1.23 0.00 -1.78 -3.33 103.07 94.42 2b39 h GLY 141 Ca 0.00 -0.32 -0.55 0.00 0.00 0.00 0.00 47.33 46.46 2b39 h GLY 141 CO 0.00 0.30 0.61 -1.35 0.00 0.00 0.00 176.54 176.09 2b39 s SER 142 N -6.78 5.36 -0.15 0.19 1.04 0.03 -4.39 113.70 109.01 2b39 s SER 142 Ca -0.07 2.74 -0.19 0.00 0.48 0.00 0.00 55.95 58.92 2b39 s SER 142 Cb 0.15 -2.63 -0.04 0.00 0.10 0.00 0.00 66.02 63.60 2b39 s SER 142 CO 0.77 -1.50 0.52 0.28 0.98 0.00 0.00 173.24 174.28 2b39 s THR 143 N -1.31 5.14 -0.07 2.02 -1.32 -1.26 -2.29 115.64 116.55 2b39 s THR 143 Ca 0.70 1.00 -0.30 0.00 -1.21 0.00 0.00 61.69 61.89 2b39 s THR 143 Cb -0.40 -3.85 -0.02 0.00 -1.51 0.00 0.00 72.50 66.72 2b39 s THR 143 CO 0.47 0.25 0.99 -0.69 -2.21 0.00 0.00 174.62 173.44 2b39 s VAL 144 N 1.09 4.82 -0.41 5.08 1.01 0.11 -4.92 120.40 127.17 2b39 s VAL 144 Ca 0.26 2.05 -0.10 0.00 0.00 0.00 0.00 61.98 64.19 2b39 s VAL 144 Cb -0.15 -4.32 0.07 0.00 0.00 0.00 0.00 36.38 31.98 2b39 s VAL 144 CO 0.11 0.07 0.26 -0.76 0.00 0.00 0.00 175.10 174.77 2b39 s LEU 145 N 1.62 5.10 0.23 3.92 1.43 -1.26 -1.67 118.68 128.05 2b39 s LEU 145 Ca 0.50 -1.40 0.10 0.00 -1.03 0.00 0.00 54.13 52.30 2b39 s LEU 145 Cb -0.19 -2.01 -0.05 0.00 0.03 0.00 0.00 46.19 43.97 2b39 s LEU 145 CO 0.22 -0.52 -0.17 -0.72 0.23 0.00 0.00 176.35 175.39 2b39 s TYR 146 N 1.46 1.98 0.03 0.29 -0.00 -1.22 0.12 117.35 120.00 2b39 s TYR 146 Ca 0.03 -0.46 0.00 0.00 -0.00 0.00 0.00 57.07 56.64 2b39 s TYR 146 Cb -0.22 -0.89 -0.02 0.00 -0.00 0.00 0.00 41.96 40.82 2b39 s TYR 146 CO 0.03 0.52 -0.03 1.03 -0.00 0.00 0.00 175.55 177.09 2b39 s ARG 147 N -3.51 0.37 -0.09 -3.49 0.52 -0.47 -2.01 118.95 110.27 2b39 s ARG 147 Ca 0.25 -0.70 -0.01 0.00 -0.52 0.00 0.00 55.73 54.76 2b39 s ARG 147 Cb -0.03 0.08 0.03 0.00 0.52 0.00 0.00 34.95 35.54 2b39 s ARG 147 CO 0.10 -0.05 -0.04 0.54 0.02 0.00 0.00 175.30 175.88 2b39 s VAL 148 N -1.74 0.70 -0.35 3.52 0.11 -0.37 0.14 120.40 122.42 2b39 s VAL 148 Ca -0.13 -0.09 -0.17 0.00 -2.93 0.00 0.00 61.98 58.66 2b39 s VAL 148 Cb -0.08 -0.78 -0.00 0.00 -1.53 0.00 0.00 36.38 33.98 2b39 s VAL 148 CO -0.02 0.31 0.47 -0.36 -3.33 0.00 0.00 175.10 172.17 2b39 s PHE 149 N 1.76 3.19 -0.29 1.54 0.08 -0.52 -1.73 117.98 122.01 2b39 s PHE 149 Ca 0.04 0.10 -0.24 0.00 0.12 0.00 0.00 56.93 56.95 2b39 s PHE 149 Cb -0.13 -2.86 0.00 0.00 -0.57 0.00 0.00 43.02 39.47 2b39 s PHE 149 CO -0.06 -0.52 0.82 0.95 -0.10 0.00 0.00 175.22 176.32 2b39 s THR 150 N 2.28 4.78 0.02 0.64 -4.23 -1.14 -2.77 115.64 115.22 2b39 s THR 150 Ca 0.17 1.35 0.01 0.00 -1.18 0.00 0.00 61.69 62.03 2b39 s THR 150 Cb -0.16 -4.16 -0.01 0.00 1.34 0.00 0.00 72.50 69.51 2b39 s THR 150 CO 0.13 -0.21 -0.03 0.54 -0.54 0.00 0.00 174.62 174.50 2b39 s VAL 151 N 2.98 0.19 0.64 2.29 0.11 -0.22 -3.66 120.40 122.72 2b39 s VAL 151 Ca 0.34 -0.65 -0.08 0.00 -2.93 0.00 0.00 61.98 58.66 2b39 s VAL 151 Cb -0.14 -0.27 0.01 0.00 -1.53 0.00 0.00 36.38 34.45 2b39 s VAL 151 CO 0.11 -0.30 0.98 -0.62 -3.33 0.00 0.00 175.10 171.95 2b39 s ASP 152 N -0.99 5.53 0.28 3.54 -1.08 -0.35 0.22 116.67 123.81 2b39 s ASP 152 Ca -0.09 0.89 0.08 0.00 -0.52 0.00 0.00 52.55 52.90 2b39 s ASP 152 Cb -0.07 -1.80 0.82 0.00 -1.46 0.00 0.00 42.92 40.42 2b39 s ASP 152 CO -0.00 -1.18 1.30 1.57 0.52 0.00 0.00 175.17 177.37 2b39 n HIS 153 N -2.76 0.70 -0.66 -5.34 -0.00 -1.26 0.12 115.22 106.01 2b39 n HIS 153 Ca 0.05 0.99 -0.15 0.00 -0.00 0.00 0.00 57.72 58.62 2b39 n HIS 153 Cb 0.57 -1.23 0.05 0.00 -0.00 0.00 0.00 29.99 29.38 2b39 n HIS 153 CO 0.00 0.00 0.00 1.63 -0.00 0.00 0.00 176.34 177.97 2b39 n LYS 154 N -5.06 1.72 -4.32 1.57 5.02 -1.26 -4.82 118.16 111.00 2b39 n LYS 154 Ca 0.24 -1.47 -0.34 0.00 -2.02 0.00 0.00 58.31 54.72 2b39 n LYS 154 Cb 0.81 -1.58 -0.08 0.00 -0.02 0.00 0.00 35.03 34.16 2b39 n LYS 154 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 2b39 n LEU 155 N 0.23 -1.16 -4.36 -0.35 4.77 0.32 -4.69 117.00 111.76 2b39 n LEU 155 Ca 0.28 -1.21 -0.35 0.00 -0.03 0.00 0.00 56.01 54.70 2b39 n LEU 155 Cb 0.69 -1.72 -0.14 0.00 -2.33 0.00 0.00 43.42 39.92 2b39 n LEU 155 CO 0.34 0.35 -0.36 -0.76 -1.33 0.00 0.00 177.39 175.63 2b39 s LEU 156 N -7.29 3.04 -0.89 2.23 1.43 -1.17 -3.31 118.68 112.73 2b39 s LEU 156 Ca 0.29 -0.33 -0.15 0.00 -1.03 0.00 0.00 54.13 52.91 2b39 s LEU 156 Cb -0.17 -1.78 -0.25 0.00 0.03 0.00 0.00 46.19 44.02 2b39 s LEU 156 CO 0.99 -0.00 2.20 -0.81 0.23 0.00 0.00 176.35 178.96 2b39 n PRO 157 N 4.67 0.21 -3.94 1.29 -0.04 -1.26 -1.22 135.00 134.71 2b39 n PRO 157 Ca -0.18 -0.35 -0.35 0.00 -0.04 0.00 0.00 63.50 62.58 2b39 n PRO 157 Cb 0.51 -2.05 -0.10 0.00 -0.04 0.00 0.00 33.50 31.82 2b39 n PRO 157 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 2b39 s VAL 158 N 5.84 4.77 -1.39 0.52 1.01 -1.24 -4.74 120.40 125.17 2b39 s VAL 158 Ca 1.12 -0.03 -0.07 0.00 0.00 0.00 0.00 61.98 62.99 2b39 s VAL 158 Cb -0.54 -3.17 0.08 0.00 0.00 0.00 0.00 36.38 32.75 2b39 s VAL 158 CO 0.36 0.43 2.45 0.61 0.00 0.00 0.00 175.10 178.95 2b39 n GLY 159 N 3.84 4.94 1.48 4.51 0.00 -1.26 -4.63 105.19 114.06 2b39 n GLY 159 Ca -0.16 -1.93 -0.09 0.00 0.00 0.00 0.00 46.02 43.84 2b39 n GLY 159 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2b39 n GLN 160 N 2.50 0.15 -3.82 1.61 6.02 -1.26 -3.63 117.38 118.95 2b39 n GLN 160 Ca 0.63 -0.98 -0.36 0.00 -0.01 0.00 0.00 57.00 56.28 2b39 n GLN 160 Cb 0.26 -0.31 -0.08 0.00 1.02 0.00 0.00 30.24 31.13 2b39 n GLN 160 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 177.06 177.00 2b39 s THR 161 N -1.28 5.34 0.12 5.09 -4.23 -1.26 -2.62 115.64 116.80 2b39 s THR 161 Ca 0.26 0.16 0.07 0.00 -1.18 0.00 0.00 61.69 61.00 2b39 s THR 161 Cb -0.01 -3.39 -0.04 0.00 1.34 0.00 0.00 72.50 70.40 2b39 s THR 161 CO 0.18 0.50 -0.16 -0.69 -0.54 0.00 0.00 174.62 173.91 2b39 s VAL 162 N -0.09 1.46 -0.18 2.29 1.01 -1.20 0.46 120.40 124.15 2b39 s VAL 162 Ca 0.10 -1.66 0.01 0.00 0.00 0.00 0.00 61.98 60.43 2b39 s VAL 162 Cb -0.11 -1.52 0.03 0.00 0.00 0.00 0.00 36.38 34.77 2b39 s VAL 162 CO 0.00 -0.30 -0.17 -0.36 0.00 0.00 0.00 175.10 174.27 2b39 s PHE 163 N -1.80 2.68 -0.10 5.22 0.08 -0.76 -3.38 117.98 119.92 2b39 s PHE 163 Ca 0.08 -1.64 -0.02 0.00 0.12 0.00 0.00 56.93 55.48 2b39 s PHE 163 Cb -0.07 -1.83 -0.03 0.00 -0.57 0.00 0.00 43.02 40.52 2b39 s PHE 163 CO 0.04 -0.78 -0.03 0.42 -0.10 0.00 0.00 175.22 174.76 2b39 s ILE 164 N 1.32 4.02 -0.15 0.64 1.09 -0.13 -2.59 121.20 125.40 2b39 s ILE 164 Ca 0.03 -0.34 -0.04 0.00 -1.10 0.00 0.00 60.65 59.19 2b39 s ILE 164 Cb -0.14 -2.70 0.05 0.00 -1.06 0.00 0.00 42.46 38.61 2b39 s ILE 164 CO -0.11 0.57 0.07 0.42 -0.10 0.00 0.00 174.94 175.79 2b39 s THR 165 N -0.46 0.00 0.08 2.92 -4.23 -0.63 -0.65 115.64 112.67 2b39 s THR 165 Ca 0.08 -0.09 -0.31 0.00 -1.18 0.00 0.00 61.69 60.19 2b39 s THR 165 Cb -0.12 -0.55 -0.06 0.00 1.34 0.00 0.00 72.50 73.10 2b39 s THR 165 CO 0.02 -0.17 1.28 -0.63 -0.54 0.00 0.00 174.62 174.59 2b39 s ILE 166 N 2.10 3.74 0.03 2.99 1.01 -0.98 -2.33 121.20 127.77 2b39 s ILE 166 Ca 0.02 1.24 0.07 0.00 0.00 0.00 0.00 60.65 61.99 2b39 s ILE 166 Cb -0.15 -3.80 -0.03 0.00 0.01 0.00 0.00 42.46 38.49 2b39 s ILE 166 CO -0.08 0.09 -0.18 -1.61 0.00 0.00 0.00 174.94 173.16 2b39 s GLU 167 N 1.14 2.09 0.86 2.79 2.02 -0.65 -1.18 118.70 125.78 2b39 s GLU 167 Ca 0.61 -0.97 -0.11 0.00 0.02 0.00 0.00 54.97 54.53 2b39 s GLU 167 Cb -0.32 -2.19 0.11 0.00 0.10 0.00 0.00 34.13 31.83 2b39 s GLU 167 CO 0.29 0.55 1.09 0.95 0.02 0.00 0.00 175.26 178.16 2b39 s THR 168 N -0.90 2.83 -1.35 3.63 -4.23 -0.96 -2.89 115.64 111.77 2b39 s THR 168 Ca 0.14 0.27 0.00 0.00 -1.18 0.00 0.00 61.69 60.92 2b39 s THR 168 Cb -0.10 -2.69 0.00 0.00 1.34 0.00 0.00 72.50 71.04 2b39 s THR 168 CO 0.05 -0.35 0.83 -0.81 -0.54 0.00 0.00 174.62 173.80 2b39 n PRO 169 N -3.82 0.00 -0.79 3.99 -0.04 -1.26 -0.58 135.00 132.49 2b39 n PRO 169 Ca 0.08 0.32 -0.04 0.00 -0.04 0.00 0.00 63.50 63.83 2b39 n PRO 169 Cb 0.54 -1.50 0.20 0.00 -0.04 0.00 0.00 33.50 32.70 2b39 n PRO 169 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 2b39 n ASP 170 N -1.33 2.54 0.00 3.54 8.00 -1.26 -4.85 116.55 123.19 2b39 n ASP 170 Ca 0.00 -3.74 0.00 0.00 0.71 0.00 0.00 54.79 51.76 2b39 n ASP 170 Cb 0.00 -0.63 0.00 0.00 -0.02 0.00 0.00 41.12 40.47 2b39 n ASP 170 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2b39 n GLY 171 N -1.10 -0.63 1.82 0.44 0.00 0.25 -5.03 105.19 100.94 2b39 n GLY 171 Ca 0.33 -1.13 -0.01 0.00 0.00 0.00 0.00 46.02 45.21 2b39 n GLY 171 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2b39 n ILE 172 N 0.00 -5.26 -0.60 -0.61 5.41 -1.26 -2.28 119.36 114.77 2b39 n ILE 172 Ca 0.00 0.64 -0.31 0.00 1.00 0.00 0.00 62.75 64.08 2b39 n ILE 172 Cb 0.00 -4.61 0.21 0.00 -0.71 0.00 0.00 39.64 34.53 2b39 n ILE 172 CO 0.00 0.00 0.00 -0.81 0.00 0.00 0.00 176.55 175.74 2b39 n PRO 173 N 0.33 -1.89 0.00 0.38 -0.04 -1.26 -2.30 135.00 130.21 2b39 n PRO 173 Ca -0.06 -0.53 0.00 0.00 -0.04 0.00 0.00 63.50 62.88 2b39 n PRO 173 Cb 0.09 -1.90 0.00 0.00 -0.04 0.00 0.00 33.50 31.64 2b39 n PRO 173 CO 0.00 0.00 0.00 1.55 -0.04 0.00 0.00 175.50 177.01 2b39 n VAL 174 N -4.62 0.00 -3.47 0.52 3.14 -0.32 -4.72 118.33 108.86 2b39 n VAL 174 Ca 0.02 0.00 0.01 0.00 -2.96 0.00 0.00 64.34 61.41 2b39 n VAL 174 Cb 0.58 0.24 -0.05 0.00 -1.06 0.00 0.00 33.84 33.55 2b39 n VAL 174 CO 0.00 0.00 0.00 -0.75 -6.46 0.00 0.00 176.83 169.62 2b39 s LYS 175 N 0.00 0.23 -0.14 1.45 2.20 -1.23 -4.95 119.74 117.30 2b39 s LYS 175 Ca 0.00 0.50 0.02 0.00 -0.36 0.00 0.00 55.97 56.13 2b39 s LYS 175 Cb 0.00 0.21 0.01 0.00 -1.51 0.00 0.00 37.83 36.53 2b39 s LYS 175 CO 0.00 -0.07 -0.21 1.03 -0.36 0.00 0.00 175.35 175.75 2b39 s ARG 176 N 1.85 3.06 -0.16 4.03 0.52 -1.26 -2.31 118.95 124.68 2b39 s ARG 176 Ca -0.05 -0.84 0.01 0.00 -0.52 0.00 0.00 55.73 54.34 2b39 s ARG 176 Cb -0.04 -2.46 0.01 0.00 0.52 0.00 0.00 34.95 32.98 2b39 s ARG 176 CO -0.15 0.01 -0.19 -0.51 0.02 0.00 0.00 175.30 174.47 2b39 s ASP 177 N 0.77 3.26 -0.69 0.23 1.01 0.18 -5.00 116.67 116.42 2b39 s ASP 177 Ca -0.08 -0.59 0.05 0.00 0.71 0.00 0.00 52.55 52.64 2b39 s ASP 177 Cb -0.16 -1.49 0.18 0.00 1.01 0.00 0.00 42.92 42.46 2b39 s ASP 177 CO -0.01 0.05 0.51 -0.24 0.21 0.00 0.00 175.17 175.70 2b39 n SER 178 N 4.28 2.96 -4.42 0.27 2.88 -1.26 -0.96 113.62 117.36 2b39 n SER 178 Ca -0.20 -3.20 -0.30 0.00 -1.33 0.00 0.00 58.87 53.84 2b39 n SER 178 Cb 0.51 -0.74 -0.13 0.00 -0.75 0.00 0.00 64.21 63.10 2b39 n SER 178 CO 0.00 0.00 0.00 -0.54 -1.23 0.00 0.00 175.04 173.27 2b39 s LYS 179 N -1.51 1.84 -0.06 -1.46 1.02 -1.22 -5.02 119.74 113.33 2b39 s LYS 179 Ca 0.26 -1.11 0.02 0.00 0.02 0.00 0.00 55.97 55.17 2b39 s LYS 179 Cb -0.02 -2.07 -0.03 0.00 -0.52 0.00 0.00 37.83 35.19 2b39 s LYS 179 CO -0.16 0.51 -0.12 0.45 -0.92 0.00 0.00 175.35 175.11 2b39 s SER 180 N -1.62 4.19 -0.14 2.83 0.15 -1.26 -3.27 113.70 114.58 2b39 s SER 180 Ca 0.14 -0.16 0.05 0.00 0.70 0.00 0.00 55.95 56.67 2b39 s SER 180 Cb -0.10 -1.01 0.33 0.00 -1.71 0.00 0.00 66.02 63.53 2b39 s SER 180 CO 0.05 0.33 1.17 -1.54 1.20 0.00 0.00 173.24 174.46 2b39 n SER 181 N 2.42 3.16 0.02 5.45 3.41 -1.08 -4.40 113.62 122.62 2b39 n SER 181 Ca -0.17 -2.51 0.11 0.00 -0.26 0.00 0.00 58.87 56.04 2b39 n SER 181 Cb 0.52 -0.61 0.07 0.00 -0.26 0.00 0.00 64.21 63.94 2b39 n SER 181 CO 0.00 0.00 0.00 1.67 -0.16 0.00 0.00 175.04 176.55 2b39 n GLN 182 N 0.10 0.22 -0.07 4.33 -0.06 -1.24 -2.91 117.38 117.75 2b39 n GLN 182 Ca 0.17 0.01 -0.06 0.00 -2.00 0.00 0.00 57.00 55.12 2b39 n GLN 182 Cb 0.79 -1.58 -0.03 0.00 -4.06 0.00 0.00 30.24 25.36 2b39 n GLN 182 CO 0.00 0.00 0.00 -0.97 -0.20 0.00 0.00 177.06 175.89 2b39 h ASN 183 N 0.00 0.00 -2.54 1.69 -0.00 -1.93 -3.40 115.58 109.40 2b39 h ASN 183 Ca 0.00 -0.10 -0.65 0.00 -0.00 0.00 0.00 56.30 55.55 2b39 h ASN 183 Cb 0.68 0.00 -0.15 0.00 -0.00 0.00 0.00 38.32 38.85 2b39 h ASN 183 CO 0.00 0.79 0.65 -1.10 -0.00 0.00 0.00 177.43 177.76 2b39 s GLN 184 N -2.08 3.25 -0.63 6.67 1.11 -1.26 -4.98 119.66 121.74 2b39 s GLN 184 Ca -0.13 -1.09 -0.26 0.00 0.01 0.00 0.00 55.36 53.89 2b39 s GLN 184 Cb 0.02 -4.45 -0.10 0.00 -1.01 0.00 0.00 33.01 27.46 2b39 s GLN 184 CO 0.23 -1.82 2.42 1.19 0.01 0.00 0.00 175.29 177.32 2b39 n PHE 185 N 7.43 1.30 0.00 0.91 3.72 -1.23 -4.04 117.46 125.55 2b39 n PHE 185 Ca 0.05 0.06 0.00 0.00 -0.05 0.00 0.00 57.45 57.51 2b39 n PHE 185 Cb 0.46 -2.62 0.00 0.00 -0.94 0.00 0.00 39.48 36.38 2b39 n PHE 185 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2b39 n GLY 186 N 6.37 2.97 2.95 1.37 0.00 -1.15 -4.96 105.19 112.74 2b39 n GLY 186 Ca 0.42 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 46.15 2b39 n GLY 186 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2b39 s ILE 187 N -1.06 1.30 -0.26 -0.61 1.01 -1.26 -2.89 121.20 117.44 2b39 s ILE 187 Ca 0.00 -0.60 -0.14 0.00 0.00 0.00 0.00 60.65 59.91 2b39 s ILE 187 Cb 0.00 -1.34 -0.04 0.00 0.01 0.00 0.00 42.46 41.09 2b39 s ILE 187 CO 0.00 0.29 0.35 -0.76 0.00 0.00 0.00 174.94 174.82 2b39 s LEU 188 N 1.57 4.06 -0.21 2.97 1.43 -0.71 -4.93 118.68 122.86 2b39 s LEU 188 Ca 0.03 0.30 -0.07 0.00 -1.03 0.00 0.00 54.13 53.36 2b39 s LEU 188 Cb -0.14 -2.40 -0.03 0.00 0.03 0.00 0.00 46.19 43.65 2b39 s LEU 188 CO -0.09 -0.14 0.05 0.42 0.23 0.00 0.00 176.35 176.82 2b39 s THR 189 N 1.84 4.38 0.38 5.49 -4.23 -1.26 -1.23 115.64 121.00 2b39 s THR 189 Ca 0.15 -0.16 0.03 0.00 -1.18 0.00 0.00 61.69 60.52 2b39 s THR 189 Cb -0.15 -3.00 -0.01 0.00 1.34 0.00 0.00 72.50 70.67 2b39 s THR 189 CO 0.09 0.40 0.10 0.18 -0.54 0.00 0.00 174.62 174.85 2b39 n LEU 190 N 4.30 0.00 -3.57 4.79 4.77 -0.85 -5.03 117.00 121.40 2b39 n LEU 190 Ca -0.16 -2.78 -0.06 0.00 -0.03 0.00 0.00 56.01 52.97 2b39 n LEU 190 Cb 0.52 0.79 -0.02 0.00 -2.33 0.00 0.00 43.42 42.37 2b39 n LEU 190 CO 0.32 -0.42 0.92 -0.94 -1.33 0.00 0.00 177.39 175.94 2b39 s SER 191 N -3.28 -0.21 -0.16 -1.43 1.04 -1.26 -3.43 113.70 104.98 2b39 s SER 191 Ca 0.14 0.05 -0.09 0.00 0.48 0.00 0.00 55.95 56.53 2b39 s SER 191 Cb 0.01 0.21 0.05 0.00 0.10 0.00 0.00 66.02 66.39 2b39 s SER 191 CO 0.10 -0.32 0.38 0.86 0.98 0.00 0.00 173.24 175.24 2b39 s TRP 192 N -2.34 -0.54 -0.21 5.02 -0.00 -0.67 -5.00 118.94 115.20 2b39 s TRP 192 Ca 0.07 1.18 -0.17 0.00 -0.00 0.00 0.00 56.10 57.18 2b39 s TRP 192 Cb -0.01 0.22 -0.03 0.00 -0.00 0.00 0.00 33.47 33.64 2b39 s TRP 192 CO -0.05 -0.31 0.47 -0.80 -0.00 0.00 0.00 176.95 176.26 2b39 s ASN 193 N 1.20 6.49 -0.06 5.86 0.02 -1.26 0.03 114.94 127.22 2b39 s ASN 193 Ca -0.08 0.59 -0.30 0.00 -1.02 0.00 0.00 52.86 52.05 2b39 s ASN 193 Cb -0.08 -2.27 -0.03 0.00 0.02 0.00 0.00 41.25 38.89 2b39 s ASN 193 CO -0.10 -0.16 1.23 -0.63 0.02 0.00 0.00 177.10 177.46 2b39 s ILE 194 N 1.62 4.21 0.58 0.60 1.01 -0.97 -4.95 121.20 123.30 2b39 s ILE 194 Ca 0.22 1.53 -0.19 0.00 0.00 0.00 0.00 60.65 62.21 2b39 s ILE 194 Cb -0.15 -3.98 -0.04 0.00 0.01 0.00 0.00 42.46 38.29 2b39 s ILE 194 CO 0.09 -0.02 1.18 -2.16 0.00 0.00 0.00 174.94 174.04 2b39 s PRO 195 N 2.39 3.07 0.58 2.79 0.04 -1.25 -4.15 135.00 138.47 2b39 s PRO 195 Ca 0.56 1.75 0.30 0.00 0.04 0.00 0.00 61.00 63.66 2b39 s PRO 195 Cb -0.25 -1.95 1.44 0.00 0.04 0.00 0.00 34.50 33.78 2b39 s PRO 195 CO 0.21 -1.11 1.84 1.05 0.04 0.00 0.00 177.00 179.04 2b39 h GLU 196 N 0.94 0.00 -6.13 4.56 4.11 -1.91 -3.38 114.58 112.77 2b39 h GLU 196 Ca -0.50 0.00 -0.64 0.00 0.07 0.00 0.00 59.36 58.29 2b39 h GLU 196 Cb 1.29 0.00 -0.30 0.00 0.50 0.00 0.00 28.75 30.24 2b39 h GLU 196 CO 0.56 0.00 -0.87 -1.17 0.07 0.00 0.00 179.01 177.60 2b39 s LEU 197 N -7.62 2.04 -0.24 3.06 2.96 -1.26 -4.68 118.68 112.93 2b39 s LEU 197 Ca -0.04 -0.42 -0.35 0.00 -0.22 0.00 0.00 54.13 53.10 2b39 s LEU 197 Cb 0.17 -1.18 0.15 0.00 0.50 0.00 0.00 46.19 45.83 2b39 s LEU 197 CO 0.60 0.26 1.29 0.54 -1.32 0.00 0.00 176.35 177.72 2b39 s VAL 198 N -0.43 0.00 0.06 1.68 0.11 -1.26 -4.37 120.40 116.19 2b39 s VAL 198 Ca 0.06 0.00 -0.37 0.00 -2.93 0.00 0.00 61.98 58.74 2b39 s VAL 198 Cb -0.10 -1.00 -0.16 0.00 -1.53 0.00 0.00 36.38 33.59 2b39 s VAL 198 CO 0.00 0.00 1.41 0.59 -3.33 0.00 0.00 175.10 173.77 2b39 n ASN 199 N 0.08 1.91 -4.84 3.54 3.02 -1.26 -4.91 115.26 112.80 2b39 n ASN 199 Ca 0.02 1.11 -0.37 0.00 -0.03 0.00 0.00 54.58 55.31 2b39 n ASN 199 Cb 0.58 -1.22 -0.06 0.00 -0.61 0.00 0.00 39.78 38.47 2b39 n ASN 199 CO 0.00 0.00 0.00 -0.32 -2.62 0.00 0.00 177.26 174.32 2b39 s MET 200 N 0.84 3.94 0.00 3.52 1.75 -1.26 -4.89 119.30 123.20 2b39 s MET 200 Ca 0.85 0.43 0.00 0.00 -1.25 0.00 0.00 55.69 55.72 2b39 s MET 200 Cb -0.93 -3.11 0.00 0.00 2.84 0.00 0.00 34.83 33.63 2b39 s MET 200 CO 0.47 0.61 0.00 0.41 -0.65 0.00 0.00 175.02 175.86 2b39 n GLY 201 N 1.38 0.60 3.38 2.11 0.00 -0.52 -4.88 105.19 107.26 2b39 n GLY 201 Ca -0.10 -1.86 -0.45 0.00 0.00 0.00 0.00 46.02 43.60 2b39 n GLY 201 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2b39 s VAL 202 N -2.15 5.50 1.01 1.61 1.01 -1.26 -1.55 120.40 124.58 2b39 s VAL 202 Ca 0.00 -2.72 -0.12 0.00 0.00 0.00 0.00 61.98 59.14 2b39 s VAL 202 Cb 0.00 -4.66 0.19 0.00 0.00 0.00 0.00 36.38 31.92 2b39 s VAL 202 CO 0.00 -1.28 1.08 0.26 0.00 0.00 0.00 175.10 175.16 2b39 s TRP 203 N 0.32 1.85 -0.10 5.22 0.52 -0.69 -4.48 118.94 121.59 2b39 s TRP 203 Ca 0.30 1.26 -0.04 0.00 0.02 0.00 0.00 56.10 57.64 2b39 s TRP 203 Cb -0.08 -3.18 0.05 0.00 -1.15 0.00 0.00 33.47 29.11 2b39 s TRP 203 CO -0.07 -3.04 0.20 0.15 0.02 0.00 0.00 176.95 174.21 2b39 s LYS 204 N -4.74 0.10 0.47 4.98 1.02 -1.14 -2.16 119.74 118.27 2b39 s LYS 204 Ca 0.66 0.57 -0.16 0.00 0.02 0.00 0.00 55.97 57.06 2b39 s LYS 204 Cb -0.21 -0.17 -0.08 0.00 -0.52 0.00 0.00 37.83 36.85 2b39 s LYS 204 CO 0.60 -0.25 0.92 0.42 -0.92 0.00 0.00 175.35 176.12 2b39 s ILE 205 N 1.93 4.57 -0.28 2.17 1.01 -1.13 -1.63 121.20 127.85 2b39 s ILE 205 Ca -0.02 1.12 0.01 0.00 0.00 0.00 0.00 60.65 61.76 2b39 s ILE 205 Cb -0.12 -3.70 0.15 0.00 0.01 0.00 0.00 42.46 38.81 2b39 s ILE 205 CO -0.07 -0.57 0.40 -0.75 0.00 0.00 0.00 174.94 173.95 2b39 s LYS 206 N -3.83 0.39 0.16 2.79 2.20 -0.98 -2.72 119.74 117.75 2b39 s LYS 206 Ca 0.57 0.23 0.10 0.00 -0.36 0.00 0.00 55.97 56.52 2b39 s LYS 206 Cb -0.10 -0.36 -0.04 0.00 -1.51 0.00 0.00 37.83 35.82 2b39 s LYS 206 CO 0.28 -0.93 -0.18 0.00 -0.36 0.00 0.00 175.35 174.16 2b39 s ALA 207 N 2.54 2.70 0.02 3.13 0.00 -0.76 -1.61 121.76 127.78 2b39 s ALA 207 Ca 0.11 -1.49 -0.16 0.00 0.00 0.00 0.00 51.96 50.42 2b39 s ALA 207 Cb -0.13 -0.56 0.03 0.00 0.00 0.00 0.00 23.12 22.45 2b39 s ALA 207 CO -0.27 0.50 0.36 1.52 0.00 0.00 0.00 175.76 177.87 2b39 s TYR 208 N -1.48 -0.20 0.52 0.00 1.13 -1.07 0.95 117.35 117.20 2b39 s TYR 208 Ca 0.21 0.20 -0.20 0.00 -1.41 0.00 0.00 57.07 55.87 2b39 s TYR 208 Cb -0.09 0.15 -0.06 0.00 -1.10 0.00 0.00 41.96 40.85 2b39 s TYR 208 CO 0.11 -0.49 1.12 0.71 -2.51 0.00 0.00 175.55 174.49 2b39 s TYR 209 N -2.07 2.74 0.03 -3.49 1.51 -1.26 -1.83 117.35 112.98 2b39 s TYR 209 Ca -0.08 1.55 -0.23 0.00 -1.01 0.00 0.00 57.07 57.30 2b39 s TYR 209 Cb -0.02 -3.28 -0.12 0.00 -0.11 0.00 0.00 41.96 38.43 2b39 s TYR 209 CO 0.00 -1.48 1.28 1.49 -1.11 0.00 0.00 175.55 175.74 2b39 h GLU 210 N 1.36 -0.78 0.00 -0.62 4.81 -0.33 -3.12 114.58 115.90 2b39 h GLU 210 Ca -0.50 0.05 0.00 0.00 -0.13 0.00 0.00 59.36 58.78 2b39 h GLU 210 Cb 1.26 0.18 0.00 0.00 0.63 0.00 0.00 28.75 30.81 2b39 h GLU 210 CO 0.58 -0.52 0.00 -0.25 -0.73 0.00 0.00 179.01 178.08 2b39 n ASP 211 N -4.28 0.00 -3.06 1.04 8.00 -1.26 -3.62 116.55 113.36 2b39 n ASP 211 Ca -0.10 -0.20 -0.14 0.00 0.71 0.00 0.00 54.79 55.06 2b39 n ASP 211 Cb 0.32 0.00 -0.04 0.00 -0.02 0.00 0.00 41.12 41.38 2b39 n ASP 211 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 2b39 s SER 212 N -1.94 -0.15 0.00 -2.24 1.04 -1.18 -5.01 113.70 104.22 2b39 s SER 212 Ca 0.05 -2.21 0.01 0.00 0.48 0.00 0.00 55.95 54.28 2b39 s SER 212 Cb 0.02 0.90 0.07 0.00 0.10 0.00 0.00 66.02 67.11 2b39 s SER 212 CO 0.03 -0.12 0.89 -0.81 0.98 0.00 0.00 173.24 174.22 2b39 n PRO 213 N 3.05 0.01 -2.13 4.02 -0.04 -1.24 -4.14 135.00 134.54 2b39 n PRO 213 Ca 0.22 0.32 -0.27 0.00 -0.04 0.00 0.00 63.50 63.73 2b39 n PRO 213 Cb 0.52 -1.50 0.09 0.00 -0.04 0.00 0.00 33.50 32.57 2b39 n PRO 213 CO 0.00 0.00 0.00 -0.65 -0.04 0.00 0.00 175.50 174.81 2b39 s GLN 214 N -2.67 1.92 -0.11 0.54 -1.52 -1.26 -4.56 119.66 111.99 2b39 s GLN 214 Ca 0.01 -0.25 -0.10 0.00 -1.95 0.00 0.00 55.36 53.07 2b39 s GLN 214 Cb 0.01 -2.09 0.01 0.00 -0.22 0.00 0.00 33.01 30.72 2b39 s GLN 214 CO 0.02 -1.47 0.17 1.04 -0.25 0.00 0.00 175.29 174.80 2b39 n GLN 215 N -3.10 -0.63 -3.52 2.91 1.13 -1.26 -4.82 117.38 108.08 2b39 n GLN 215 Ca 0.09 0.82 -0.31 0.00 -1.94 0.00 0.00 57.00 55.66 2b39 n GLN 215 Cb 0.60 -1.09 -0.05 0.00 0.11 0.00 0.00 30.24 29.82 2b39 n GLN 215 CO 0.00 0.00 0.00 0.08 -1.44 0.00 0.00 177.06 175.70 2b39 s VAL 216 N -0.97 5.04 -0.25 5.09 1.01 -1.26 -4.81 120.40 124.26 2b39 s VAL 216 Ca 0.10 0.23 -0.11 0.00 0.00 0.00 0.00 61.98 62.20 2b39 s VAL 216 Cb -0.01 -3.63 -0.05 0.00 0.00 0.00 0.00 36.38 32.69 2b39 s VAL 216 CO 0.22 -0.05 0.19 -0.36 0.00 0.00 0.00 175.10 175.10 2b39 s PHE 217 N -1.78 3.29 0.35 5.22 0.08 0.27 -4.96 117.98 120.45 2b39 s PHE 217 Ca 0.44 0.23 -0.03 0.00 0.12 0.00 0.00 56.93 57.69 2b39 s PHE 217 Cb -0.12 -2.33 0.07 0.00 -0.57 0.00 0.00 43.02 40.08 2b39 s PHE 217 CO 0.24 -0.02 0.47 0.43 -0.10 0.00 0.00 175.22 176.24 2b39 n SER 218 N 4.56 0.31 0.00 1.36 7.64 -1.26 -1.83 113.62 124.40 2b39 n SER 218 Ca -0.14 -1.34 0.00 0.00 1.01 0.00 0.00 58.87 58.40 2b39 n SER 218 Cb 0.52 -0.34 0.00 0.00 -1.01 0.00 0.00 64.21 63.38 2b39 n SER 218 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2b39 n ALA 219 N -3.15 0.00 -0.62 -0.43 0.00 -1.10 -4.76 120.51 110.46 2b39 n ALA 219 Ca -0.08 0.00 -0.30 0.00 0.00 0.00 0.00 53.44 53.06 2b39 n ALA 219 Cb 0.24 0.00 0.19 0.00 0.00 0.00 0.00 19.45 19.88 2b39 n ALA 219 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2b39 n GLU 220 N 0.00 -1.05 -3.62 0.00 1.02 -1.26 -2.83 120.64 112.91 2b39 n GLU 220 Ca 0.00 -0.25 -0.08 0.00 -0.02 0.00 0.00 57.16 56.81 2b39 n GLU 220 Cb 0.00 -2.29 -0.06 0.00 -0.02 0.00 0.00 31.44 29.07 2b39 n GLU 220 CO 0.00 0.00 0.00 -0.59 1.18 0.00 0.00 177.13 177.72 2b39 s PHE 221 N -2.56 -0.30 0.06 -0.32 -0.12 -0.92 -4.90 117.98 108.92 2b39 s PHE 221 Ca 0.67 0.64 0.01 0.00 -0.05 0.00 0.00 56.93 58.20 2b39 s PHE 221 Cb -0.24 0.43 -0.04 0.00 -0.63 0.00 0.00 43.02 42.55 2b39 s PHE 221 CO 0.60 -0.21 0.14 -2.00 -0.05 0.00 0.00 175.22 173.71 2b39 s GLU 222 N -0.47 3.16 -0.22 1.99 2.12 0.21 -1.70 118.70 123.79 2b39 s GLU 222 Ca 0.03 -0.55 0.01 0.00 0.36 0.00 0.00 54.97 54.82 2b39 s GLU 222 Cb -0.03 -2.89 0.05 0.00 0.26 0.00 0.00 34.13 31.52 2b39 s GLU 222 CO -0.05 0.60 -0.08 0.08 -0.54 0.00 0.00 175.26 175.26 2b39 s VAL 223 N -1.42 1.61 0.11 3.70 1.01 -0.59 0.69 120.40 125.51 2b39 s VAL 223 Ca 0.31 -1.12 0.01 0.00 0.00 0.00 0.00 61.98 61.18 2b39 s VAL 223 Cb -0.13 -1.77 0.01 0.00 0.00 0.00 0.00 36.38 34.49 2b39 s VAL 223 CO 0.24 0.05 0.08 0.29 0.00 0.00 0.00 175.10 175.75 2b39 n LYS 224 N 4.67 1.37 -4.13 2.72 5.02 0.25 -1.44 118.16 126.62 2b39 n LYS 224 Ca -0.13 -0.70 -0.27 0.00 -2.02 0.00 0.00 58.31 55.19 2b39 n LYS 224 Cb 0.45 0.09 -0.07 0.00 -0.02 0.00 0.00 35.03 35.48 2b39 n LYS 224 CO 0.00 0.00 0.00 -1.83 -0.52 0.00 0.00 177.40 175.05 2b39 s GLU 225 N -2.45 2.70 -0.37 1.97 -1.05 -1.26 -3.96 118.70 114.28 2b39 s GLU 225 Ca 0.06 -0.93 -0.44 0.00 -0.15 0.00 0.00 54.97 53.51 2b39 s GLU 225 Cb -0.00 -2.54 -0.18 0.00 -0.44 0.00 0.00 34.13 30.96 2b39 s GLU 225 CO 0.04 0.49 1.63 0.98 0.95 0.00 0.00 175.26 179.34 2b39 n TYR 226 N -0.12 1.83 -3.75 4.83 9.36 -1.26 -4.71 117.16 123.34 2b39 n TYR 226 Ca -0.09 0.87 -0.23 0.00 3.32 0.00 0.00 57.90 61.77 2b39 n TYR 226 Cb 0.54 -2.32 -0.18 0.00 -0.63 0.00 0.00 39.34 36.75 2b39 n TYR 226 CO 0.00 0.00 0.00 0.08 0.22 0.00 0.00 176.86 177.16 2b39 s VAL 227 N 3.02 0.31 -0.49 2.97 1.01 -1.26 -4.99 120.40 120.97 2b39 s VAL 227 Ca 1.01 0.11 0.06 0.00 0.00 0.00 0.00 61.98 63.16 2b39 s VAL 227 Cb -1.29 -0.52 0.38 0.00 0.00 0.00 0.00 36.38 34.95 2b39 s VAL 227 CO 0.73 0.21 1.00 -0.11 0.00 0.00 0.00 175.10 176.93 2b39 n LEU 228 N 5.16 4.13 -4.63 3.92 0.00 -1.26 -2.72 117.00 121.61 2b39 n LEU 228 Ca -0.07 -5.31 -0.56 0.00 0.00 0.00 0.00 56.01 50.08 2b39 n LEU 228 Cb 0.50 -0.36 -0.07 0.00 0.00 0.00 0.00 43.42 43.48 2b39 n LEU 228 CO 0.10 2.25 1.46 -0.81 0.00 0.00 0.00 177.39 180.39 2b39 n PRO 229 N -0.30 1.10 0.02 1.96 -0.04 -1.26 -4.75 135.00 131.73 2b39 n PRO 229 Ca 0.33 0.38 0.22 0.00 -0.04 0.00 0.00 63.50 64.39 2b39 n PRO 229 Cb 0.55 -2.16 0.72 0.00 -0.04 0.00 0.00 33.50 32.58 2b39 n PRO 229 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2b39 h SER 230 N 8.43 0.00 -5.31 3.54 4.64 -1.98 -3.42 113.55 119.45 2b39 h SER 230 Ca -0.40 0.00 -0.11 0.00 -0.47 0.00 0.00 61.79 60.80 2b39 h SER 230 Cb 1.32 0.00 -0.12 0.00 -0.31 0.00 0.00 62.40 63.30 2b39 h SER 230 CO 0.98 0.00 -0.31 0.72 -0.87 0.00 0.00 176.83 177.36 2b39 s PHE 231 N -4.68 0.52 -0.08 4.77 -0.12 -1.26 -4.24 117.98 112.88 2b39 s PHE 231 Ca -0.04 -0.86 -0.01 0.00 -0.05 0.00 0.00 56.93 55.97 2b39 s PHE 231 Cb 0.17 -0.06 -0.03 0.00 -0.63 0.00 0.00 43.02 42.46 2b39 s PHE 231 CO 0.59 -0.80 -0.03 -2.00 -0.05 0.00 0.00 175.22 172.93 2b39 s GLU 232 N -4.02 2.93 -0.16 1.99 2.12 0.15 -4.92 118.70 116.79 2b39 s GLU 232 Ca 0.23 -0.48 0.00 0.00 0.36 0.00 0.00 54.97 55.08 2b39 s GLU 232 Cb 0.03 -2.71 0.03 0.00 0.26 0.00 0.00 34.13 31.73 2b39 s GLU 232 CO 0.05 0.65 -0.12 0.08 -0.54 0.00 0.00 175.26 175.38 2b39 s VAL 233 N -0.76 1.55 -0.13 3.70 1.01 -1.26 -1.45 120.40 123.07 2b39 s VAL 233 Ca 0.12 -0.72 -0.04 0.00 0.00 0.00 0.00 61.98 61.33 2b39 s VAL 233 Cb -0.11 -1.52 -0.03 0.00 0.00 0.00 0.00 36.38 34.71 2b39 s VAL 233 CO 0.02 0.36 0.02 -1.10 0.00 0.00 0.00 175.10 174.40 2b39 s GLN 234 N 1.48 3.40 -0.14 2.72 -0.21 0.32 -4.86 119.66 122.36 2b39 s GLN 234 Ca 0.03 -0.39 0.00 0.00 0.02 0.00 0.00 55.36 55.03 2b39 s GLN 234 Cb -0.14 -2.96 0.02 0.00 1.00 0.00 0.00 33.01 30.94 2b39 s GLN 234 CO -0.10 0.52 -0.13 -0.51 -2.12 0.00 0.00 175.29 172.95 2b39 s LEU 235 N -0.36 1.62 -0.04 2.90 1.43 -1.26 -0.92 118.68 122.05 2b39 s LEU 235 Ca 0.08 -0.45 -0.05 0.00 -1.03 0.00 0.00 54.13 52.68 2b39 s LEU 235 Cb -0.12 -1.11 0.01 0.00 0.03 0.00 0.00 46.19 45.00 2b39 s LEU 235 CO 0.02 -0.05 0.13 -1.61 0.23 0.00 0.00 176.35 175.07 2b39 s GLU 236 N 1.42 0.22 0.00 1.70 0.41 -0.94 -4.82 118.70 116.69 2b39 s GLU 236 Ca 0.03 0.05 0.00 0.00 -0.41 0.00 0.00 54.97 54.64 2b39 s GLU 236 Cb -0.13 0.10 0.00 0.00 -1.78 0.00 0.00 34.13 32.32 2b39 s GLU 236 CO -0.09 -0.04 0.00 -0.35 -0.49 0.00 0.00 175.26 174.30 2b39 n PRO 237 N 2.68 0.84 0.00 0.39 -0.04 -1.26 0.11 135.00 137.72 2b39 n PRO 237 Ca -0.15 0.00 0.05 0.00 -0.04 0.00 0.00 63.50 63.36 2b39 n PRO 237 Cb 0.58 0.00 0.01 0.00 -0.04 0.00 0.00 33.50 34.06 2b39 n PRO 237 CO 0.00 0.00 0.00 -0.85 -0.04 0.00 0.00 175.50 174.61 2b39 n GLU 238 N -0.11 1.53 0.00 0.54 0.28 -1.18 -3.88 120.64 117.81 2b39 n GLU 238 Ca 0.00 -0.74 0.00 0.00 -0.16 0.00 0.00 57.16 56.26 2b39 n GLU 238 Cb 0.00 -1.10 0.00 0.00 1.43 0.00 0.00 31.44 31.77 2b39 n GLU 238 CO 0.00 0.00 0.00 0.39 -0.16 0.00 0.00 177.13 177.36 2b39 n GLU 239 N 0.00 0.00 0.00 3.44 -0.58 -1.26 -5.07 120.64 117.18 2b39 n GLU 239 Ca 0.04 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.78 2b39 n GLU 239 Cb 0.21 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 31.08 2b39 n GLU 239 CO 0.00 0.00 0.00 1.17 -0.48 0.00 0.00 177.13 177.82 2b39 n LYS 240 N 0.00 0.19 -3.69 3.49 3.00 -1.26 -5.08 118.16 114.81 2b39 n LYS 240 Ca 0.00 -0.43 -0.08 0.00 -0.00 0.00 0.00 58.31 57.80 2b39 n LYS 240 Cb 0.00 -0.66 -0.02 0.00 0.00 0.00 0.00 35.03 34.35 2b39 n LYS 240 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.40 176.81 2b39 s PHE 241 N -0.13 -0.29 -0.09 5.64 -0.12 -1.26 -4.09 117.98 117.64 2b39 s PHE 241 Ca 0.00 -0.05 0.01 0.00 -0.05 0.00 0.00 56.93 56.84 2b39 s PHE 241 Cb 0.00 0.64 0.02 0.00 -0.63 0.00 0.00 43.02 43.05 2b39 s PHE 241 CO 0.00 -1.01 -0.11 -0.47 -0.05 0.00 0.00 175.22 173.58 2b39 s TYR 242 N -3.72 1.53 -0.21 3.49 5.04 -0.36 -4.98 117.35 118.13 2b39 s TYR 242 Ca 0.08 -0.66 -0.25 0.00 -2.44 0.00 0.00 57.07 53.80 2b39 s TYR 242 Cb -0.04 -1.17 -0.01 0.00 0.35 0.00 0.00 41.96 41.10 2b39 s TYR 242 CO -0.01 -0.39 0.83 -0.47 -1.34 0.00 0.00 175.55 174.18 2b39 s TYR 243 N 1.07 3.36 0.32 4.97 5.04 -1.26 -3.36 117.35 127.49 2b39 s TYR 243 Ca -0.07 1.19 0.26 0.00 -2.44 0.00 0.00 57.07 56.01 2b39 s TYR 243 Cb -0.15 -3.04 0.89 0.00 0.35 0.00 0.00 41.96 40.02 2b39 s TYR 243 CO -0.01 -0.34 0.86 -0.89 -1.34 0.00 0.00 175.55 173.83 2b39 n ILE 244 N 5.04 0.00 -4.54 3.14 5.41 -1.26 -4.25 119.36 122.90 2b39 n ILE 244 Ca 0.05 0.82 -0.34 0.00 1.00 0.00 0.00 62.75 64.29 2b39 n ILE 244 Cb 0.48 -1.39 -0.11 0.00 -0.71 0.00 0.00 39.64 37.90 2b39 n ILE 244 CO 0.00 0.00 0.00 -1.81 0.00 0.00 0.00 176.55 174.74 2b39 s ASP 245 N -3.78 4.73 0.00 4.38 1.01 -1.26 -5.07 116.67 116.68 2b39 s ASP 245 Ca -0.03 -0.05 0.00 0.00 0.71 0.00 0.00 52.55 53.19 2b39 s ASP 245 Cb 0.14 -1.41 0.00 0.00 1.01 0.00 0.00 42.92 42.66 2b39 s ASP 245 CO 0.46 0.30 0.00 0.47 0.21 0.00 0.00 175.17 176.61 2b39 n ASP 246 N 2.66 0.00 -0.00 0.27 8.00 -1.26 -4.96 116.55 121.26 2b39 n ASP 246 Ca -0.18 0.00 0.14 0.00 0.71 0.00 0.00 54.79 55.46 2b39 n ASP 246 Cb 0.53 0.00 0.61 0.00 -0.02 0.00 0.00 41.12 42.24 2b39 n ASP 246 CO 0.00 0.00 0.00 -0.81 -0.39 0.00 0.00 177.20 176.00 2b39 n PRO 247 N -0.32 0.07 0.00 -0.24 -0.04 -1.26 -4.14 135.00 129.07 2b39 n PRO 247 Ca 0.00 -0.01 0.00 0.00 -0.04 0.00 0.00 63.50 63.45 2b39 n PRO 247 Cb 0.00 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 31.96 2b39 n PRO 247 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 2b39 n ASP 248 N -1.46 0.00 0.00 3.54 8.00 -1.26 -4.84 116.55 120.53 2b39 n ASP 248 Ca 0.08 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.58 2b39 n ASP 248 Cb 0.33 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.43 2b39 n ASP 248 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2b39 n GLY 249 N 1.35 1.89 0.00 0.44 0.00 -1.26 -3.64 105.19 103.96 2b39 n GLY 249 Ca 0.00 -0.53 0.00 0.00 0.00 0.00 0.00 46.02 45.49 2b39 n GLY 249 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2b39 n LEU 250 N 0.00 0.00 -3.14 0.99 4.77 -1.26 -4.83 117.00 113.53 2b39 n LEU 250 Ca 0.00 0.00 -0.31 0.00 -0.03 0.00 0.00 56.01 55.67 2b39 n LEU 250 Cb 0.00 0.00 0.03 0.00 -2.33 0.00 0.00 43.42 41.12 2b39 n LEU 250 CO 0.00 0.00 -0.23 0.29 -1.33 0.00 0.00 177.39 176.12 2b39 n LYS 251 N -1.02 -1.55 -3.18 3.23 5.02 -1.26 -3.75 118.16 115.65 2b39 n LYS 251 Ca 0.00 1.10 -0.33 0.00 -2.02 0.00 0.00 58.31 57.05 2b39 n LYS 251 Cb 0.00 -1.66 -0.06 0.00 -0.02 0.00 0.00 35.03 33.29 2b39 n LYS 251 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 2b39 s VAL 252 N -1.41 4.70 -0.20 -0.18 1.01 -1.22 -3.12 120.40 119.98 2b39 s VAL 252 Ca 0.28 0.95 -0.10 0.00 0.00 0.00 0.00 61.98 63.11 2b39 s VAL 252 Cb -0.03 -3.67 -0.05 0.00 0.00 0.00 0.00 36.38 32.64 2b39 s VAL 252 CO 0.73 -0.07 0.13 0.20 0.00 0.00 0.00 175.10 176.08 2b39 s ASN 253 N -2.13 6.12 -0.21 3.32 0.01 0.30 -2.25 114.94 120.09 2b39 s ASN 253 Ca 0.50 0.19 -0.09 0.00 -0.71 0.00 0.00 52.86 52.75 2b39 s ASN 253 Cb -0.12 -2.08 -0.04 0.00 0.41 0.00 0.00 41.25 39.42 2b39 s ASN 253 CO 0.19 0.16 0.11 -0.63 -1.51 0.00 0.00 177.10 175.42 2b39 s ILE 254 N 0.47 5.07 -0.10 0.60 1.01 -1.18 -2.22 121.20 124.86 2b39 s ILE 254 Ca 0.07 0.07 0.00 0.00 0.00 0.00 0.00 60.65 60.80 2b39 s ILE 254 Cb -0.12 -3.32 0.02 0.00 0.01 0.00 0.00 42.46 39.05 2b39 s ILE 254 CO -0.01 0.41 -0.09 -0.63 0.00 0.00 0.00 174.94 174.63 2b39 s ILE 255 N 0.69 1.03 -0.26 2.92 1.01 -0.09 -1.98 121.20 124.52 2b39 s ILE 255 Ca 0.06 -0.33 -0.03 0.00 0.00 0.00 0.00 60.65 60.36 2b39 s ILE 255 Cb -0.13 -1.02 0.11 0.00 0.01 0.00 0.00 42.46 41.43 2b39 s ILE 255 CO 0.01 0.36 0.22 0.00 0.00 0.00 0.00 174.94 175.54 2b39 s ALA 256 N 1.42 -0.10 0.19 9.38 0.00 -1.20 0.12 121.76 131.56 2b39 s ALA 256 Ca -0.00 -0.34 0.08 0.00 0.00 0.00 0.00 51.96 51.70 2b39 s ALA 256 Cb -0.13 -1.53 -0.04 0.00 0.00 0.00 0.00 23.12 21.42 2b39 s ALA 256 CO -0.05 -1.53 -0.17 -0.98 0.00 0.00 0.00 175.76 173.03 2b39 s ARG 257 N 2.28 1.32 0.74 0.00 1.70 -0.52 -3.16 118.95 121.31 2b39 s ARG 257 Ca 0.08 -1.50 -0.12 0.00 -0.47 0.00 0.00 55.73 53.72 2b39 s ARG 257 Cb -0.15 -1.28 0.04 0.00 -0.57 0.00 0.00 34.95 33.00 2b39 s ARG 257 CO -0.27 0.24 1.11 -0.06 -1.08 0.00 0.00 175.30 175.24 2b39 s PHE 258 N -2.42 2.46 -2.00 5.89 0.08 -0.94 -0.67 117.98 120.38 2b39 s PHE 258 Ca 0.19 1.58 0.03 0.00 0.12 0.00 0.00 56.93 58.85 2b39 s PHE 258 Cb -0.04 -3.15 0.16 0.00 -0.57 0.00 0.00 43.02 39.42 2b39 s PHE 258 CO 0.07 -1.91 0.56 1.28 -0.10 0.00 0.00 175.22 175.12 2b39 n LEU 259 N -3.16 0.00 -1.53 -0.37 4.77 -1.26 -1.49 117.00 113.96 2b39 n LEU 259 Ca 0.10 0.00 0.02 0.00 -0.03 0.00 0.00 56.01 56.10 2b39 n LEU 259 Cb 0.52 0.00 0.07 0.00 -2.33 0.00 0.00 43.42 41.68 2b39 n LEU 259 CO 0.51 0.00 0.13 -1.22 -1.33 0.00 0.00 177.39 175.48 2b39 n TYR 260 N -0.60 0.39 -1.32 -1.77 4.01 -1.26 -4.99 117.16 111.62 2b39 n TYR 260 Ca 0.02 -1.11 -0.11 0.00 -0.16 0.00 0.00 57.90 56.54 2b39 n TYR 260 Cb 0.01 -0.20 -0.05 0.00 -0.31 0.00 0.00 39.34 38.79 2b39 n TYR 260 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2b39 n GLY 261 N -0.14 1.07 3.55 2.72 0.00 -0.56 -4.92 105.19 106.90 2b39 n GLY 261 Ca 0.12 -0.03 -0.42 0.00 0.00 0.00 0.00 46.02 45.69 2b39 n GLY 261 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2b39 s GLU 262 N -2.89 3.38 -0.02 1.61 0.41 -1.26 -4.83 118.70 115.10 2b39 s GLU 262 Ca 0.00 -0.06 -0.35 0.00 -0.41 0.00 0.00 54.97 54.15 2b39 s GLU 262 Cb 0.00 -4.07 -0.14 0.00 -1.78 0.00 0.00 34.13 28.15 2b39 s GLU 262 CO 0.00 -1.71 1.70 0.94 -0.49 0.00 0.00 175.26 175.70 2b39 n GLN 263 N 8.26 1.88 -2.27 1.61 -0.06 -1.26 -2.21 117.38 123.34 2b39 n GLN 263 Ca 0.05 0.69 -0.35 0.00 -2.00 0.00 0.00 57.00 55.39 2b39 n GLN 263 Cb 0.48 -2.46 -0.00 0.00 -4.06 0.00 0.00 30.24 24.20 2b39 n GLN 263 CO 0.00 0.00 0.00 0.08 -0.20 0.00 0.00 177.06 176.94 2b39 s VAL 264 N 2.59 3.30 -0.42 1.69 1.01 -1.19 -4.79 120.40 122.60 2b39 s VAL 264 Ca 0.88 0.79 0.05 0.00 0.00 0.00 0.00 61.98 63.71 2b39 s VAL 264 Cb -0.78 -3.31 0.17 0.00 0.00 0.00 0.00 36.38 32.46 2b39 s VAL 264 CO 0.49 -0.20 0.51 -0.62 0.00 0.00 0.00 175.10 175.29 2b39 s ASP 265 N -1.90 -0.03 0.00 3.32 -1.08 -1.26 -0.67 116.67 115.05 2b39 s ASP 265 Ca 0.71 -1.69 0.00 0.00 -0.52 0.00 0.00 52.55 51.05 2b39 s ASP 265 Cb -0.22 1.04 0.00 0.00 -1.46 0.00 0.00 42.92 42.28 2b39 s ASP 265 CO 0.27 -0.17 0.00 0.61 0.52 0.00 0.00 175.17 176.40 2b39 n GLY 266 N 3.73 4.55 2.97 2.66 0.00 -1.13 -3.29 105.19 114.69 2b39 n GLY 266 Ca 0.16 -0.51 -0.10 0.00 0.00 0.00 0.00 46.02 45.57 2b39 n GLY 266 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2b39 s THR 267 N 2.49 0.09 -0.01 2.61 -4.23 -0.94 -2.22 115.64 113.43 2b39 s THR 267 Ca 0.00 -0.77 0.04 0.00 -1.18 0.00 0.00 61.69 59.78 2b39 s THR 267 Cb 0.00 -0.24 -0.01 0.00 1.34 0.00 0.00 72.50 73.59 2b39 s THR 267 CO 0.00 -0.42 -0.13 0.00 -0.54 0.00 0.00 174.62 173.53 2b39 s ALA 268 N -1.25 1.06 -0.21 3.99 0.00 -0.91 -1.28 121.76 123.17 2b39 s ALA 268 Ca -0.14 -0.55 -0.05 0.00 0.00 0.00 0.00 51.96 51.23 2b39 s ALA 268 Cb -0.08 -0.27 -0.02 0.00 0.00 0.00 0.00 23.12 22.74 2b39 s ALA 268 CO -0.01 0.26 -0.01 -0.06 0.00 0.00 0.00 175.76 175.94 2b39 s PHE 269 N -0.29 3.01 0.00 0.00 0.08 -0.69 -2.23 117.98 117.86 2b39 s PHE 269 Ca 0.05 -0.62 0.06 0.00 0.12 0.00 0.00 56.93 56.53 2b39 s PHE 269 Cb -0.05 -2.11 -0.02 0.00 -0.57 0.00 0.00 43.02 40.28 2b39 s PHE 269 CO -0.00 -0.36 -0.17 0.08 -0.10 0.00 0.00 175.22 174.66 2b39 s VAL 270 N 1.24 1.38 -0.05 -0.44 1.01 -1.14 -1.80 120.40 120.60 2b39 s VAL 270 Ca 0.03 -0.86 -0.00 0.00 0.00 0.00 0.00 61.98 61.16 2b39 s VAL 270 Cb -0.15 -1.17 0.03 0.00 0.00 0.00 0.00 36.38 35.09 2b39 s VAL 270 CO 0.00 0.30 -0.01 -0.63 0.00 0.00 0.00 175.10 174.76 2b39 s ILE 271 N -0.54 0.37 0.00 2.22 1.01 -0.78 -2.45 121.20 121.04 2b39 s ILE 271 Ca 0.06 0.04 0.00 0.00 0.00 0.00 0.00 60.65 60.75 2b39 s ILE 271 Cb -0.07 -0.47 0.00 0.00 0.01 0.00 0.00 42.46 41.92 2b39 s ILE 271 CO 0.00 0.22 0.00 0.49 0.00 0.00 0.00 174.94 175.65 2b39 n PHE 272 N 4.54 0.00 0.00 3.97 3.72 -1.26 -2.77 117.46 125.66 2b39 n PHE 272 Ca -0.18 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.22 2b39 n PHE 272 Cb 0.50 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.04 2b39 n PHE 272 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2b39 n GLY 273 N 5.00 3.47 3.79 1.37 0.00 -1.01 -3.99 105.19 113.83 2b39 n GLY 273 Ca 0.00 -0.15 -0.33 0.00 0.00 0.00 0.00 46.02 45.54 2b39 n GLY 273 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2b39 s VAL 274 N 0.00 3.61 -0.07 1.61 1.01 -1.22 -1.29 120.40 124.05 2b39 s VAL 274 Ca 0.00 0.77 0.01 0.00 0.00 0.00 0.00 61.98 62.75 2b39 s VAL 274 Cb 0.00 -3.29 0.02 0.00 0.00 0.00 0.00 36.38 33.11 2b39 s VAL 274 CO 0.00 -0.45 -0.07 -1.58 0.00 0.00 0.00 175.10 173.00 2b39 s GLN 275 N -4.05 1.21 -0.06 2.72 0.74 0.18 -1.32 119.66 119.08 2b39 s GLN 275 Ca 0.65 -0.20 0.00 0.00 0.05 0.00 0.00 55.36 55.86 2b39 s GLN 275 Cb -0.18 -1.20 0.06 0.00 1.10 0.00 0.00 33.01 32.80 2b39 s GLN 275 CO 0.38 -0.13 1.39 -0.25 -0.55 0.00 0.00 175.29 176.13 2b39 n ASP 276 N 4.36 3.90 0.00 6.67 10.43 0.11 -3.44 116.55 138.57 2b39 n ASP 276 Ca -0.19 -2.30 0.00 0.00 2.57 0.00 0.00 54.79 54.88 2b39 n ASP 276 Cb 0.51 -0.72 0.00 0.00 1.84 0.00 0.00 41.12 42.74 2b39 n ASP 276 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 2b39 n GLY 277 N 0.62 2.08 0.53 0.44 0.00 -1.26 -3.91 105.19 103.70 2b39 n GLY 277 Ca 0.07 -0.31 -0.00 0.00 0.00 0.00 0.00 46.02 45.77 2b39 n GLY 277 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2b39 n ASP 278 N 3.10 0.01 -4.21 1.61 -0.08 -1.26 -5.12 116.55 110.60 2b39 n ASP 278 Ca 0.00 -1.62 -0.24 0.00 -1.51 0.00 0.00 54.79 51.42 2b39 n ASP 278 Cb 0.00 -0.12 -0.14 0.00 2.34 0.00 0.00 41.12 43.20 2b39 n ASP 278 CO 0.00 0.00 0.00 -0.13 0.12 0.00 0.00 177.20 177.19 2b39 s ARG 279 N 0.00 1.30 -0.14 -0.67 0.52 -1.25 -5.14 118.95 113.56 2b39 s ARG 279 Ca 0.01 -0.83 -0.02 0.00 -0.52 0.00 0.00 55.73 54.38 2b39 s ARG 279 Cb 0.01 -1.35 -0.02 0.00 0.52 0.00 0.00 34.95 34.11 2b39 s ARG 279 CO -0.00 0.35 -0.09 1.03 0.02 0.00 0.00 175.30 176.61 2b39 s ARG 280 N -0.98 3.52 -0.65 3.54 0.52 -1.26 0.06 118.95 123.69 2b39 s ARG 280 Ca 0.06 -0.61 0.05 0.00 -0.52 0.00 0.00 55.73 54.71 2b39 s ARG 280 Cb -0.08 -2.76 0.28 0.00 0.52 0.00 0.00 34.95 32.90 2b39 s ARG 280 CO 0.01 0.23 0.85 -0.89 0.02 0.00 0.00 175.30 175.52 2b39 n ILE 281 N 3.53 2.76 -1.51 1.52 5.41 -0.44 -5.01 119.36 125.62 2b39 n ILE 281 Ca -0.18 -5.36 -0.26 0.00 1.00 0.00 0.00 62.75 57.95 2b39 n ILE 281 Cb 0.53 -1.93 -0.19 0.00 -0.71 0.00 0.00 39.64 37.34 2b39 n ILE 281 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 176.55 175.01 2b39 n SER 282 N 0.59 -0.56 -4.54 4.38 3.41 -1.26 -3.45 113.62 112.19 2b39 n SER 282 Ca 0.30 -0.49 -0.28 0.00 -0.26 0.00 0.00 58.87 58.15 2b39 n SER 282 Cb 0.40 -0.79 -0.07 0.00 -0.26 0.00 0.00 64.21 63.49 2b39 n SER 282 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2b39 n LEU 283 N 8.54 1.65 -0.25 1.04 4.77 -1.26 -4.80 117.00 126.70 2b39 n LEU 283 Ca 0.64 -0.79 0.03 0.00 -0.03 0.00 0.00 56.01 55.87 2b39 n LEU 283 Cb 0.16 -1.47 0.12 0.00 -2.33 0.00 0.00 43.42 39.91 2b39 n LEU 283 CO 0.99 -1.85 0.78 0.71 -1.33 0.00 0.00 177.39 176.68 2b39 h THR 284 N 7.68 0.31 -0.48 -5.08 1.35 -1.92 -1.25 112.91 113.53 2b39 h THR 284 Ca -0.12 -0.02 -0.00 0.00 -0.55 0.00 0.00 66.41 65.72 2b39 h THR 284 Cb 1.17 0.25 -0.02 0.00 -1.73 0.00 0.00 68.15 67.82 2b39 h THR 284 CO 1.16 0.01 0.30 0.45 -0.25 0.00 0.00 175.52 177.19 2b39 h HIS 285 N 0.05 0.62 -0.21 4.73 3.86 -1.95 -3.33 115.15 118.91 2b39 h HIS 285 Ca 0.38 0.01 0.02 0.00 -1.16 0.00 0.00 60.37 59.62 2b39 h HIS 285 Cb 0.64 -0.21 -0.03 0.00 1.06 0.00 0.00 27.41 28.88 2b39 h HIS 285 CO -0.49 0.40 -0.12 0.43 0.86 0.00 0.00 177.93 179.01 2b39 n SER 286 N -4.45 -0.22 -4.69 2.45 7.64 -0.47 -4.66 113.62 109.22 2b39 n SER 286 Ca 0.04 0.42 -0.43 0.00 1.01 0.00 0.00 58.87 59.91 2b39 n SER 286 Cb 0.07 -0.07 -0.01 0.00 -1.01 0.00 0.00 64.21 63.18 2b39 n SER 286 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2b39 n LEU 287 N -3.95 3.46 -3.93 -3.43 -0.00 -1.23 -4.76 117.00 103.17 2b39 n LEU 287 Ca 0.00 1.18 -0.10 0.00 -0.00 0.00 0.00 56.01 57.10 2b39 n LEU 287 Cb 0.05 -1.47 -0.10 0.00 -0.00 0.00 0.00 43.42 41.90 2b39 n LEU 287 CO -0.03 -0.44 -0.23 0.42 -0.00 0.00 0.00 177.39 177.10 2b39 s THR 288 N -0.66 0.12 -0.90 1.47 -4.23 -1.03 -4.99 115.64 105.42 2b39 s THR 288 Ca 0.60 -0.98 -0.16 0.00 -1.18 0.00 0.00 61.69 59.97 2b39 s THR 288 Cb -0.59 -0.68 0.18 0.00 1.34 0.00 0.00 72.50 72.75 2b39 s THR 288 CO 0.57 -0.54 0.96 -0.60 -0.54 0.00 0.00 174.62 174.47 2b39 s ARG 289 N -2.13 3.65 0.26 3.99 3.52 -1.26 -2.89 118.95 124.10 2b39 s ARG 289 Ca -0.09 -2.22 -0.25 0.00 -0.13 0.00 0.00 55.73 53.04 2b39 s ARG 289 Cb -0.04 -4.66 -0.09 0.00 -1.56 0.00 0.00 34.95 28.60 2b39 s ARG 289 CO -0.02 -1.51 0.86 0.08 -0.81 0.00 0.00 175.30 173.91 2b39 s VAL 290 N 1.18 4.30 0.19 7.11 1.01 -0.95 -4.93 120.40 128.31 2b39 s VAL 290 Ca 0.26 1.72 -0.12 0.00 0.00 0.00 0.00 61.98 63.83 2b39 s VAL 290 Cb -0.08 -4.04 -0.07 0.00 0.00 0.00 0.00 36.38 32.19 2b39 s VAL 290 CO -0.09 0.27 0.55 -2.16 0.00 0.00 0.00 175.10 173.68 2b39 s PRO 291 N -1.77 3.90 -0.26 2.72 0.04 -1.26 -2.14 135.00 136.24 2b39 s PRO 291 Ca 0.45 0.40 -0.07 0.00 0.04 0.00 0.00 61.00 61.82 2b39 s PRO 291 Cb -0.20 -2.79 -0.02 0.00 0.04 0.00 0.00 34.50 31.54 2b39 s PRO 291 CO 0.25 0.40 0.06 0.42 0.04 0.00 0.00 177.00 178.16 2b39 s ILE 292 N -1.64 4.08 -0.19 0.56 1.01 -0.94 -4.60 121.20 119.47 2b39 s ILE 292 Ca 0.43 -0.35 0.01 0.00 0.00 0.00 0.00 60.65 60.73 2b39 s ILE 292 Cb -0.13 -2.95 0.03 0.00 0.01 0.00 0.00 42.46 39.42 2b39 s ILE 292 CO 0.20 0.29 -0.18 0.20 0.00 0.00 0.00 174.94 175.44 2b39 s ASN 293 N 1.57 3.30 -0.94 3.58 0.01 0.11 -2.82 114.94 119.74 2b39 s ASN 293 Ca 0.05 -0.75 0.00 0.00 -0.71 0.00 0.00 52.86 51.45 2b39 s ASN 293 Cb -0.15 -1.48 0.00 0.00 0.41 0.00 0.00 41.25 40.03 2b39 s ASN 293 CO 0.02 -0.03 0.00 -0.67 -1.51 0.00 0.00 177.10 174.91 2b39 n ASP 294 N 4.60 -3.61 -0.22 -1.22 -0.08 -1.22 -2.75 116.55 112.06 2b39 n ASP 294 Ca -0.20 0.01 -0.02 0.00 -1.51 0.00 0.00 54.79 53.07 2b39 n ASP 294 Cb 0.49 -2.78 -0.00 0.00 2.34 0.00 0.00 41.12 41.16 2b39 n ASP 294 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2b39 n GLY 295 N -1.07 0.39 3.03 0.27 0.00 0.16 -4.78 105.19 103.19 2b39 n GLY 295 Ca -0.13 -0.87 -0.12 0.00 0.00 0.00 0.00 46.02 44.90 2b39 n GLY 295 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2b39 s ASN 296 N -2.93 -0.10 0.21 1.61 0.02 -1.11 -3.27 114.94 109.37 2b39 s ASN 296 Ca 0.00 0.16 -0.04 0.00 -1.02 0.00 0.00 52.86 51.96 2b39 s ASN 296 Cb 0.00 0.26 0.02 0.00 0.02 0.00 0.00 41.25 41.55 2b39 s ASN 296 CO 0.00 -0.12 0.34 0.61 0.02 0.00 0.00 177.10 177.96 2b39 n GLY 297 N 2.66 2.07 3.37 0.66 0.00 -0.84 -0.72 105.19 112.40 2b39 n GLY 297 Ca -0.15 -1.35 -0.09 0.00 0.00 0.00 0.00 46.02 44.43 2b39 n GLY 297 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2b39 s GLU 298 N -2.28 0.46 -0.74 1.61 2.12 -1.26 -3.09 118.70 115.51 2b39 s GLU 298 Ca 0.13 0.96 0.04 0.00 0.36 0.00 0.00 54.97 56.45 2b39 s GLU 298 Cb -0.01 0.11 0.27 0.00 0.26 0.00 0.00 34.13 34.76 2b39 s GLU 298 CO 0.10 -0.17 0.94 0.00 -0.54 0.00 0.00 175.26 175.58 2b39 n ALA 299 N 4.52 4.39 -1.76 6.30 0.00 -0.96 -4.77 120.51 128.24 2b39 n ALA 299 Ca -0.20 -4.78 -0.39 0.00 0.00 0.00 0.00 53.44 48.08 2b39 n ALA 299 Cb 0.55 -1.24 0.01 0.00 0.00 0.00 0.00 19.45 18.77 2b39 n ALA 299 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2b39 s ILE 300 N -2.69 2.57 -0.48 0.00 1.01 -1.26 -3.39 121.20 116.95 2b39 s ILE 300 Ca 0.38 0.47 0.04 0.00 0.00 0.00 0.00 60.65 61.55 2b39 s ILE 300 Cb 0.13 -3.26 0.18 0.00 0.01 0.00 0.00 42.46 39.52 2b39 s ILE 300 CO 0.01 0.04 0.39 -0.11 0.00 0.00 0.00 174.94 175.27 2b39 n LEU 301 N -0.27 0.36 -3.99 2.97 -0.00 -1.26 -4.83 117.00 109.98 2b39 n LEU 301 Ca 0.06 -4.59 -0.19 0.00 -0.00 0.00 0.00 56.01 51.29 2b39 n LEU 301 Cb 0.45 0.26 0.10 0.00 -0.00 0.00 0.00 43.42 44.23 2b39 n LEU 301 CO 0.54 1.86 -0.38 0.29 -0.00 0.00 0.00 177.39 179.69 2b39 n LYS 302 N 2.53 -1.37 -0.01 1.96 5.02 -1.24 -4.02 118.16 121.03 2b39 n LYS 302 Ca 0.27 -0.40 0.14 0.00 -2.02 0.00 0.00 58.31 56.30 2b39 n LYS 302 Cb 0.45 -1.33 0.61 0.00 -0.02 0.00 0.00 35.03 34.75 2b39 n LYS 302 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 2b39 n ARG 303 N -0.37 1.48 -0.29 1.97 1.74 -1.26 -3.88 116.66 116.05 2b39 n ARG 303 Ca 0.03 -0.71 0.06 0.00 -0.77 0.00 0.00 57.85 56.46 2b39 n ARG 303 Cb 0.37 -1.47 0.27 0.00 -1.02 0.00 0.00 32.46 30.61 2b39 n ARG 303 CO 0.00 0.00 0.00 1.96 -1.52 0.00 0.00 177.63 178.07 2b39 h GLN 304 N 1.67 0.93 -0.52 5.56 4.20 -1.97 3.60 115.11 128.57 2b39 h GLN 304 Ca 0.00 -0.06 0.00 0.00 0.06 0.00 0.00 58.65 58.65 2b39 h GLN 304 Cb 0.36 -0.21 0.00 0.00 0.30 0.00 0.00 27.48 27.93 2b39 h GLN 304 CO 0.00 0.61 0.00 0.28 -0.67 0.00 0.00 178.83 179.05 2b39 n VAL 305 N -4.51 0.73 -0.06 -0.54 0.31 -1.25 -3.29 118.33 109.71 2b39 n VAL 305 Ca 0.14 -0.70 -0.09 0.00 -0.01 0.00 0.00 64.34 63.69 2b39 n VAL 305 Cb 0.25 0.32 -0.05 0.00 -0.91 0.00 0.00 33.84 33.46 2b39 n VAL 305 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 2b39 n LEU 306 N 0.99 2.34 0.34 7.52 4.77 0.16 -1.41 117.00 131.70 2b39 n LEU 306 Ca 0.17 0.00 0.20 0.00 -0.03 0.00 0.00 56.01 56.36 2b39 n LEU 306 Cb 0.45 -0.37 1.09 0.00 -2.33 0.00 0.00 43.42 42.26 2b39 n LEU 306 CO 0.12 0.55 1.17 0.25 -1.33 0.00 0.00 177.39 178.15 2b39 h LEU 307 N -0.12 0.00 0.00 2.23 5.85 0.64 0.12 115.31 124.02 2b39 h LEU 307 Ca -0.26 0.00 -0.33 0.00 0.84 0.00 0.00 57.88 58.13 2b39 h LEU 307 Cb 1.34 0.00 -0.06 0.00 0.37 0.00 0.00 40.66 42.31 2b39 h LEU 307 CO -0.08 0.00 -2.26 0.59 -0.34 0.00 0.00 178.44 176.35 2b39 n ASN 308 N -3.01 1.10 -3.23 1.25 4.13 -1.21 -4.91 115.26 109.37 2b39 n ASN 308 Ca -0.03 -0.04 -0.35 0.00 1.68 0.00 0.00 54.58 55.84 2b39 n ASN 308 Cb 0.17 0.52 -0.02 0.00 -1.54 0.00 0.00 39.78 38.91 2b39 n ASN 308 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2b39 n GLY 309 N 2.06 -1.26 1.76 7.41 0.00 0.42 -3.83 105.19 111.75 2b39 n GLY 309 Ca -0.33 0.26 -0.06 0.00 0.00 0.00 0.00 46.02 45.88 2b39 n GLY 309 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2b39 n VAL 310 N 0.03 0.00 -2.10 1.61 0.31 -1.26 -4.74 118.33 112.17 2b39 n VAL 310 Ca 0.13 -0.27 -0.41 0.00 -0.01 0.00 0.00 64.34 63.78 2b39 n VAL 310 Cb 0.18 0.00 -0.02 0.00 -0.91 0.00 0.00 33.84 33.09 2b39 n VAL 310 CO 0.00 0.00 0.00 -1.58 -1.32 0.00 0.00 176.83 173.93 2b39 s GLN 311 N 3.28 4.34 0.00 5.55 0.74 -1.25 -4.97 119.66 127.35 2b39 s GLN 311 Ca 0.39 2.21 0.00 0.00 0.05 0.00 0.00 55.36 58.01 2b39 s GLN 311 Cb -0.25 -3.10 0.00 0.00 1.10 0.00 0.00 33.01 30.76 2b39 s GLN 311 CO 0.17 -0.26 0.00 -2.30 -0.55 0.00 0.00 175.29 172.35 2b39 n PRO 312 N 1.51 0.00 -3.81 1.67 -0.02 -1.26 -5.14 135.00 127.94 2b39 n PRO 312 Ca 0.03 0.00 -0.06 0.00 -2.02 0.00 0.00 63.50 61.44 2b39 n PRO 312 Cb 0.41 -0.04 -0.02 0.00 -0.02 0.00 0.00 33.50 33.83 2b39 n PRO 312 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 2b39 s SER 313 N -3.63 -0.25 0.23 2.55 1.04 -1.26 -5.08 113.70 107.29 2b39 s SER 313 Ca 0.00 -0.53 0.01 0.00 0.48 0.00 0.00 55.95 55.91 2b39 s SER 313 Cb 0.00 0.66 0.24 0.00 0.10 0.00 0.00 66.02 67.02 2b39 s SER 313 CO 0.00 -1.22 1.57 0.03 0.98 0.00 0.00 173.24 174.61 2b39 h ARG 314 N 2.00 0.41 0.00 4.02 2.47 -2.00 -3.15 114.38 118.12 2b39 h ARG 314 Ca -0.21 -0.24 0.00 0.00 -1.26 0.00 0.00 59.98 58.27 2b39 h ARG 314 Cb 1.25 0.02 0.00 0.00 -1.65 0.00 0.00 29.97 29.59 2b39 h ARG 314 CO 0.24 0.82 -0.31 0.00 0.56 0.00 0.00 179.97 181.28 2b39 n ALA 315 N -2.49 0.28 0.44 0.04 0.00 -1.26 -4.40 120.51 113.11 2b39 n ALA 315 Ca -0.02 -0.32 0.12 0.00 0.00 0.00 0.00 53.44 53.22 2b39 n ALA 315 Cb 0.57 0.01 0.48 0.00 0.00 0.00 0.00 19.45 20.51 2b39 n ALA 315 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 2b39 n ASP 316 N -3.61 0.74 -0.77 0.00 5.68 -1.26 -4.81 116.55 112.52 2b39 n ASP 316 Ca -0.04 0.66 0.00 0.00 -0.50 0.00 0.00 54.79 54.90 2b39 n ASP 316 Cb 0.16 -0.82 0.00 0.00 -1.14 0.00 0.00 41.12 39.32 2b39 n ASP 316 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2b39 n ALA 317 N -1.79 0.00 -3.96 2.12 0.00 -1.19 -1.56 120.51 114.13 2b39 n ALA 317 Ca 0.03 0.00 -0.28 0.00 0.00 0.00 0.00 53.44 53.18 2b39 n ALA 317 Cb 0.28 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.73 2b39 n ALA 317 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2b39 n LEU 318 N -0.19 -2.36 -0.28 0.00 4.77 -1.26 -4.90 117.00 112.78 2b39 n LEU 318 Ca 0.00 -0.91 -0.06 0.00 -0.03 0.00 0.00 56.01 55.01 2b39 n LEU 318 Cb 0.00 -2.36 0.06 0.00 -2.33 0.00 0.00 43.42 38.79 2b39 n LEU 318 CO 0.00 0.41 1.09 0.58 -1.33 0.00 0.00 177.39 178.13 2b39 h VAL 319 N -1.84 1.24 0.00 4.08 2.07 -1.61 -3.02 116.25 117.18 2b39 h VAL 319 Ca -0.61 -0.67 0.00 0.00 0.82 0.00 0.00 66.70 66.25 2b39 h VAL 319 Cb 1.37 0.28 0.00 0.00 -1.52 0.00 0.00 31.29 31.43 2b39 h VAL 319 CO 0.66 0.28 0.00 0.61 0.02 0.00 0.00 177.57 179.14 2b39 n GLY 320 N -1.00 0.00 3.71 2.17 0.00 -1.26 -4.23 105.19 104.58 2b39 n GLY 320 Ca 0.07 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.77 2b39 n GLY 320 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2b39 s LYS 321 N -1.35 2.79 -0.03 1.61 1.02 -1.14 -4.94 119.74 117.70 2b39 s LYS 321 Ca 0.00 -0.64 -0.03 0.00 0.02 0.00 0.00 55.97 55.32 2b39 s LYS 321 Cb 0.00 -2.68 -0.04 0.00 -0.52 0.00 0.00 37.83 34.59 2b39 s LYS 321 CO 0.00 0.61 0.14 -1.54 -0.92 0.00 0.00 175.35 173.64 2b39 s SER 322 N -1.82 6.16 0.55 2.83 1.04 -1.22 -3.03 113.70 118.20 2b39 s SER 322 Ca 0.22 0.31 -0.06 0.00 0.48 0.00 0.00 55.95 56.90 2b39 s SER 322 Cb -0.12 -1.90 -0.02 0.00 0.10 0.00 0.00 66.02 64.09 2b39 s SER 322 CO 0.14 0.29 0.87 -0.63 0.98 0.00 0.00 173.24 174.89 2b39 s ILE 323 N -1.23 4.35 -0.11 -1.02 1.01 0.27 -0.65 121.20 123.82 2b39 s ILE 323 Ca 0.24 0.20 -0.07 0.00 0.00 0.00 0.00 60.65 61.02 2b39 s ILE 323 Cb -0.12 -3.69 0.04 0.00 0.01 0.00 0.00 42.46 38.69 2b39 s ILE 323 CO 0.15 -0.73 0.27 -0.72 0.00 0.00 0.00 174.94 173.91 2b39 s TYR 324 N -2.90 -0.34 -0.01 3.97 -0.85 -0.41 -3.13 117.35 113.68 2b39 s TYR 324 Ca 0.51 0.80 0.04 0.00 -0.52 0.00 0.00 57.07 57.89 2b39 s TYR 324 Cb -0.10 0.09 -0.01 0.00 0.38 0.00 0.00 41.96 42.32 2b39 s TYR 324 CO 0.46 -0.20 -0.12 0.08 -1.52 0.00 0.00 175.55 174.25 2b39 s VAL 325 N 0.77 0.95 0.01 -3.49 1.01 -0.68 -2.39 120.40 116.58 2b39 s VAL 325 Ca -0.05 -0.50 -0.07 0.00 0.00 0.00 0.00 61.98 61.36 2b39 s VAL 325 Cb -0.06 -0.81 -0.00 0.00 0.00 0.00 0.00 36.38 35.51 2b39 s VAL 325 CO -0.05 0.27 0.12 -0.94 0.00 0.00 0.00 175.10 174.51 2b39 s SER 326 N -0.18 0.06 0.29 3.32 1.04 -1.11 0.24 113.70 117.36 2b39 s SER 326 Ca 0.03 -0.28 -0.11 0.00 0.48 0.00 0.00 55.95 56.07 2b39 s SER 326 Cb -0.06 0.20 0.01 0.00 0.10 0.00 0.00 66.02 66.27 2b39 s SER 326 CO -0.00 -0.39 0.53 0.00 0.98 0.00 0.00 173.24 174.36 2b39 s ALA 327 N -1.57 -0.09 0.16 5.32 0.00 -0.86 -1.87 121.76 122.85 2b39 s ALA 327 Ca -0.13 -1.00 0.08 0.00 0.00 0.00 0.00 51.96 50.90 2b39 s ALA 327 Cb -0.07 1.03 -0.04 0.00 0.00 0.00 0.00 23.12 24.04 2b39 s ALA 327 CO 0.01 -0.86 -0.16 0.95 0.00 0.00 0.00 175.76 175.69 2b39 s THR 328 N -3.55 1.65 -0.06 0.00 -4.23 -0.74 0.81 115.64 109.52 2b39 s THR 328 Ca 0.23 -1.90 0.00 0.00 -1.18 0.00 0.00 61.69 58.85 2b39 s THR 328 Cb -0.01 -1.78 0.02 0.00 1.34 0.00 0.00 72.50 72.07 2b39 s THR 328 CO 0.12 -0.39 -0.03 -0.69 -0.54 0.00 0.00 174.62 173.09 2b39 s VAL 329 N -2.22 0.55 -0.24 2.29 1.01 0.78 -1.70 120.40 120.86 2b39 s VAL 329 Ca 0.15 -0.07 -0.01 0.00 0.00 0.00 0.00 61.98 62.04 2b39 s VAL 329 Cb -0.05 -0.62 0.02 0.00 0.00 0.00 0.00 36.38 35.74 2b39 s VAL 329 CO 0.05 0.26 -0.07 0.27 0.00 0.00 0.00 175.10 175.61 2b39 s ILE 330 N 1.35 2.80 0.38 2.22 -4.36 -0.41 -2.48 121.20 120.70 2b39 s ILE 330 Ca -0.04 -1.01 -0.27 0.00 -0.26 0.00 0.00 60.65 59.07 2b39 s ILE 330 Cb -0.13 -2.40 -0.11 0.00 1.25 0.00 0.00 42.46 41.06 2b39 s ILE 330 CO -0.02 0.23 1.24 0.18 0.24 0.00 0.00 174.94 176.81 2b39 n LEU 331 N 4.66 3.51 0.20 0.37 4.77 -1.24 -2.22 117.00 127.05 2b39 n LEU 331 Ca -0.17 1.15 0.06 0.00 -0.03 0.00 0.00 56.01 57.03 2b39 n LEU 331 Cb 0.47 -1.46 0.39 0.00 -2.33 0.00 0.00 43.42 40.49 2b39 n LEU 331 CO 0.27 -0.71 0.72 -0.61 -1.33 0.00 0.00 177.39 175.73 2b39 h GLN 332 N 2.24 0.00 -0.35 3.23 4.15 -1.86 -1.38 115.11 121.14 2b39 h GLN 332 Ca -0.46 0.00 -0.01 0.00 0.77 0.00 0.00 58.65 58.95 2b39 h GLN 332 Cb 1.30 0.00 -0.02 0.00 0.21 0.00 0.00 27.48 28.97 2b39 h GLN 332 CO 0.61 0.34 0.17 0.66 -1.93 0.00 0.00 178.83 178.67 2b39 h SER 333 N 0.00 0.43 0.00 -0.69 4.64 -1.89 -3.40 113.55 112.63 2b39 h SER 333 Ca -0.00 -0.03 0.00 0.00 -0.47 0.00 0.00 61.79 61.29 2b39 h SER 333 Cb 0.80 -0.11 0.00 0.00 -0.31 0.00 0.00 62.40 62.78 2b39 h SER 333 CO 0.04 0.37 0.00 0.61 -0.87 0.00 0.00 176.83 176.98 2b39 n GLY 334 N -1.31 0.34 1.44 -0.77 0.00 -1.20 -4.49 105.19 99.21 2b39 n GLY 334 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.04 2b39 n GLY 334 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2b39 n SER 335 N 0.00 -1.59 -4.45 1.61 7.64 -0.52 -3.55 113.62 112.76 2b39 n SER 335 Ca 0.00 0.00 -0.33 0.00 1.01 0.00 0.00 58.87 59.55 2b39 n SER 335 Cb 0.00 -0.45 -0.13 0.00 -1.01 0.00 0.00 64.21 62.62 2b39 n SER 335 CO 0.00 0.00 0.00 1.51 -3.01 0.00 0.00 175.04 173.54 2b39 s ASP 336 N -2.90 4.04 0.55 6.43 -4.77 -1.26 -4.89 116.67 113.87 2b39 s ASP 336 Ca 0.00 -0.23 0.07 0.00 -3.30 0.00 0.00 52.55 49.10 2b39 s ASP 336 Cb 0.00 -1.07 0.06 0.00 -1.09 0.00 0.00 42.92 40.81 2b39 s ASP 336 CO 0.00 0.30 0.57 0.00 0.70 0.00 0.00 175.17 176.74 2b39 s MET 337 N -0.43 2.30 -0.13 2.11 0.23 -1.26 -3.61 119.30 118.52 2b39 s MET 337 Ca 0.05 -1.81 -0.09 0.00 -1.03 0.00 0.00 55.69 52.81 2b39 s MET 337 Cb -0.12 -2.37 0.05 0.00 -1.53 0.00 0.00 34.83 30.86 2b39 s MET 337 CO 0.02 -0.69 0.34 0.08 -2.03 0.00 0.00 175.02 172.73 2b39 s VAL 338 N -2.70 -0.02 -0.06 5.16 1.01 -1.04 -4.84 120.40 117.91 2b39 s VAL 338 Ca 0.47 0.07 -0.01 0.00 0.00 0.00 0.00 61.98 62.51 2b39 s VAL 338 Cb -0.04 -0.49 -0.03 0.00 0.00 0.00 0.00 36.38 35.81 2b39 s VAL 338 CO 0.29 0.03 0.02 -1.83 0.00 0.00 0.00 175.10 173.61 2b39 s GLU 339 N 0.90 2.98 0.31 2.72 -1.05 -1.26 -0.16 118.70 123.14 2b39 s GLU 339 Ca -0.06 -0.43 0.04 0.00 -0.15 0.00 0.00 54.97 54.37 2b39 s GLU 339 Cb -0.07 -2.80 -0.03 0.00 -0.44 0.00 0.00 34.13 30.79 2b39 s GLU 339 CO -0.07 0.69 0.20 0.00 0.95 0.00 0.00 175.26 177.03 2b39 s ALA 340 N -0.96 1.94 -0.06 -0.84 0.00 0.24 -4.80 121.76 117.28 2b39 s ALA 340 Ca 0.15 -1.81 -0.31 0.00 0.00 0.00 0.00 51.96 50.00 2b39 s ALA 340 Cb -0.11 1.26 0.11 0.00 0.00 0.00 0.00 23.12 24.38 2b39 s ALA 340 CO 0.05 -0.56 1.04 -1.83 0.00 0.00 0.00 175.76 174.46 2b39 s GLU 341 N -3.70 0.63 -0.05 0.00 -1.05 -1.26 -2.02 118.70 111.25 2b39 s GLU 341 Ca 0.37 -0.26 0.01 0.00 -0.15 0.00 0.00 54.97 54.93 2b39 s GLU 341 Cb 0.04 0.27 0.02 0.00 -0.44 0.00 0.00 34.13 34.03 2b39 s GLU 341 CO 0.20 -0.28 -0.04 1.03 0.95 0.00 0.00 175.26 177.12 2b39 s ARG 342 N -2.82 0.85 0.01 -4.83 1.81 0.66 -4.81 118.95 109.82 2b39 s ARG 342 Ca 0.08 -0.08 0.04 0.00 -1.72 0.00 0.00 55.73 54.05 2b39 s ARG 342 Cb -0.01 -0.92 -0.01 0.00 -0.45 0.00 0.00 34.95 33.56 2b39 s ARG 342 CO -0.06 -0.13 -0.12 0.95 -0.68 0.00 0.00 175.30 175.26 2b39 s THR 343 N 1.14 0.97 0.00 0.02 -4.23 -1.26 -1.69 115.64 110.59 2b39 s THR 343 Ca -0.07 -0.67 0.00 0.00 -1.18 0.00 0.00 61.69 59.76 2b39 s THR 343 Cb -0.14 -0.84 0.00 0.00 1.34 0.00 0.00 72.50 72.86 2b39 s THR 343 CO -0.01 0.16 0.00 0.61 -0.54 0.00 0.00 174.62 174.84 2b39 n GLY 344 N 2.47 0.84 3.55 3.99 0.00 -1.26 -5.04 105.19 109.74 2b39 n GLY 344 Ca -0.15 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.47 2b39 n GLY 344 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2b39 s ILE 345 N -2.00 3.63 0.53 -0.61 1.01 -1.18 -4.96 121.20 117.62 2b39 s ILE 345 Ca 0.00 0.27 -0.11 0.00 0.00 0.00 0.00 60.65 60.80 2b39 s ILE 345 Cb 0.00 -4.65 -0.05 0.00 0.01 0.00 0.00 42.46 37.77 2b39 s ILE 345 CO 0.00 -1.59 0.93 -2.16 0.00 0.00 0.00 174.94 172.12 2b39 s PRO 346 N 6.07 3.71 -0.55 2.79 0.04 -1.26 0.95 135.00 146.75 2b39 s PRO 346 Ca 0.45 0.65 0.03 0.00 0.04 0.00 0.00 61.00 62.17 2b39 s PRO 346 Cb -0.09 -2.20 0.40 0.00 0.04 0.00 0.00 34.50 32.65 2b39 s PRO 346 CO 0.15 -0.33 1.38 -0.89 0.04 0.00 0.00 177.00 177.34 2b39 n ILE 347 N -2.11 2.73 -0.77 0.56 5.41 -1.17 -1.23 119.36 122.78 2b39 n ILE 347 Ca 0.04 -4.73 -0.33 0.00 1.00 0.00 0.00 62.75 58.74 2b39 n ILE 347 Cb 0.54 -1.26 0.13 0.00 -0.71 0.00 0.00 39.64 38.34 2b39 n ILE 347 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 176.55 177.07 2b39 n VAL 348 N -0.51 0.00 0.04 1.39 0.31 -1.22 -4.51 118.33 113.85 2b39 n VAL 348 Ca 0.44 -0.21 0.03 0.00 -0.01 0.00 0.00 64.34 64.59 2b39 n VAL 348 Cb 0.55 -0.62 -0.07 0.00 -0.91 0.00 0.00 33.84 32.79 2b39 n VAL 348 CO 0.00 0.00 0.00 0.35 -1.32 0.00 0.00 176.83 175.86 2b39 n THR 349 N -3.74 1.00 -4.03 2.52 -2.24 -1.26 -4.22 114.28 102.31 2b39 n THR 349 Ca 0.06 -0.65 -0.12 0.00 -2.27 0.00 0.00 64.05 61.06 2b39 n THR 349 Cb 0.55 -0.60 -0.12 0.00 -2.10 0.00 0.00 70.33 68.06 2b39 n THR 349 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 2b39 s SER 350 N -5.61 0.52 0.64 3.42 1.04 -1.26 -4.59 113.70 107.86 2b39 s SER 350 Ca -0.03 -0.38 0.42 0.00 0.48 0.00 0.00 55.95 56.44 2b39 s SER 350 Cb 0.09 0.03 2.19 0.00 0.10 0.00 0.00 66.02 68.44 2b39 s SER 350 CO 0.81 -0.15 2.29 1.55 0.98 0.00 0.00 173.24 178.72 2b39 h PRO 351 N 5.05 0.00 -4.08 4.02 0.13 -1.91 -3.42 132.00 131.78 2b39 h PRO 351 Ca -0.32 0.00 -0.36 0.00 -0.87 0.00 0.00 66.00 64.45 2b39 h PRO 351 Cb 1.20 0.00 -0.32 0.00 0.13 0.00 0.00 31.00 32.02 2b39 h PRO 351 CO 0.44 0.00 -0.76 0.71 -0.23 0.00 0.00 178.00 178.16 2b39 s TYR 352 N -4.09 0.54 -0.28 1.56 2.02 -1.26 -3.78 117.35 112.06 2b39 s TYR 352 Ca -0.04 -0.11 -0.11 0.00 -0.37 0.00 0.00 57.07 56.44 2b39 s TYR 352 Cb 0.12 -0.46 -0.05 0.00 -0.40 0.00 0.00 41.96 41.18 2b39 s TYR 352 CO 0.45 -0.10 0.18 -1.14 -1.57 0.00 0.00 175.55 173.37 2b39 s GLN 353 N 0.50 3.95 0.16 -0.62 0.74 -0.34 -4.57 119.66 119.48 2b39 s GLN 353 Ca -0.06 -0.32 0.06 0.00 0.05 0.00 0.00 55.36 55.09 2b39 s GLN 353 Cb -0.09 -3.64 -0.04 0.00 1.10 0.00 0.00 33.01 30.34 2b39 s GLN 353 CO -0.00 -0.16 0.05 0.96 -0.55 0.00 0.00 175.29 175.58 2b39 s ILE 354 N 1.70 4.03 0.10 -2.34 -5.25 -1.26 -2.80 121.20 115.37 2b39 s ILE 354 Ca 0.07 -1.24 -0.03 0.00 -0.99 0.00 0.00 60.65 58.46 2b39 s ILE 354 Cb -0.16 -3.02 0.01 0.00 2.95 0.00 0.00 42.46 42.24 2b39 s ILE 354 CO 0.10 -0.08 0.18 0.00 -1.79 0.00 0.00 174.94 173.36 2b39 n HIS 355 N -0.10 -1.13 -3.94 1.37 1.44 0.03 -4.82 115.22 108.07 2b39 n HIS 355 Ca -0.09 -0.53 -0.30 0.00 -2.01 0.00 0.00 57.72 54.78 2b39 n HIS 355 Cb 0.54 0.21 -0.16 0.00 0.12 0.00 0.00 29.99 30.71 2b39 n HIS 355 CO 0.00 0.00 0.00 -0.06 -2.81 0.00 0.00 176.34 173.47 2b39 s PHE 356 N -6.27 2.29 0.05 -1.40 0.40 -1.26 -1.04 117.98 110.76 2b39 s PHE 356 Ca 0.05 -1.64 -0.00 0.00 -0.60 0.00 0.00 56.93 54.74 2b39 s PHE 356 Cb -0.01 -1.55 -0.00 0.00 0.51 0.00 0.00 43.02 41.97 2b39 s PHE 356 CO 0.04 -0.75 -0.01 2.41 0.70 0.00 0.00 175.22 177.61 2b39 n THR 357 N 4.70 0.74 0.31 0.64 -1.04 -1.26 -4.68 114.28 113.69 2b39 n THR 357 Ca -0.12 0.24 0.20 0.00 -2.04 0.00 0.00 64.05 62.33 2b39 n THR 357 Cb 0.45 -1.37 0.95 0.00 -1.82 0.00 0.00 70.33 68.54 2b39 n THR 357 CO 0.00 0.00 0.00 0.11 -0.64 0.00 0.00 175.07 174.54 2b39 h LYS 358 N -0.02 0.00 -6.98 -2.82 1.79 -1.95 -3.45 116.57 103.15 2b39 h LYS 358 Ca 0.00 0.00 -0.49 0.00 -2.18 0.00 0.00 60.65 57.98 2b39 h LYS 358 Cb 0.02 0.00 0.22 0.00 -1.58 0.00 0.00 32.23 30.88 2b39 h LYS 358 CO 0.00 0.00 -0.33 2.41 -1.08 0.00 0.00 179.45 180.45 2b39 n THR 359 N -3.08 0.00 -4.02 -0.16 -1.04 -1.26 -4.73 114.28 100.00 2b39 n THR 359 Ca -0.01 -0.24 -0.23 0.00 -2.04 0.00 0.00 64.05 61.53 2b39 n THR 359 Cb 0.19 -0.82 -0.06 0.00 -1.82 0.00 0.00 70.33 67.82 2b39 n THR 359 CO 0.00 0.00 0.00 -2.16 -0.64 0.00 0.00 175.07 172.27 2b39 s PRO 360 N -4.06 2.37 -0.23 -2.82 0.04 -1.26 -4.09 135.00 124.95 2b39 s PRO 360 Ca 0.63 -1.62 0.04 0.00 0.04 0.00 0.00 61.00 60.09 2b39 s PRO 360 Cb -0.21 -2.16 -0.20 0.00 0.04 0.00 0.00 34.50 31.97 2b39 s PRO 360 CO 0.64 0.01 -0.08 0.36 0.04 0.00 0.00 177.00 177.97 2b39 n LYS 361 N -1.24 0.67 -5.09 4.56 2.85 -1.26 -4.93 118.16 113.72 2b39 n LYS 361 Ca -0.02 0.14 -0.32 0.00 -1.05 0.00 0.00 58.31 57.06 2b39 n LYS 361 Cb 0.62 -1.55 -0.16 0.00 -0.65 0.00 0.00 35.03 33.29 2b39 n LYS 361 CO 0.00 0.00 0.00 -0.06 -0.05 0.00 0.00 177.40 177.29 2b39 s PHE 362 N -2.52 2.62 0.07 5.58 2.99 -1.26 -2.65 117.98 122.81 2b39 s PHE 362 Ca -0.28 -0.84 0.01 0.00 0.00 0.00 0.00 56.93 55.82 2b39 s PHE 362 Cb 0.08 -1.73 0.01 0.00 0.00 0.00 0.00 43.02 41.39 2b39 s PHE 362 CO 0.67 -0.30 0.08 1.97 -0.00 0.00 0.00 175.22 177.64 2b39 n PHE 363 N 3.37 -2.11 -3.81 0.36 1.16 -1.15 -4.47 117.46 110.82 2b39 n PHE 363 Ca -0.18 -0.29 -0.26 0.00 -1.87 0.00 0.00 57.45 54.85 2b39 n PHE 363 Cb 0.53 -0.06 -0.17 0.00 -1.61 0.00 0.00 39.48 38.16 2b39 n PHE 363 CO 0.00 0.00 0.00 0.15 -1.87 0.00 0.00 176.76 175.04 2b39 s LYS 364 N -2.31 0.97 0.20 3.97 3.01 -1.26 -1.51 119.74 122.81 2b39 s LYS 364 Ca 0.06 -0.26 -0.32 0.00 -1.01 0.00 0.00 55.97 54.44 2b39 s LYS 364 Cb -0.00 -1.65 -0.15 0.00 -1.01 0.00 0.00 37.83 35.01 2b39 s LYS 364 CO 0.04 -0.43 1.16 -0.35 0.51 0.00 0.00 175.35 176.28 2b39 n PRO 365 N 5.02 1.28 -1.94 -1.68 -0.04 -1.26 -2.18 135.00 134.20 2b39 n PRO 365 Ca -0.10 0.46 -0.14 0.00 -0.04 0.00 0.00 63.50 63.68 2b39 n PRO 365 Cb 0.49 -1.95 -0.03 0.00 -0.04 0.00 0.00 33.50 31.97 2b39 n PRO 365 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2b39 n ALA 366 N 1.33 -0.34 -2.87 0.55 0.00 -0.19 -4.81 120.51 114.18 2b39 n ALA 366 Ca 0.14 0.16 -0.13 0.00 0.00 0.00 0.00 53.44 53.61 2b39 n ALA 366 Cb 0.26 -1.60 -0.12 0.00 0.00 0.00 0.00 19.45 18.00 2b39 n ALA 366 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 2b39 s MET 367 N -4.12 0.46 0.61 0.00 -1.94 -0.92 -4.84 119.30 108.54 2b39 s MET 367 Ca 0.00 -0.64 -0.20 0.00 -1.71 0.00 0.00 55.69 53.14 2b39 s MET 367 Cb 0.00 -0.22 -0.03 0.00 2.01 0.00 0.00 34.83 36.59 2b39 s MET 367 CO 0.00 0.04 1.33 -1.25 -0.01 0.00 0.00 175.02 175.12 2b39 s PRO 368 N -1.34 2.79 -0.14 2.03 0.04 -1.26 -2.94 135.00 134.18 2b39 s PRO 368 Ca -0.09 2.15 -0.04 0.00 0.04 0.00 0.00 61.00 63.06 2b39 s PRO 368 Cb -0.09 -2.02 -0.03 0.00 0.04 0.00 0.00 34.50 32.40 2b39 s PRO 368 CO 0.00 -1.44 -0.01 0.12 0.04 0.00 0.00 177.00 175.71 2b39 s PHE 369 N -1.35 3.10 -1.14 0.56 5.36 0.13 -4.86 117.98 119.78 2b39 s PHE 369 Ca 0.78 -0.11 -0.10 0.00 -0.96 0.00 0.00 56.93 56.54 2b39 s PHE 369 Cb -0.39 -1.94 0.26 0.00 -0.34 0.00 0.00 43.02 40.60 2b39 s PHE 369 CO 0.43 0.12 1.19 -0.51 -1.46 0.00 0.00 175.22 174.99 2b39 s ASP 370 N 0.08 7.28 0.40 6.13 1.01 -1.26 -2.18 116.67 128.12 2b39 s ASP 370 Ca 0.01 -3.48 -0.08 0.00 0.71 0.00 0.00 52.55 49.71 2b39 s ASP 370 Cb -0.13 -2.25 -0.05 0.00 1.01 0.00 0.00 42.92 41.49 2b39 s ASP 370 CO 0.02 -0.38 0.73 -1.48 0.21 0.00 0.00 175.17 174.27 2b39 s LEU 371 N -0.66 3.83 -0.51 1.23 2.34 -1.25 -4.48 118.68 119.18 2b39 s LEU 371 Ca 0.34 0.99 0.04 0.00 0.06 0.00 0.00 54.13 55.56 2b39 s LEU 371 Cb -0.08 -3.88 0.16 0.00 -0.56 0.00 0.00 46.19 41.83 2b39 s LEU 371 CO -0.06 -0.40 0.38 -0.04 -1.06 0.00 0.00 176.35 175.16 2b39 s MET 372 N -4.02 1.47 -0.87 1.48 -1.94 -1.26 -2.21 119.30 111.95 2b39 s MET 372 Ca 0.49 -2.49 -0.25 0.00 -1.71 0.00 0.00 55.69 51.72 2b39 s MET 372 Cb -0.10 -2.21 -0.10 0.00 2.01 0.00 0.00 34.83 34.43 2b39 s MET 372 CO 0.34 -1.32 2.19 0.08 -0.01 0.00 0.00 175.02 176.30 2b39 s VAL 373 N -0.39 3.21 -0.11 -6.03 1.01 -1.18 -4.00 120.40 112.91 2b39 s VAL 373 Ca 0.28 -0.19 -0.30 0.00 0.00 0.00 0.00 61.98 61.77 2b39 s VAL 373 Cb -0.03 -3.53 -0.02 0.00 0.00 0.00 0.00 36.38 32.79 2b39 s VAL 373 CO -0.16 -0.44 1.24 -0.47 0.00 0.00 0.00 175.10 175.27 2b39 s TYR 374 N 12.87 3.01 0.23 5.22 6.04 -0.20 -2.48 117.35 142.03 2b39 s TYR 374 Ca 0.82 1.10 0.10 0.00 0.04 0.00 0.00 57.07 59.13 2b39 s TYR 374 Cb -0.09 -3.47 -0.04 0.00 -1.04 0.00 0.00 41.96 37.31 2b39 s TYR 374 CO 0.05 -1.54 -0.11 0.08 -1.54 0.00 0.00 175.55 172.50 2b39 s VAL 375 N 2.84 3.03 0.09 3.14 1.01 -0.45 -0.79 120.40 129.27 2b39 s VAL 375 Ca 0.56 -1.93 -0.24 0.00 0.00 0.00 0.00 61.98 60.37 2b39 s VAL 375 Cb -0.23 -2.55 0.06 0.00 0.00 0.00 0.00 36.38 33.66 2b39 s VAL 375 CO 0.19 -0.25 0.59 0.42 0.00 0.00 0.00 175.10 176.05 2b39 s THR 376 N -2.04 0.01 0.47 3.92 -4.23 -1.12 -3.66 115.64 108.99 2b39 s THR 376 Ca 0.27 -0.08 -0.04 0.00 -1.18 0.00 0.00 61.69 60.66 2b39 s THR 376 Cb -0.07 -1.01 -0.03 0.00 1.34 0.00 0.00 72.50 72.73 2b39 s THR 376 CO 0.16 -0.05 0.75 0.20 -0.54 0.00 0.00 174.62 175.15 2b39 s ASN 377 N -2.26 6.14 0.00 3.99 0.01 0.19 -1.20 114.94 121.81 2b39 s ASN 377 Ca -0.03 0.77 0.00 0.00 -0.71 0.00 0.00 52.86 52.89 2b39 s ASN 377 Cb -0.01 -2.08 0.00 0.00 0.41 0.00 0.00 41.25 39.58 2b39 s ASN 377 CO -0.06 -0.61 0.02 -0.81 -1.51 0.00 0.00 177.10 174.13 2b39 n PRO 378 N -2.22 0.00 -1.49 -0.60 -0.04 -1.25 -2.30 135.00 127.11 2b39 n PRO 378 Ca 0.00 0.00 -0.04 0.00 -0.04 0.00 0.00 63.50 63.42 2b39 n PRO 378 Cb 0.56 -1.20 0.01 0.00 -0.04 0.00 0.00 33.50 32.83 2b39 n PRO 378 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 2b39 n ASP 379 N 1.74 -0.93 -3.51 3.54 5.75 -1.26 -4.86 116.55 117.03 2b39 n ASP 379 Ca 0.00 -1.72 -0.22 0.00 -0.01 0.00 0.00 54.79 52.83 2b39 n ASP 379 Cb 0.00 0.36 0.05 0.00 -1.03 0.00 0.00 41.12 40.50 2b39 n ASP 379 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2b39 n GLY 380 N -0.48 -0.89 2.57 6.12 0.00 -0.97 -4.99 105.19 106.54 2b39 n GLY 380 Ca -0.19 0.42 -0.28 0.00 0.00 0.00 0.00 46.02 45.98 2b39 n GLY 380 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2b39 s SER 381 N -3.66 3.18 -0.35 1.61 1.04 -1.23 -4.95 113.70 109.35 2b39 s SER 381 Ca 0.35 -1.11 -0.38 0.00 0.48 0.00 0.00 55.95 55.29 2b39 s SER 381 Cb -0.09 -0.28 -0.17 0.00 0.10 0.00 0.00 66.02 65.59 2b39 s SER 381 CO 0.80 -0.42 1.25 -2.65 0.98 0.00 0.00 173.24 173.20 2b39 n PRO 382 N 5.26 0.00 -1.75 4.02 -0.02 -1.26 -0.64 135.00 140.61 2b39 n PRO 382 Ca -0.06 0.00 -0.31 0.00 -2.02 0.00 0.00 63.50 61.11 2b39 n PRO 382 Cb 0.44 -1.24 0.04 0.00 -0.02 0.00 0.00 33.50 32.71 2b39 n PRO 382 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2b39 s ALA 383 N 2.07 2.84 1.00 3.55 0.00 -1.24 -4.74 121.76 125.24 2b39 s ALA 383 Ca 0.85 -0.10 0.00 0.00 0.00 0.00 0.00 51.96 52.71 2b39 s ALA 383 Cb -1.21 -3.10 0.00 0.00 0.00 0.00 0.00 23.12 18.81 2b39 s ALA 383 CO 0.65 -1.06 0.00 0.54 0.00 0.00 0.00 175.76 175.89 2b39 n ARG 384 N -2.99 1.35 -1.50 0.00 5.12 -1.26 -4.17 116.66 113.21 2b39 n ARG 384 Ca 0.07 0.00 -0.44 0.00 -1.93 0.00 0.00 57.85 55.54 2b39 n ARG 384 Cb 0.55 0.00 -0.06 0.00 -1.16 0.00 0.00 32.46 31.78 2b39 n ARG 384 CO 0.00 0.00 0.00 0.72 -1.93 0.00 0.00 177.63 176.42 2b39 n HIS 385 N -0.39 1.48 -4.57 -1.55 8.25 -1.23 -4.31 115.22 112.89 2b39 n HIS 385 Ca 0.00 0.18 -0.22 0.00 -0.26 0.00 0.00 57.72 57.42 2b39 n HIS 385 Cb 0.00 -2.57 -0.15 0.00 1.12 0.00 0.00 29.99 28.38 2b39 n HIS 385 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 2b39 s ILE 386 N 9.03 1.03 -0.78 1.59 1.01 -0.84 -4.91 121.20 127.34 2b39 s ILE 386 Ca 1.09 -0.52 -0.26 0.00 0.00 0.00 0.00 60.65 60.95 2b39 s ILE 386 Cb -0.64 -0.88 0.04 0.00 0.01 0.00 0.00 42.46 40.98 2b39 s ILE 386 CO 0.41 0.30 1.28 -2.16 0.00 0.00 0.00 174.94 174.77 2b39 s PRO 387 N -0.05 3.24 -0.60 2.79 0.04 -1.26 0.19 135.00 139.35 2b39 s PRO 387 Ca 0.00 -0.41 -0.19 0.00 0.04 0.00 0.00 61.00 60.44 2b39 s PRO 387 Cb -0.08 -4.35 0.11 0.00 0.04 0.00 0.00 34.50 30.22 2b39 s PRO 387 CO 0.00 -2.13 0.70 0.08 0.04 0.00 0.00 177.00 175.69 2b39 s VAL 388 N 5.50 4.85 0.51 -0.36 1.01 -1.19 -1.75 120.40 128.97 2b39 s VAL 388 Ca 0.36 -1.05 0.06 0.00 0.00 0.00 0.00 61.98 61.34 2b39 s VAL 388 Cb -0.07 -4.49 0.04 0.00 0.00 0.00 0.00 36.38 31.86 2b39 s VAL 388 CO 0.11 -1.12 0.71 -0.69 0.00 0.00 0.00 175.10 174.11 2b39 s VAL 389 N 2.60 2.66 0.17 2.92 1.01 -0.68 -3.33 120.40 125.75 2b39 s VAL 389 Ca 0.11 -0.87 0.02 0.00 0.00 0.00 0.00 61.98 61.25 2b39 s VAL 389 Cb -0.24 -2.79 -0.01 0.00 0.00 0.00 0.00 36.38 33.34 2b39 s VAL 389 CO 0.06 0.00 0.09 0.35 0.00 0.00 0.00 175.10 175.59 2b39 n THR 390 N -2.16 0.00 0.21 3.92 -2.24 -1.26 -2.55 114.28 110.20 2b39 n THR 390 Ca 0.10 -1.06 0.02 0.00 -2.27 0.00 0.00 64.05 60.85 2b39 n THR 390 Cb 0.60 0.44 0.12 0.00 -2.10 0.00 0.00 70.33 69.38 2b39 n THR 390 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2b39 n GLN 391 N -0.35 0.05 0.00 -0.78 6.02 -1.26 -1.41 117.38 119.65 2b39 n GLN 391 Ca -0.00 0.27 0.12 0.00 -0.01 0.00 0.00 57.00 57.38 2b39 n GLN 391 Cb 0.27 -1.50 0.13 0.00 1.02 0.00 0.00 30.24 30.16 2b39 n GLN 391 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2b39 n GLY 392 N -0.91 0.41 2.49 1.08 0.00 -1.26 -4.97 105.19 102.04 2b39 n GLY 392 Ca 0.02 -0.62 -0.21 0.00 0.00 0.00 0.00 46.02 45.21 2b39 n GLY 392 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2b39 n SER 393 N 0.57 -5.64 -4.87 1.61 3.41 -0.50 -4.98 113.62 103.21 2b39 n SER 393 Ca 0.13 0.24 -0.31 0.00 -0.26 0.00 0.00 58.87 58.67 2b39 n SER 393 Cb 0.51 -4.84 0.01 0.00 -0.26 0.00 0.00 64.21 59.63 2b39 n SER 393 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 175.04 175.08 2b39 s ASN 394 N -2.39 6.14 -0.57 4.04 0.01 -1.26 -4.97 114.94 115.94 2b39 s ASN 394 Ca 0.00 1.38 0.04 0.00 -0.71 0.00 0.00 52.86 53.57 2b39 s ASN 394 Cb 0.00 -2.41 0.15 0.00 0.41 0.00 0.00 41.25 39.41 2b39 s ASN 394 CO 0.00 -0.92 0.37 -0.69 -1.51 0.00 0.00 177.10 174.35 2b39 s VAL 395 N -3.20 2.20 1.06 1.60 1.01 -1.26 -4.18 120.40 117.63 2b39 s VAL 395 Ca 0.55 -3.52 -0.18 0.00 0.00 0.00 0.00 61.98 58.83 2b39 s VAL 395 Cb -0.11 -2.49 0.26 0.00 0.00 0.00 0.00 36.38 34.04 2b39 s VAL 395 CO 0.54 -0.97 1.10 1.67 0.00 0.00 0.00 175.10 177.44 2b39 n GLN 396 N 2.64 -2.35 -3.89 2.72 -0.06 -1.21 -4.95 117.38 110.29 2b39 n GLN 396 Ca 0.16 -1.73 -0.11 0.00 -2.00 0.00 0.00 57.00 53.31 2b39 n GLN 396 Cb 0.36 -1.43 -0.11 0.00 -4.06 0.00 0.00 30.24 25.00 2b39 n GLN 396 CO 0.00 0.00 0.00 0.45 -0.20 0.00 0.00 177.06 177.31 2b39 s SER 397 N -4.72 0.04 -0.40 1.69 0.15 -1.26 -3.15 113.70 106.06 2b39 s SER 397 Ca 0.68 -0.17 -0.17 0.00 0.70 0.00 0.00 55.95 56.98 2b39 s SER 397 Cb -0.05 0.18 0.01 0.00 -1.71 0.00 0.00 66.02 64.46 2b39 s SER 397 CO 0.50 -0.27 0.46 -0.22 1.20 0.00 0.00 173.24 174.91 2b39 s LEU 398 N -1.04 4.66 0.90 3.45 2.96 0.50 -3.86 118.68 126.26 2b39 s LEU 398 Ca -0.11 -0.45 -0.10 0.00 -0.22 0.00 0.00 54.13 53.24 2b39 s LEU 398 Cb -0.06 -2.45 0.14 0.00 0.50 0.00 0.00 46.19 44.31 2b39 s LEU 398 CO 0.01 -0.55 1.15 0.42 -1.32 0.00 0.00 176.35 176.06 2b39 s THR 399 N 2.24 2.12 -0.19 3.68 -4.23 -1.26 -1.99 115.64 116.01 2b39 s THR 399 Ca 0.14 0.04 0.05 0.00 -1.18 0.00 0.00 61.69 60.74 2b39 s THR 399 Cb -0.16 -2.10 -0.15 0.00 1.34 0.00 0.00 72.50 71.42 2b39 s THR 399 CO 0.14 -0.05 -0.12 0.00 -0.54 0.00 0.00 174.62 174.05 2b39 n GLN 400 N -4.16 0.75 0.31 3.99 10.64 -1.26 -2.09 117.38 125.56 2b39 n GLN 400 Ca 0.12 0.08 0.19 0.00 -1.83 0.00 0.00 57.00 55.56 2b39 n GLN 400 Cb 0.52 -1.41 0.98 0.00 -0.86 0.00 0.00 30.24 29.47 2b39 n GLN 400 CO 0.00 0.00 0.00 -0.44 -1.83 0.00 0.00 177.06 174.79 2b39 h ASP 401 N 0.00 0.00 0.00 2.61 3.32 -1.92 -3.02 116.42 117.41 2b39 h ASP 401 Ca -0.45 0.00 -0.03 0.00 0.02 0.00 0.00 57.03 56.57 2b39 h ASP 401 Cb 1.79 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 41.33 2b39 h ASP 401 CO -0.05 0.03 -1.12 0.47 -1.72 0.00 0.00 179.24 176.85 2b39 n ASP 402 N -3.31 4.50 0.00 6.45 8.00 -1.26 -4.98 116.55 125.95 2b39 n ASP 402 Ca -0.02 -0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.48 2b39 n ASP 402 Cb 0.15 0.50 0.00 0.00 -0.02 0.00 0.00 41.12 41.75 2b39 n ASP 402 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2b39 n GLY 403 N 2.93 0.99 3.17 0.44 0.00 -0.89 -4.83 105.19 107.00 2b39 n GLY 403 Ca -0.03 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.59 2b39 n GLY 403 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2b39 s VAL 404 N -2.40 4.41 0.93 1.61 1.01 -1.26 -1.34 120.40 123.36 2b39 s VAL 404 Ca 0.00 -2.94 -0.11 0.00 0.00 0.00 0.00 61.98 58.93 2b39 s VAL 404 Cb 0.00 -3.80 0.12 0.00 0.00 0.00 0.00 36.38 32.70 2b39 s VAL 404 CO 0.00 -0.96 0.92 0.00 0.00 0.00 0.00 175.10 175.07 2b39 n ALA 405 N 3.46 -1.37 -2.52 5.51 0.00 -1.04 -4.53 120.51 120.02 2b39 n ALA 405 Ca 0.12 -0.58 -0.25 0.00 0.00 0.00 0.00 53.44 52.73 2b39 n ALA 405 Cb 0.40 -2.08 -0.10 0.00 0.00 0.00 0.00 19.45 17.68 2b39 n ALA 405 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 2b39 s LYS 406 N -4.34 1.81 0.36 0.00 -0.14 -1.25 -3.13 119.74 113.05 2b39 s LYS 406 Ca 0.64 -1.83 -0.12 0.00 -1.36 0.00 0.00 55.97 53.29 2b39 s LYS 406 Cb -0.22 -1.77 0.05 0.00 -1.68 0.00 0.00 37.83 34.20 2b39 s LYS 406 CO 0.61 0.22 0.70 -0.11 -0.76 0.00 0.00 175.35 176.01 2b39 n LEU 407 N -0.75 0.00 -3.65 3.17 0.00 -0.94 -4.53 117.00 110.31 2b39 n LEU 407 Ca -0.05 -2.36 -0.01 0.00 0.00 0.00 0.00 56.01 53.59 2b39 n LEU 407 Cb 0.62 3.38 -0.06 0.00 0.00 0.00 0.00 43.42 47.36 2b39 n LEU 407 CO 0.41 -0.77 0.80 -0.44 0.00 0.00 0.00 177.39 177.40 2b39 s SER 408 N -2.88 -0.34 -0.10 1.96 0.01 -1.25 -3.74 113.70 107.36 2b39 s SER 408 Ca 0.15 0.54 0.01 0.00 1.31 0.00 0.00 55.95 57.97 2b39 s SER 408 Cb -0.04 1.11 0.02 0.00 0.21 0.00 0.00 66.02 67.32 2b39 s SER 408 CO 0.11 -0.09 -0.10 0.27 0.41 0.00 0.00 173.24 173.85 2b39 s ILE 409 N 1.18 1.12 -0.77 1.44 -5.25 -0.93 -4.89 121.20 113.11 2b39 s ILE 409 Ca -0.08 -0.40 -0.25 0.00 -0.99 0.00 0.00 60.65 58.92 2b39 s ILE 409 Cb -0.03 -1.08 -0.02 0.00 2.95 0.00 0.00 42.46 44.27 2b39 s ILE 409 CO -0.13 0.37 1.81 0.54 -1.79 0.00 0.00 174.94 175.75 2b39 s ASN 410 N 1.24 5.39 0.97 4.36 4.22 -1.26 0.22 114.94 130.08 2b39 s ASN 410 Ca -0.03 -0.27 -0.14 0.00 -2.14 0.00 0.00 52.86 50.27 2b39 s ASN 410 Cb -0.14 -2.55 0.18 0.00 1.28 0.00 0.00 41.25 40.02 2b39 s ASN 410 CO -0.03 -2.41 1.18 0.42 -2.04 0.00 0.00 177.10 174.21 2b39 s THR 411 N 8.88 1.93 0.47 0.54 -4.23 -1.15 -4.91 115.64 117.16 2b39 s THR 411 Ca 0.64 0.00 0.01 0.00 -1.18 0.00 0.00 61.69 61.16 2b39 s THR 411 Cb -0.09 -2.78 -0.00 0.00 1.34 0.00 0.00 72.50 70.97 2b39 s THR 411 CO 0.09 0.00 0.03 0.00 -0.54 0.00 0.00 174.62 174.20 2b39 n GLN 412 N -3.92 0.78 -2.48 3.99 0.00 -1.26 -3.66 117.38 110.84 2b39 n GLN 412 Ca 0.10 -3.51 -0.39 0.00 0.00 0.00 0.00 57.00 53.19 2b39 n GLN 412 Cb 0.59 1.10 -0.03 0.00 0.00 0.00 0.00 30.24 31.91 2b39 n GLN 412 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.06 176.26 2b39 s ASN 413 N -3.63 6.36 0.07 2.61 0.01 -1.26 -1.02 114.94 118.09 2b39 s ASN 413 Ca 0.04 -1.68 -0.26 0.00 -0.71 0.00 0.00 52.86 50.25 2b39 s ASN 413 Cb 0.00 -2.57 0.08 0.00 0.41 0.00 0.00 41.25 39.17 2b39 s ASN 413 CO 0.03 -1.64 0.72 -0.54 -1.51 0.00 0.00 177.10 174.15 2b39 s LYS 414 N 5.07 1.08 0.00 -0.60 1.02 -1.26 -4.97 119.74 120.08 2b39 s LYS 414 Ca 0.52 -0.33 0.04 0.00 0.02 0.00 0.00 55.97 56.23 2b39 s LYS 414 Cb 0.00 0.50 0.05 0.00 -0.52 0.00 0.00 37.83 37.87 2b39 s LYS 414 CO -0.02 -0.46 0.76 0.54 -0.92 0.00 0.00 175.35 175.24 2b39 n ARG 415 N -0.18 0.51 -0.84 1.68 1.74 -1.26 -4.55 116.66 113.76 2b39 n ARG 415 Ca -0.14 -1.00 -0.29 0.00 -0.77 0.00 0.00 57.85 55.65 2b39 n ARG 415 Cb 0.63 -1.08 0.21 0.00 -1.02 0.00 0.00 32.46 31.20 2b39 n ARG 415 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2b39 s ASP 416 N -0.52 1.90 0.00 0.55 1.01 -1.26 -4.26 116.67 114.10 2b39 s ASP 416 Ca 0.06 1.43 -0.30 0.00 0.71 0.00 0.00 52.55 54.45 2b39 s ASP 416 Cb 0.03 -2.14 -0.04 0.00 1.01 0.00 0.00 42.92 41.78 2b39 s ASP 416 CO 0.05 -3.62 1.13 -2.16 0.21 0.00 0.00 175.17 170.78 2b39 s PRO 417 N -4.70 4.45 -0.57 8.23 0.04 -1.26 -4.77 135.00 136.41 2b39 s PRO 417 Ca 0.67 1.62 -0.23 0.00 0.04 0.00 0.00 61.00 63.10 2b39 s PRO 417 Cb -0.22 -3.44 0.05 0.00 0.04 0.00 0.00 34.50 30.93 2b39 s PRO 417 CO 0.61 -0.25 0.91 -1.17 0.04 0.00 0.00 177.00 177.14 2b39 s LEU 418 N 1.41 4.27 -0.67 -3.56 2.96 -1.12 -4.94 118.68 117.03 2b39 s LEU 418 Ca 0.55 -0.58 -0.08 0.00 -0.22 0.00 0.00 54.13 53.80 2b39 s LEU 418 Cb -0.25 -2.67 0.17 0.00 0.50 0.00 0.00 46.19 43.94 2b39 s LEU 418 CO 0.26 -1.24 0.54 -0.89 -1.32 0.00 0.00 176.35 173.70 2b39 s THR 419 N 3.83 4.51 -0.31 3.68 2.01 -1.26 -2.29 115.64 125.81 2b39 s THR 419 Ca 0.26 -2.54 -0.16 0.00 0.31 0.00 0.00 61.69 59.56 2b39 s THR 419 Cb -0.14 -3.88 -0.02 0.00 0.01 0.00 0.00 72.50 68.47 2b39 s THR 419 CO 0.16 -0.91 0.43 0.27 -0.69 0.00 0.00 174.62 173.88 2b39 s ILE 420 N 0.31 5.11 0.46 1.82 -5.25 -0.84 -4.91 121.20 117.91 2b39 s ILE 420 Ca 0.15 0.42 -0.02 0.00 -0.99 0.00 0.00 60.65 60.22 2b39 s ILE 420 Cb -0.18 -3.82 -0.01 0.00 2.95 0.00 0.00 42.46 41.40 2b39 s ILE 420 CO -0.05 -0.02 0.71 0.42 -1.79 0.00 0.00 174.94 174.21 2b39 s THR 421 N 2.19 4.27 -0.07 8.37 -4.23 -1.26 -1.37 115.64 123.54 2b39 s THR 421 Ca 0.16 -0.29 -0.03 0.00 -1.18 0.00 0.00 61.69 60.35 2b39 s THR 421 Cb -0.16 -3.60 0.04 0.00 1.34 0.00 0.00 72.50 70.12 2b39 s THR 421 CO 0.11 -0.48 0.13 -0.69 -0.54 0.00 0.00 174.62 173.15 2b39 s VAL 422 N -2.62 -0.18 0.42 2.29 1.01 -1.18 -4.08 120.40 116.06 2b39 s VAL 422 Ca 0.48 0.33 0.07 0.00 0.00 0.00 0.00 61.98 62.86 2b39 s VAL 422 Cb -0.10 -0.24 -0.04 0.00 0.00 0.00 0.00 36.38 36.00 2b39 s VAL 422 CO 0.40 0.14 0.24 -0.13 0.00 0.00 0.00 175.10 175.75 2b39 s ARG 423 N 1.97 2.31 -0.29 2.72 3.00 -1.06 -3.11 118.95 124.50 2b39 s ARG 423 Ca 0.00 -1.76 0.03 0.00 0.00 0.00 0.00 55.73 54.00 2b39 s ARG 423 Cb -0.12 -2.10 0.08 0.00 0.00 0.00 0.00 34.95 32.81 2b39 s ARG 423 CO -0.05 -0.15 -0.04 0.95 0.00 0.00 0.00 175.30 176.01 2b39 s THR 424 N -2.57 2.06 -1.20 0.02 -4.23 -1.25 -1.68 115.64 106.80 2b39 s THR 424 Ca 0.43 -1.81 -0.05 0.00 -1.18 0.00 0.00 61.69 59.08 2b39 s THR 424 Cb 0.02 -2.33 0.22 0.00 1.34 0.00 0.00 72.50 71.75 2b39 s THR 424 CO 0.24 -0.26 1.95 0.29 -0.54 0.00 0.00 174.62 176.30 2b39 n LYS 425 N 4.42 4.51 -2.42 3.99 5.02 -0.72 -4.43 118.16 128.54 2b39 n LYS 425 Ca -0.07 -3.97 -0.38 0.00 -2.02 0.00 0.00 58.31 51.87 2b39 n LYS 425 Cb 0.42 -2.65 -0.03 0.00 -0.02 0.00 0.00 35.03 32.76 2b39 n LYS 425 CO 0.00 0.00 0.00 0.21 -0.52 0.00 0.00 177.40 177.09 2b39 s LYS 426 N -1.80 3.39 0.31 1.97 2.47 -1.26 -4.73 119.74 120.09 2b39 s LYS 426 Ca 0.42 -1.21 0.13 0.00 -1.56 0.00 0.00 55.97 53.76 2b39 s LYS 426 Cb 0.13 -5.34 0.46 0.00 -1.46 0.00 0.00 37.83 31.62 2b39 s LYS 426 CO -0.03 -2.63 0.65 -0.40 0.16 0.00 0.00 175.35 173.10 2b39 n ASP 427 N 10.29 0.00 0.26 1.43 5.75 -1.26 -1.36 116.55 131.65 2b39 n ASP 427 Ca 0.40 0.38 0.10 0.00 -0.01 0.00 0.00 54.79 55.66 2b39 n ASP 427 Cb 0.48 -0.13 0.69 0.00 -1.03 0.00 0.00 41.12 41.13 2b39 n ASP 427 CO 0.00 0.00 0.00 0.78 -0.11 0.00 0.00 177.20 177.87 2b39 h ASN 428 N 0.00 0.00 -2.69 -1.12 4.21 -2.02 -3.43 115.58 110.54 2b39 h ASN 428 Ca 0.25 0.00 -0.53 0.00 1.21 0.00 0.00 56.30 57.23 2b39 h ASN 428 Cb 1.49 0.00 -0.14 0.00 -1.12 0.00 0.00 38.32 38.55 2b39 h ASN 428 CO -0.00 0.09 -0.70 0.27 -1.29 0.00 0.00 177.43 175.80 2b39 s ILE 429 N -4.58 1.90 0.81 2.81 -4.36 -0.47 -5.14 121.20 112.17 2b39 s ILE 429 Ca -0.04 -2.20 -0.11 0.00 -0.26 0.00 0.00 60.65 58.04 2b39 s ILE 429 Cb 0.15 -2.39 0.08 0.00 1.25 0.00 0.00 42.46 41.55 2b39 s ILE 429 CO 0.63 -0.35 1.09 -2.16 0.24 0.00 0.00 174.94 174.38 2b39 s PRO 430 N -3.66 1.99 0.00 0.37 0.04 -1.26 -4.79 135.00 127.69 2b39 s PRO 430 Ca 0.29 0.78 0.00 0.00 0.04 0.00 0.00 61.00 62.10 2b39 s PRO 430 Cb 0.01 -1.90 0.00 0.00 0.04 0.00 0.00 34.50 32.66 2b39 s PRO 430 CO 0.12 -1.72 0.83 -0.85 0.04 0.00 0.00 177.00 175.42 2b39 n GLU 431 N -3.52 0.68 0.04 4.56 0.28 -1.26 -3.21 120.64 118.21 2b39 n GLU 431 Ca 0.07 0.00 -0.20 0.00 -0.16 0.00 0.00 57.16 56.87 2b39 n GLU 431 Cb 0.55 -1.16 -0.11 0.00 1.43 0.00 0.00 31.44 32.15 2b39 n GLU 431 CO 0.00 0.00 0.00 0.78 -0.16 0.00 0.00 177.13 177.75 2b39 h GLY 432 N 3.35 0.67 -2.48 -1.84 0.00 -1.97 -3.30 103.07 97.51 2b39 h GLY 432 Ca 0.00 -1.21 -0.15 0.00 0.00 0.00 0.00 47.33 45.96 2b39 h GLY 432 CO 0.00 1.07 0.10 -0.96 0.00 0.00 0.00 176.54 176.75 2b39 n ARG 433 N -3.96 2.77 -2.06 4.80 1.85 -1.20 -4.96 116.66 113.90 2b39 n ARG 433 Ca -0.11 -3.03 -0.42 0.00 -1.00 0.00 0.00 57.85 53.28 2b39 n ARG 433 Cb 0.84 -1.96 -0.03 0.00 -1.05 0.00 0.00 32.46 30.25 2b39 n ARG 433 CO 0.00 0.00 0.00 1.14 -0.01 0.00 0.00 177.63 178.76 2b39 s GLN 434 N -3.04 4.24 -0.22 2.89 -2.07 -1.24 -4.39 119.66 115.83 2b39 s GLN 434 Ca 0.48 2.18 -0.27 0.00 -1.82 0.00 0.00 55.36 55.93 2b39 s GLN 434 Cb 0.40 -3.51 -0.00 0.00 -1.09 0.00 0.00 33.01 28.81 2b39 s GLN 434 CO 0.07 -0.63 0.91 0.00 -1.32 0.00 0.00 175.29 174.32 2b39 s ALA 435 N 2.24 3.62 0.34 2.60 0.00 -1.26 -4.75 121.76 124.55 2b39 s ALA 435 Ca 0.69 0.04 0.07 0.00 0.00 0.00 0.00 51.96 52.76 2b39 s ALA 435 Cb -0.37 -3.38 -0.02 0.00 0.00 0.00 0.00 23.12 19.35 2b39 s ALA 435 CO 0.30 -0.89 0.35 0.99 0.00 0.00 0.00 175.76 176.51 2b39 s THR 436 N 2.78 3.57 -0.30 0.00 2.01 -1.26 -3.75 115.64 118.69 2b39 s THR 436 Ca 0.40 -1.27 -0.18 0.00 0.31 0.00 0.00 61.69 60.95 2b39 s THR 436 Cb -0.16 -3.22 0.18 0.00 0.01 0.00 0.00 72.50 69.32 2b39 s THR 436 CO 0.09 -0.15 1.22 -0.60 -0.69 0.00 0.00 174.62 174.49 2b39 s ARG 437 N -4.06 0.07 0.07 4.92 6.06 -1.18 -4.84 118.95 119.99 2b39 s ARG 437 Ca 0.43 0.15 0.01 0.00 -2.50 0.00 0.00 55.73 53.82 2b39 s ARG 437 Cb -0.07 0.08 -0.04 0.00 0.06 0.00 0.00 34.95 34.99 2b39 s ARG 437 CO 0.28 -0.05 0.15 -0.08 -2.50 0.00 0.00 175.30 173.10 2b39 s THR 438 N 2.53 4.99 0.34 4.11 -1.32 -1.26 -3.10 115.64 121.92 2b39 s THR 438 Ca -0.04 -0.57 0.05 0.00 -1.21 0.00 0.00 61.69 59.92 2b39 s THR 438 Cb -0.05 -3.42 -0.07 0.00 -1.51 0.00 0.00 72.50 67.45 2b39 s THR 438 CO -0.12 0.13 0.04 -0.32 -2.21 0.00 0.00 174.62 172.13 2b39 s MET 439 N -2.47 1.71 -0.11 7.08 1.75 -0.47 -4.97 119.30 121.82 2b39 s MET 439 Ca 0.32 -1.94 -0.05 0.00 -1.25 0.00 0.00 55.69 52.76 2b39 s MET 439 Cb -0.13 -1.06 0.05 0.00 2.84 0.00 0.00 34.83 36.53 2b39 s MET 439 CO 0.25 -0.14 0.26 -1.14 -0.65 0.00 0.00 175.02 173.60 2b39 s GLN 440 N -3.84 0.22 0.09 4.11 0.74 -1.26 -1.98 119.66 117.74 2b39 s GLN 440 Ca 0.36 0.55 0.07 0.00 0.05 0.00 0.00 55.36 56.39 2b39 s GLN 440 Cb 0.09 -0.11 -0.03 0.00 1.10 0.00 0.00 33.01 34.05 2b39 s GLN 440 CO 0.16 -0.17 -0.19 0.00 -0.55 0.00 0.00 175.29 174.54 2b39 s ALA 441 N 1.31 1.66 -0.07 1.58 0.00 -0.97 -4.93 121.76 120.33 2b39 s ALA 441 Ca -0.09 -1.18 0.06 0.00 0.00 0.00 0.00 51.96 50.75 2b39 s ALA 441 Cb -0.10 -0.22 -0.01 0.00 0.00 0.00 0.00 23.12 22.79 2b39 s ALA 441 CO -0.09 0.32 -0.25 -0.51 0.00 0.00 0.00 175.76 175.23 2b39 s LEU 442 N -1.84 2.08 0.97 0.00 1.02 -1.08 -2.79 118.68 117.04 2b39 s LEU 442 Ca 0.05 -0.52 -0.15 0.00 0.02 0.00 0.00 54.13 53.52 2b39 s LEU 442 Cb -0.10 -1.38 -0.04 0.00 0.02 0.00 0.00 46.19 44.69 2b39 s LEU 442 CO 0.04 0.22 -0.12 -0.81 0.02 0.00 0.00 176.35 175.70 2b39 n PRO 443 N 3.09 -0.20 -3.33 1.29 -0.04 -1.26 -2.91 135.00 131.64 2b39 n PRO 443 Ca -0.18 -0.03 -0.39 0.00 -0.04 0.00 0.00 63.50 62.86 2b39 n PRO 443 Cb 0.52 -1.50 -0.08 0.00 -0.04 0.00 0.00 33.50 32.41 2b39 n PRO 443 CO 0.00 0.00 0.00 -0.47 -0.04 0.00 0.00 175.50 174.99 2b39 s TYR 444 N -2.23 3.30 -0.21 0.54 5.04 -0.57 -4.74 117.35 118.48 2b39 s TYR 444 Ca 0.50 0.56 -0.19 0.00 -2.44 0.00 0.00 57.07 55.50 2b39 s TYR 444 Cb -0.19 -2.61 -0.03 0.00 0.35 0.00 0.00 41.96 39.48 2b39 s TYR 444 CO 0.74 -0.17 0.57 -0.80 -1.34 0.00 0.00 175.55 174.54 2b39 s ASN 445 N 1.40 6.59 0.39 4.32 -0.87 -1.26 -4.81 114.94 120.70 2b39 s ASN 445 Ca 0.19 0.71 -0.18 0.00 -1.57 0.00 0.00 52.86 52.01 2b39 s ASN 445 Cb -0.15 -2.32 -0.10 0.00 -0.02 0.00 0.00 41.25 38.66 2b39 s ASN 445 CO 0.09 -0.25 0.86 0.28 -2.57 0.00 0.00 177.10 175.51 2b39 s THR 446 N 1.91 4.52 -0.03 1.60 -1.32 -1.26 -4.20 115.64 116.86 2b39 s THR 446 Ca 0.26 1.24 -0.30 0.00 -1.21 0.00 0.00 61.69 61.68 2b39 s THR 446 Cb -0.16 -3.61 -0.08 0.00 -1.51 0.00 0.00 72.50 67.15 2b39 s THR 446 CO 0.10 -0.28 1.97 0.00 -2.21 0.00 0.00 174.62 174.19 2b39 s GLN 447 N -3.13 3.96 -0.28 7.08 -2.07 -1.26 -4.07 119.66 119.88 2b39 s GLN 447 Ca 0.59 2.43 -0.03 0.00 -1.82 0.00 0.00 55.36 56.52 2b39 s GLN 447 Cb -0.10 -4.18 0.00 0.00 -1.09 0.00 0.00 33.01 27.65 2b39 s GLN 447 CO 0.16 -1.16 0.13 0.41 -1.32 0.00 0.00 175.29 173.50 2b39 n GLY 448 N 4.72 -3.36 0.34 2.60 0.00 -1.26 -3.95 105.19 104.28 2b39 n GLY 448 Ca 0.21 0.52 0.00 0.00 0.00 0.00 0.00 46.02 46.76 2b39 n GLY 448 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2b39 n ASN 449 N 0.36 0.00 -3.31 1.61 3.02 -1.26 -4.84 115.26 110.84 2b39 n ASN 449 Ca 0.03 0.00 -0.26 0.00 -0.03 0.00 0.00 54.58 54.31 2b39 n ASN 449 Cb 0.10 -0.13 0.24 0.00 -0.61 0.00 0.00 39.78 39.37 2b39 n ASN 449 CO 0.00 0.00 0.00 -0.24 -2.62 0.00 0.00 177.26 174.40 2b39 n SER 450 N 0.42 -2.93 -2.75 6.41 2.88 -1.25 -5.02 113.62 111.37 2b39 n SER 450 Ca 0.00 -0.93 -0.03 0.00 -1.33 0.00 0.00 58.87 56.58 2b39 n SER 450 Cb 0.00 -0.87 0.05 0.00 -0.75 0.00 0.00 64.21 62.63 2b39 n SER 450 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40 2b39 n ASN 451 N -5.06 1.89 -4.18 -3.46 4.13 -1.26 -4.76 115.26 102.57 2b39 n ASN 451 Ca 0.13 -2.23 -0.40 0.00 1.68 0.00 0.00 54.58 53.76 2b39 n ASN 451 Cb 0.52 -0.47 -0.07 0.00 -1.54 0.00 0.00 39.78 38.22 2b39 n ASN 451 CO 0.00 0.00 0.00 0.20 0.28 0.00 0.00 177.26 177.74 2b39 s ASN 452 N -3.75 5.84 0.53 6.41 0.01 -1.26 -3.89 114.94 118.83 2b39 s ASN 452 Ca 0.29 -2.89 0.05 0.00 -0.71 0.00 0.00 52.86 49.61 2b39 s ASN 452 Cb 0.34 -1.99 0.03 0.00 0.41 0.00 0.00 41.25 40.04 2b39 s ASN 452 CO -0.03 -0.42 0.35 -0.31 -1.51 0.00 0.00 177.10 175.18 2b39 s TYR 453 N -0.12 1.71 -0.26 2.20 4.12 -0.88 -4.84 117.35 119.29 2b39 s TYR 453 Ca 0.18 -0.83 -0.01 0.00 0.02 0.00 0.00 57.07 56.42 2b39 s TYR 453 Cb -0.16 -1.89 0.13 0.00 -1.52 0.00 0.00 41.96 38.52 2b39 s TYR 453 CO -0.06 -0.37 0.30 -1.17 0.02 0.00 0.00 175.55 174.27 2b39 s LEU 454 N -4.22 -0.33 -0.38 -1.29 2.96 -1.26 -3.35 118.68 110.81 2b39 s LEU 454 Ca 0.32 -0.42 -0.13 0.00 -0.22 0.00 0.00 54.13 53.68 2b39 s LEU 454 Cb -0.02 0.64 0.02 0.00 0.50 0.00 0.00 46.19 47.33 2b39 s LEU 454 CO 0.19 -0.36 0.25 -2.28 -1.32 0.00 0.00 176.35 172.84 2b39 s HIS 455 N 2.40 3.24 0.02 5.38 5.65 -1.03 -4.43 115.29 126.52 2b39 s HIS 455 Ca 0.09 -0.67 -0.18 0.00 0.25 0.00 0.00 55.06 54.55 2b39 s HIS 455 Cb -0.14 -2.51 -0.06 0.00 -1.18 0.00 0.00 32.58 28.69 2b39 s HIS 455 CO -0.25 -0.57 0.52 -0.51 -0.65 0.00 0.00 174.74 173.29 2b39 s LEU 456 N 1.64 4.47 0.13 8.88 1.43 -1.26 -2.19 118.68 131.78 2b39 s LEU 456 Ca 0.04 1.13 0.04 0.00 -1.03 0.00 0.00 54.13 54.31 2b39 s LEU 456 Cb -0.19 -2.80 -0.04 0.00 0.03 0.00 0.00 46.19 43.19 2b39 s LEU 456 CO 0.09 0.23 -0.09 -0.55 0.23 0.00 0.00 176.35 176.25 2b39 s SER 457 N -0.77 1.64 -0.17 2.29 0.15 -0.11 -4.98 113.70 111.75 2b39 s SER 457 Ca 0.28 -1.00 -0.28 0.00 0.70 0.00 0.00 55.95 55.65 2b39 s SER 457 Cb -0.18 0.01 0.08 0.00 -1.71 0.00 0.00 66.02 64.22 2b39 s SER 457 CO 0.16 -0.35 0.73 -0.69 1.20 0.00 0.00 173.24 174.29 2b39 s VAL 458 N -3.33 0.00 0.36 4.45 1.01 -1.26 -0.74 120.40 120.90 2b39 s VAL 458 Ca 0.15 0.00 -0.10 0.00 0.00 0.00 0.00 61.98 62.03 2b39 s VAL 458 Cb 0.03 -1.00 -0.07 0.00 0.00 0.00 0.00 36.38 35.34 2b39 s VAL 458 CO -0.01 0.00 0.71 -2.16 0.00 0.00 0.00 175.10 173.65 2b39 s PRO 459 N -0.37 3.78 -0.43 2.72 0.04 -1.26 -5.05 135.00 134.43 2b39 s PRO 459 Ca -0.05 0.40 -0.06 0.00 0.04 0.00 0.00 61.00 61.33 2b39 s PRO 459 Cb -0.03 -2.46 0.11 0.00 0.04 0.00 0.00 34.50 32.16 2b39 s PRO 459 CO 0.04 0.06 0.26 0.50 0.04 0.00 0.00 177.00 177.90 2b39 s ARG 460 N -3.62 2.30 -0.38 4.56 6.06 -1.26 -4.80 118.95 121.81 2b39 s ARG 460 Ca 0.50 -1.72 0.12 0.00 -2.50 0.00 0.00 55.73 52.13 2b39 s ARG 460 Cb -0.10 -3.73 0.39 0.00 0.06 0.00 0.00 34.95 31.56 2b39 s ARG 460 CO 0.29 -1.08 1.03 1.33 -2.50 0.00 0.00 175.30 174.36 2b39 n VAL 461 N 4.77 0.26 0.00 7.11 0.24 -1.26 -4.97 118.33 124.48 2b39 n VAL 461 Ca -0.06 -2.77 0.00 0.00 -2.04 0.00 0.00 64.34 59.47 2b39 n VAL 461 Cb 0.41 0.68 0.00 0.00 -1.47 0.00 0.00 33.84 33.46 2b39 n VAL 461 CO 0.00 0.00 0.00 1.21 -2.14 0.00 0.00 176.83 175.90 2b39 n GLU 462 N -0.02 0.00 -4.06 7.34 2.13 -1.26 -4.86 120.64 119.91 2b39 n GLU 462 Ca 0.10 0.00 -0.31 0.00 0.66 0.00 0.00 57.16 57.61 2b39 n GLU 462 Cb 0.76 0.00 -0.07 0.00 0.27 0.00 0.00 31.44 32.41 2b39 n GLU 462 CO 0.00 0.00 0.00 -0.51 -0.41 0.00 0.00 177.13 176.21 2b39 s LEU 463 N 0.00 3.83 0.93 4.31 1.43 -1.26 -4.71 118.68 123.21 2b39 s LEU 463 Ca 0.00 0.03 -0.20 0.00 -1.03 0.00 0.00 54.13 52.93 2b39 s LEU 463 Cb 0.00 -2.44 -0.08 0.00 0.03 0.00 0.00 46.19 43.70 2b39 s LEU 463 CO 0.00 0.20 -0.87 0.29 0.23 0.00 0.00 176.35 176.20 2b39 n LYS 464 N 0.63 -0.47 -0.22 1.70 4.76 -1.26 -4.16 118.16 119.14 2b39 n LYS 464 Ca -0.10 -0.14 0.03 0.00 -2.87 0.00 0.00 58.31 55.23 2b39 n LYS 464 Cb 0.52 -1.16 0.11 0.00 -1.84 0.00 0.00 35.03 32.66 2b39 n LYS 464 CO 0.00 0.00 0.00 -0.35 -1.37 0.00 0.00 177.40 175.68 2b39 n PRO 465 N 1.27 1.95 -0.07 1.97 -0.04 -1.26 -3.70 135.00 135.12 2b39 n PRO 465 Ca -0.01 -0.89 -0.09 0.00 -0.04 0.00 0.00 63.50 62.48 2b39 n PRO 465 Cb 0.57 -1.55 -0.09 0.00 -0.04 0.00 0.00 33.50 32.39 2b39 n PRO 465 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2b39 n GLY 466 N 0.40 -0.44 2.42 0.55 0.00 -1.25 -4.01 105.19 102.86 2b39 n GLY 466 Ca 0.08 -0.17 -0.23 0.00 0.00 0.00 0.00 46.02 45.70 2b39 n GLY 466 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2b39 n GLU 467 N -2.72 -4.13 -4.57 1.61 4.71 -1.24 -4.71 120.64 109.59 2b39 n GLU 467 Ca -0.25 -1.09 -0.21 0.00 -0.01 0.00 0.00 57.16 55.59 2b39 n GLU 467 Cb 0.87 -1.44 -0.15 0.00 -1.01 0.00 0.00 31.44 29.71 2b39 n GLU 467 CO 0.00 0.00 0.00 0.95 0.09 0.00 0.00 177.13 178.17 2b39 s THR 468 N -1.83 1.00 -0.09 2.62 -4.23 -1.26 -2.00 115.64 109.86 2b39 s THR 468 Ca 0.50 -0.54 0.02 0.00 -1.18 0.00 0.00 61.69 60.49 2b39 s THR 468 Cb -0.09 -0.84 -0.02 0.00 1.34 0.00 0.00 72.50 72.89 2b39 s THR 468 CO 0.42 0.28 -0.13 -0.22 -0.54 0.00 0.00 174.62 174.44 2b39 s LEU 469 N -0.27 2.77 -0.27 4.79 2.96 0.55 -4.89 118.68 124.33 2b39 s LEU 469 Ca 0.04 -0.23 -0.11 0.00 -0.22 0.00 0.00 54.13 53.61 2b39 s LEU 469 Cb -0.05 -1.59 -0.05 0.00 0.50 0.00 0.00 46.19 45.00 2b39 s LEU 469 CO -0.00 0.27 0.20 0.20 -1.32 0.00 0.00 176.35 175.70 2b39 s ASN 470 N -0.27 6.07 -0.24 3.68 0.01 -1.26 0.95 114.94 123.88 2b39 s ASN 470 Ca 0.02 0.06 -0.10 0.00 -0.71 0.00 0.00 52.86 52.12 2b39 s ASN 470 Cb -0.13 -2.13 -0.05 0.00 0.41 0.00 0.00 41.25 39.36 2b39 s ASN 470 CO 0.03 -0.04 0.15 -0.69 -1.51 0.00 0.00 177.10 175.04 2b39 s VAL 471 N 1.62 5.27 -0.15 1.60 1.01 0.17 -4.67 120.40 125.25 2b39 s VAL 471 Ca 0.08 0.15 -0.29 0.00 0.00 0.00 0.00 61.98 61.92 2b39 s VAL 471 Cb -0.15 -3.46 -0.01 0.00 0.00 0.00 0.00 36.38 32.76 2b39 s VAL 471 CO 0.09 0.34 1.12 0.20 0.00 0.00 0.00 175.10 176.85 2b39 s ASN 472 N 1.14 7.08 -0.91 3.32 0.01 0.09 -0.40 114.94 125.27 2b39 s ASN 472 Ca 0.07 1.58 -0.02 0.00 -0.71 0.00 0.00 52.86 53.78 2b39 s ASN 472 Cb -0.14 -2.55 0.24 0.00 0.41 0.00 0.00 41.25 39.22 2b39 s ASN 472 CO 0.05 -0.63 0.91 0.49 -1.51 0.00 0.00 177.10 176.41 2b39 n PHE 473 N 5.90 3.97 -2.37 2.20 3.01 -1.26 -0.93 117.46 127.99 2b39 n PHE 473 Ca 0.12 -3.91 -0.39 0.00 1.01 0.00 0.00 57.45 54.28 2b39 n PHE 473 Cb 0.46 -1.13 -0.03 0.00 -0.01 0.00 0.00 39.48 38.78 2b39 n PHE 473 CO 0.00 0.00 0.00 -1.01 1.01 0.00 0.00 176.76 176.76 2b39 s HIS 474 N -1.72 3.26 0.39 1.38 3.76 -0.93 -2.48 115.29 118.96 2b39 s HIS 474 Ca 0.30 1.60 0.08 0.00 -0.15 0.00 0.00 55.06 56.89 2b39 s HIS 474 Cb -0.03 -3.34 -0.07 0.00 1.11 0.00 0.00 32.58 30.25 2b39 s HIS 474 CO -0.08 -1.02 0.03 -1.17 -0.85 0.00 0.00 174.74 171.65 2b39 s LEU 475 N -2.13 2.92 -0.36 0.89 2.96 -1.15 -2.47 118.68 119.34 2b39 s LEU 475 Ca 0.52 -1.25 -0.02 0.00 -0.22 0.00 0.00 54.13 53.16 2b39 s LEU 475 Cb -0.31 -1.06 0.19 0.00 0.50 0.00 0.00 46.19 45.51 2b39 s LEU 475 CO 0.39 -0.41 0.89 -0.60 -1.32 0.00 0.00 176.35 175.30 2b39 s ARG 476 N -3.73 0.44 0.56 1.98 3.52 -1.21 -4.81 118.95 115.69 2b39 s ARG 476 Ca 0.36 -0.18 0.06 0.00 -0.13 0.00 0.00 55.73 55.84 2b39 s ARG 476 Cb 0.07 0.04 0.05 0.00 -1.56 0.00 0.00 34.95 33.55 2b39 s ARG 476 CO 0.19 -0.63 0.47 0.95 -0.81 0.00 0.00 175.30 175.47 2b39 s THR 477 N 1.81 1.63 0.28 4.11 -4.23 -1.26 -2.07 115.64 115.92 2b39 s THR 477 Ca 0.16 -1.43 0.11 0.00 -1.18 0.00 0.00 61.69 59.35 2b39 s THR 477 Cb 0.01 -2.06 -0.05 0.00 1.34 0.00 0.00 72.50 71.75 2b39 s THR 477 CO -0.11 0.00 -0.10 -1.81 -0.54 0.00 0.00 174.62 172.05 2b39 s ASP 478 N -4.36 4.00 0.00 3.99 -0.00 -1.25 -4.91 116.67 114.14 2b39 s ASP 478 Ca 0.37 -0.89 0.00 0.00 -0.00 0.00 0.00 52.55 52.02 2b39 s ASP 478 Cb -0.03 -0.52 0.00 0.00 -0.00 0.00 0.00 42.92 42.37 2b39 s ASP 478 CO 0.23 -0.01 0.00 -2.65 -0.00 0.00 0.00 175.17 172.74 2b39 n PRO 479 N -0.76 0.00 0.00 8.23 -0.02 -1.26 -2.96 135.00 138.23 2b39 n PRO 479 Ca -0.05 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.43 2b39 n PRO 479 Cb 0.60 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 34.08 2b39 n PRO 479 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2b39 n GLY 480 N 0.00 1.89 0.00 -1.23 0.00 -1.26 -4.74 105.19 99.85 2b39 n GLY 480 Ca 0.00 0.07 0.00 0.00 0.00 0.00 0.00 46.02 46.09 2b39 n GLY 480 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2b39 n GLU 481 N 0.00 0.00 0.21 1.61 -0.58 -1.15 -2.66 120.64 118.06 2b39 n GLU 481 Ca 0.00 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.74 2b39 n GLU 481 Cb 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 30.87 2b39 n GLU 481 CO 0.00 0.00 0.00 0.94 -0.48 0.00 0.00 177.13 177.59 2b39 n GLN 482 N -2.25 0.02 -0.11 3.49 7.27 -1.26 -0.81 117.38 123.73 2b39 n GLN 482 Ca 0.00 0.60 0.08 0.00 0.07 0.00 0.00 57.00 57.75 2b39 n GLN 482 Cb 0.00 -1.78 0.13 0.00 2.41 0.00 0.00 30.24 31.01 2b39 n GLN 482 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 2b39 n ALA 483 N -1.15 2.38 0.69 1.69 0.00 -1.09 -4.20 120.51 118.83 2b39 n ALA 483 Ca 0.00 -0.88 0.11 0.00 0.00 0.00 0.00 53.44 52.68 2b39 n ALA 483 Cb 0.67 -0.58 0.06 0.00 0.00 0.00 0.00 19.45 19.60 2b39 n ALA 483 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2b39 n LYS 484 N 0.93 0.20 -2.84 0.00 5.02 0.01 -4.75 118.16 116.74 2b39 n LYS 484 Ca 0.13 0.00 -0.43 0.00 -2.02 0.00 0.00 58.31 55.99 2b39 n LYS 484 Cb 0.45 -1.57 -0.03 0.00 -0.02 0.00 0.00 35.03 33.85 2b39 n LYS 484 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 2b39 s ILE 485 N -3.14 4.44 -1.91 -0.18 1.09 -1.26 -4.84 121.20 115.41 2b39 s ILE 485 Ca 0.06 -0.98 0.18 0.00 -1.10 0.00 0.00 60.65 58.80 2b39 s ILE 485 Cb 0.15 -4.79 0.30 0.00 -1.06 0.00 0.00 42.46 37.05 2b39 s ILE 485 CO 0.78 -1.57 1.22 -2.11 -0.10 0.00 0.00 174.94 173.17 2b39 n ARG 486 N 7.37 2.06 -3.75 2.79 0.00 -1.26 -4.69 116.66 119.18 2b39 n ARG 486 Ca 0.15 -1.93 -0.07 0.00 -0.00 0.00 0.00 57.85 56.00 2b39 n ARG 486 Cb 0.48 -1.38 0.03 0.00 -0.00 0.00 0.00 32.46 31.59 2b39 n ARG 486 CO 0.00 0.00 0.00 2.48 0.00 0.00 0.00 177.63 180.11 2b39 n TYR 487 N 1.06 -2.13 -3.36 2.89 -0.00 -1.26 0.84 117.16 115.20 2b39 n TYR 487 Ca 0.14 -1.70 -0.10 0.00 -0.00 0.00 0.00 57.90 56.24 2b39 n TYR 487 Cb 0.49 0.85 -0.08 0.00 -0.00 0.00 0.00 39.34 40.59 2b39 n TYR 487 CO 0.00 0.00 0.00 0.71 -0.00 0.00 0.00 176.86 177.57 2b39 s TYR 488 N -2.25 -0.79 -0.02 -3.48 2.02 -1.25 -4.63 117.35 106.95 2b39 s TYR 488 Ca 0.17 0.72 -0.30 0.00 -0.37 0.00 0.00 57.07 57.29 2b39 s TYR 488 Cb -0.04 -0.04 -0.04 0.00 -0.40 0.00 0.00 41.96 41.44 2b39 s TYR 488 CO 0.10 -0.74 1.14 0.99 -1.57 0.00 0.00 175.55 175.48 2b39 s THR 489 N 2.52 4.35 0.10 -0.71 2.01 -0.08 -3.03 115.64 120.81 2b39 s THR 489 Ca 0.12 1.68 0.07 0.00 0.31 0.00 0.00 61.69 63.87 2b39 s THR 489 Cb -0.15 -4.08 -0.03 0.00 0.01 0.00 0.00 72.50 68.25 2b39 s THR 489 CO -0.17 0.06 -0.19 -0.72 -0.69 0.00 0.00 174.62 172.91 2b39 s TYR 490 N 1.63 1.63 -0.02 4.92 -0.85 0.86 -1.73 117.35 123.79 2b39 s TYR 490 Ca 0.55 -0.43 0.03 0.00 -0.52 0.00 0.00 57.07 56.70 2b39 s TYR 490 Cb -0.25 -0.90 -0.00 0.00 0.38 0.00 0.00 41.96 41.19 2b39 s TYR 490 CO 0.25 0.17 -0.11 -1.64 -1.52 0.00 0.00 175.55 172.70 2b39 s MET 491 N -1.89 1.04 -0.23 -3.49 -1.94 -0.36 -0.19 119.30 112.25 2b39 s MET 491 Ca 0.04 -0.37 -0.12 0.00 -1.71 0.00 0.00 55.69 53.53 2b39 s MET 491 Cb -0.10 -0.97 -0.05 0.00 2.01 0.00 0.00 34.83 35.72 2b39 s MET 491 CO 0.04 0.17 0.22 0.42 -0.01 0.00 0.00 175.02 175.86 2b39 s ILE 492 N 0.04 5.32 -0.22 2.53 -1.09 0.30 -1.18 121.20 126.90 2b39 s ILE 492 Ca -0.01 0.32 -0.06 0.00 -2.23 0.00 0.00 60.65 58.67 2b39 s ILE 492 Cb -0.08 -3.56 -0.03 0.00 -1.58 0.00 0.00 42.46 37.21 2b39 s ILE 492 CO 0.00 0.32 0.04 -0.04 -1.23 0.00 0.00 174.94 174.04 2b39 s MET 493 N 1.12 3.70 -0.06 2.79 -1.94 0.24 0.10 119.30 125.25 2b39 s MET 493 Ca 0.11 -0.47 -0.02 0.00 -1.71 0.00 0.00 55.69 53.59 2b39 s MET 493 Cb -0.14 -3.21 0.04 0.00 2.01 0.00 0.00 34.83 33.53 2b39 s MET 493 CO 0.05 -0.03 0.12 1.21 -0.01 0.00 0.00 175.02 176.37 2b39 s ASN 494 N 1.16 0.13 -1.40 3.03 2.47 -0.57 0.14 114.94 119.89 2b39 s ASN 494 Ca 0.04 0.25 -0.09 0.00 0.42 0.00 0.00 52.86 53.47 2b39 s ASN 494 Cb -0.14 0.14 0.03 0.00 -1.45 0.00 0.00 41.25 39.83 2b39 s ASN 494 CO 0.03 -0.17 1.08 0.29 -3.72 0.00 0.00 177.10 174.61 2b39 n LYS 495 N 4.45 -6.91 -2.17 0.43 5.02 -1.26 -2.40 118.16 115.31 2b39 n LYS 495 Ca -0.22 0.74 -0.15 0.00 -2.02 0.00 0.00 58.31 56.66 2b39 n LYS 495 Cb 0.51 -5.72 -0.01 0.00 -0.02 0.00 0.00 35.03 29.79 2b39 n LYS 495 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2b39 n GLY 496 N -1.82 -0.02 3.16 0.72 0.00 -1.26 -4.84 105.19 101.13 2b39 n GLY 496 Ca -0.02 -0.26 -0.10 0.00 0.00 0.00 0.00 46.02 45.64 2b39 n GLY 496 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2b39 s LYS 497 N -4.56 0.86 -0.53 1.61 1.02 -1.01 -4.93 119.74 112.21 2b39 s LYS 497 Ca 0.00 -1.38 -0.25 0.00 0.02 0.00 0.00 55.97 54.36 2b39 s LYS 497 Cb 0.00 0.03 0.04 0.00 -0.52 0.00 0.00 37.83 37.38 2b39 s LYS 497 CO 0.00 -0.14 0.99 -1.17 -0.92 0.00 0.00 175.35 174.10 2b39 s LEU 498 N -3.04 3.95 -0.04 3.17 0.20 -1.26 -1.52 118.68 120.14 2b39 s LEU 498 Ca 0.17 -0.12 -0.00 0.00 0.69 0.00 0.00 54.13 54.87 2b39 s LEU 498 Cb 0.07 -3.01 -0.00 0.00 -0.43 0.00 0.00 46.19 42.82 2b39 s LEU 498 CO -0.02 -1.22 -0.00 0.25 -0.29 0.00 0.00 176.35 175.06 2b39 h LEU 499 N 11.03 0.00 -8.57 -0.68 5.85 0.39 -3.45 115.31 119.88 2b39 h LEU 499 Ca -0.25 0.00 -0.53 0.00 0.84 0.00 0.00 57.88 57.94 2b39 h LEU 499 Cb 1.07 0.00 -0.23 0.00 0.37 0.00 0.00 40.66 41.87 2b39 h LEU 499 CO 1.09 0.20 -0.82 -0.54 -0.34 0.00 0.00 178.44 178.03 2b39 s LYS 500 N -1.23 1.13 -0.11 1.25 -0.14 -1.14 -4.96 119.74 114.54 2b39 s LYS 500 Ca -0.00 -1.03 0.00 0.00 -1.36 0.00 0.00 55.97 53.58 2b39 s LYS 500 Cb 0.00 -1.30 0.02 0.00 -1.68 0.00 0.00 37.83 34.88 2b39 s LYS 500 CO 0.00 0.31 -0.10 0.08 -0.76 0.00 0.00 175.35 174.88 2b39 s VAL 501 N -1.05 1.21 0.15 3.17 1.01 -1.26 0.11 120.40 123.74 2b39 s VAL 501 Ca 0.05 -0.43 -0.24 0.00 0.00 0.00 0.00 61.98 61.36 2b39 s VAL 501 Cb -0.09 -1.18 0.07 0.00 0.00 0.00 0.00 36.38 35.18 2b39 s VAL 501 CO 0.03 0.39 0.74 -0.83 0.00 0.00 0.00 175.10 175.44 2b39 s GLY 502 N 1.45 -0.41 0.19 4.51 0.00 0.74 -5.01 107.32 108.79 2b39 s GLY 502 Ca 0.01 0.38 0.08 0.00 0.00 0.00 0.00 44.72 45.19 2b39 s GLY 502 CO -0.07 0.12 -0.16 1.09 0.00 0.00 0.00 173.10 174.09 2b39 s ARG 503 N -3.58 1.31 -0.43 2.90 3.03 -1.26 -0.10 118.95 120.82 2b39 s ARG 503 Ca 0.06 -1.53 0.02 0.00 2.03 0.00 0.00 55.73 56.31 2b39 s ARG 503 Cb -0.02 -1.20 0.14 0.00 -1.03 0.00 0.00 34.95 32.84 2b39 s ARG 503 CO -0.05 0.21 0.25 -1.14 -1.13 0.00 0.00 175.30 173.44 2b39 s GLN 504 N -3.35 1.18 1.04 3.89 -0.44 -1.17 -4.98 119.66 115.84 2b39 s GLN 504 Ca 0.20 -1.95 -0.14 0.00 -2.50 0.00 0.00 55.36 50.98 2b39 s GLN 504 Cb -0.03 -2.13 0.13 0.00 -1.64 0.00 0.00 33.01 29.34 2b39 s GLN 504 CO 0.07 -1.19 0.57 0.66 0.50 0.00 0.00 175.29 175.90 2b39 n TYR 505 N 3.52 -0.95 -4.05 1.67 4.01 -1.26 -3.96 117.16 116.14 2b39 n TYR 505 Ca 0.11 0.16 -0.10 0.00 -0.16 0.00 0.00 57.90 57.91 2b39 n TYR 505 Cb 0.36 -1.75 -0.11 0.00 -0.31 0.00 0.00 39.34 37.53 2b39 n TYR 505 CO 0.00 0.00 0.00 0.50 -0.46 0.00 0.00 176.86 176.90 2b39 s ARG 506 N -3.94 0.51 -0.08 -0.72 3.52 0.25 -4.85 118.95 113.64 2b39 s ARG 506 Ca 0.61 -0.89 0.00 0.00 -0.13 0.00 0.00 55.73 55.32 2b39 s ARG 506 Cb -0.20 -0.03 -0.03 0.00 -1.56 0.00 0.00 34.95 33.14 2b39 s ARG 506 CO 0.65 -0.03 -0.07 -1.21 -0.81 0.00 0.00 175.30 173.83 2b39 s GLU 507 N -2.38 2.92 0.40 5.12 0.41 -1.26 -4.41 118.70 119.50 2b39 s GLU 507 Ca -0.05 -0.55 -0.17 0.00 -0.41 0.00 0.00 54.97 53.79 2b39 s GLU 507 Cb -0.04 -2.64 -0.13 0.00 -1.78 0.00 0.00 34.13 29.54 2b39 s GLU 507 CO -0.03 0.58 -0.03 -2.30 -0.49 0.00 0.00 175.26 172.99 2b39 n PRO 508 N 2.49 0.00 -0.34 0.39 -0.02 -1.26 -2.26 135.00 134.00 2b39 n PRO 508 Ca -0.18 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.30 2b39 n PRO 508 Cb 0.53 -0.86 0.00 0.00 -0.02 0.00 0.00 33.50 33.15 2b39 n PRO 508 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2b39 n GLY 509 N 2.10 1.87 3.41 -1.23 0.00 -1.26 -4.96 105.19 105.11 2b39 n GLY 509 Ca 0.08 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.66 2b39 n GLY 509 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2b39 s GLN 510 N -0.06 3.08 0.00 1.61 -0.21 -0.96 -4.94 119.66 118.18 2b39 s GLN 510 Ca 0.00 -1.09 0.00 0.00 0.02 0.00 0.00 55.36 54.29 2b39 s GLN 510 Cb 0.00 -4.21 0.00 0.00 1.00 0.00 0.00 33.01 29.80 2b39 s GLN 510 CO 0.00 -1.52 0.25 -0.25 -2.12 0.00 0.00 175.29 171.65 2b39 n ASP 511 N 6.60 0.00 -4.71 5.90 8.00 -1.26 -4.72 116.55 126.37 2b39 n ASP 511 Ca -0.07 0.26 -0.42 0.00 0.71 0.00 0.00 54.79 55.27 2b39 n ASP 511 Cb 0.44 -0.01 -0.03 0.00 -0.02 0.00 0.00 41.12 41.50 2b39 n ASP 511 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 2b39 s LEU 512 N -1.07 4.35 -0.42 0.64 2.96 -1.26 -2.91 118.68 120.96 2b39 s LEU 512 Ca 0.00 2.06 0.05 0.00 -0.22 0.00 0.00 54.13 56.02 2b39 s LEU 512 Cb 0.00 -3.57 0.18 0.00 0.50 0.00 0.00 46.19 43.30 2b39 s LEU 512 CO 0.00 -0.56 0.42 0.52 -1.32 0.00 0.00 176.35 175.41 2b39 n VAL 513 N 4.15 -1.00 -1.49 1.68 0.31 -1.03 -4.95 118.33 115.99 2b39 n VAL 513 Ca 0.10 -3.12 -0.41 0.00 -0.01 0.00 0.00 64.34 60.90 2b39 n VAL 513 Cb 0.45 -1.27 0.01 0.00 -0.91 0.00 0.00 33.84 32.12 2b39 n VAL 513 CO 0.00 0.00 0.00 0.52 -1.32 0.00 0.00 176.83 176.03 2b39 n VAL 514 N 2.70 2.00 -4.03 2.52 0.31 -1.26 -4.03 118.33 116.54 2b39 n VAL 514 Ca 0.27 -0.50 -0.31 0.00 -0.01 0.00 0.00 64.34 63.80 2b39 n VAL 514 Cb 0.50 -0.69 -0.16 0.00 -0.91 0.00 0.00 33.84 32.58 2b39 n VAL 514 CO 0.00 0.00 0.00 -0.22 -1.32 0.00 0.00 176.83 175.29 2b39 s LEU 515 N 1.11 1.90 -0.20 7.52 2.96 0.46 -4.92 118.68 127.51 2b39 s LEU 515 Ca 0.64 -0.61 -0.27 0.00 -0.22 0.00 0.00 54.13 53.66 2b39 s LEU 515 Cb -0.58 -1.23 -0.00 0.00 0.50 0.00 0.00 46.19 44.87 2b39 s LEU 515 CO 0.57 -0.07 0.95 -2.16 -1.32 0.00 0.00 176.35 174.32 2b39 s PRO 516 N 1.44 4.28 -0.15 0.98 0.04 -1.26 -0.66 135.00 139.66 2b39 s PRO 516 Ca 0.03 1.22 0.02 0.00 0.04 0.00 0.00 61.00 62.31 2b39 s PRO 516 Cb -0.14 -3.61 0.01 0.00 0.04 0.00 0.00 34.50 30.80 2b39 s PRO 516 CO -0.10 -0.50 -0.20 -1.17 0.04 0.00 0.00 177.00 175.06 2b39 s LEU 517 N 2.75 2.16 -0.19 -3.56 2.96 0.27 -4.95 118.68 118.12 2b39 s LEU 517 Ca 0.42 -0.60 -0.22 0.00 -0.22 0.00 0.00 54.13 53.50 2b39 s LEU 517 Cb -0.16 -1.47 -0.02 0.00 0.50 0.00 0.00 46.19 45.04 2b39 s LEU 517 CO 0.09 0.06 0.70 0.42 -1.32 0.00 0.00 176.35 176.30 2b39 s THR 518 N 0.96 4.97 -0.36 3.68 -4.23 -1.26 0.21 115.64 119.60 2b39 s THR 518 Ca -0.03 1.34 -0.25 0.00 -1.18 0.00 0.00 61.69 61.56 2b39 s THR 518 Cb -0.15 -4.01 0.01 0.00 1.34 0.00 0.00 72.50 69.69 2b39 s THR 518 CO -0.05 0.08 0.89 -0.63 -0.54 0.00 0.00 174.62 174.37 2b39 s ILE 519 N 2.02 4.63 0.00 2.99 1.01 -0.85 -4.95 121.20 126.06 2b39 s ILE 519 Ca 0.32 1.16 0.00 0.00 0.00 0.00 0.00 60.65 62.13 2b39 s ILE 519 Cb -0.16 -4.29 0.00 0.00 0.01 0.00 0.00 42.46 38.02 2b39 s ILE 519 CO 0.11 -0.48 0.00 0.41 0.00 0.00 0.00 174.94 174.98 2b39 n THR 520 N 5.88 0.00 0.76 2.92 -1.04 -1.26 -3.77 114.28 117.78 2b39 n THR 520 Ca 0.06 0.00 0.09 0.00 -2.04 0.00 0.00 64.05 62.17 2b39 n THR 520 Cb 0.48 0.00 -0.12 0.00 -1.82 0.00 0.00 70.33 68.87 2b39 n THR 520 CO 0.00 0.00 0.00 -1.54 -0.64 0.00 0.00 175.07 172.89 2b39 n SER 521 N 0.00 0.83 0.17 8.00 3.41 -1.26 -4.19 113.62 120.58 2b39 n SER 521 Ca 0.00 -0.80 0.12 0.00 -0.26 0.00 0.00 58.87 57.94 2b39 n SER 521 Cb 0.00 1.16 0.27 0.00 -0.26 0.00 0.00 64.21 65.38 2b39 n SER 521 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 2b39 h ASP 522 N 0.00 0.00 0.26 4.04 3.32 -1.95 -2.77 116.42 119.32 2b39 h ASP 522 Ca 0.00 -0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2b39 h ASP 522 Cb 0.54 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.09 2b39 h ASP 522 CO 0.00 0.00 -0.15 0.49 -1.72 0.00 0.00 179.24 177.86 2b39 n PHE 523 N -2.72 0.00 -0.32 4.55 3.01 -1.26 -4.54 117.46 116.18 2b39 n PHE 523 Ca 0.05 0.00 0.30 0.00 1.01 0.00 0.00 57.45 58.81 2b39 n PHE 523 Cb 0.49 -0.13 0.54 0.00 -0.01 0.00 0.00 39.48 40.36 2b39 n PHE 523 CO 0.00 0.00 0.00 1.51 1.01 0.00 0.00 176.76 179.28 2b39 n ILE 524 N -0.72 -0.33 -0.04 4.37 0.13 -1.05 -2.29 119.36 119.44 2b39 n ILE 524 Ca 0.14 1.73 -0.00 0.00 -1.10 0.00 0.00 62.75 63.52 2b39 n ILE 524 Cb 0.31 -2.82 -0.00 0.00 -0.84 0.00 0.00 39.64 36.29 2b39 n ILE 524 CO 0.00 0.00 0.00 1.55 2.80 0.00 0.00 176.55 180.90 2b39 h PRO 525 N 0.00 0.00 -2.34 9.51 0.13 -1.87 -3.41 132.00 134.03 2b39 h PRO 525 Ca 0.75 0.00 0.22 0.00 -0.87 0.00 0.00 66.00 66.10 2b39 h PRO 525 Cb 2.11 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 33.19 2b39 h PRO 525 CO -0.61 0.00 0.67 -1.12 -0.23 0.00 0.00 178.00 176.72 2b39 s SER 526 N -4.85 -0.01 0.03 1.44 0.01 -0.97 -3.31 113.70 106.04 2b39 s SER 526 Ca -0.00 -0.50 -0.28 0.00 1.31 0.00 0.00 55.95 56.48 2b39 s SER 526 Cb 0.00 0.39 0.09 0.00 0.21 0.00 0.00 66.02 66.71 2b39 s SER 526 CO 0.00 -0.77 0.86 0.72 0.41 0.00 0.00 173.24 174.47 2b39 s PHE 527 N -2.24 -0.34 -0.00 2.43 -0.12 0.18 -4.38 117.98 113.50 2b39 s PHE 527 Ca 0.22 0.18 0.05 0.00 -0.05 0.00 0.00 56.93 57.33 2b39 s PHE 527 Cb -0.01 0.55 -0.01 0.00 -0.63 0.00 0.00 43.02 42.91 2b39 s PHE 527 CO 0.03 -0.61 -0.16 0.50 -0.05 0.00 0.00 175.22 174.92 2b39 s ARG 528 N -3.21 1.29 -0.12 1.99 3.52 0.12 -0.24 118.95 122.30 2b39 s ARG 528 Ca 0.05 -0.63 0.02 0.00 -0.13 0.00 0.00 55.73 55.05 2b39 s ARG 528 Cb -0.01 -1.26 0.01 0.00 -1.56 0.00 0.00 34.95 32.13 2b39 s ARG 528 CO -0.08 0.34 -0.18 -1.17 -0.81 0.00 0.00 175.30 173.40 2b39 s LEU 529 N -0.51 1.86 0.05 -0.88 0.20 -0.54 0.83 118.68 119.68 2b39 s LEU 529 Ca 0.06 -0.48 0.08 0.00 0.69 0.00 0.00 54.13 54.47 2b39 s LEU 529 Cb -0.07 -1.21 -0.03 0.00 -0.43 0.00 0.00 46.19 44.46 2b39 s LEU 529 CO -0.00 0.05 -0.20 -0.69 -0.29 0.00 0.00 176.35 175.21 2b39 s VAL 530 N 0.87 2.63 -0.09 1.68 1.01 -0.32 -0.74 120.40 125.44 2b39 s VAL 530 Ca -0.08 -1.27 -0.16 0.00 0.00 0.00 0.00 61.98 60.47 2b39 s VAL 530 Cb -0.15 -2.10 0.04 0.00 0.00 0.00 0.00 36.38 34.16 2b39 s VAL 530 CO -0.01 0.32 0.39 0.00 0.00 0.00 0.00 175.10 175.81 2b39 s ALA 531 N -0.92 -0.99 0.21 5.51 0.00 -0.82 -1.23 121.76 123.53 2b39 s ALA 531 Ca 0.14 0.84 -0.09 0.00 0.00 0.00 0.00 51.96 52.84 2b39 s ALA 531 Cb -0.10 -0.31 -0.01 0.00 0.00 0.00 0.00 23.12 22.70 2b39 s ALA 531 CO 0.05 -0.24 0.35 1.52 0.00 0.00 0.00 175.76 177.44 2b39 s TYR 532 N -0.54 0.50 -0.05 0.00 -0.85 -0.71 -2.74 117.35 112.97 2b39 s TYR 532 Ca -0.07 -0.84 -0.03 0.00 -0.52 0.00 0.00 57.07 55.61 2b39 s TYR 532 Cb -0.04 -0.02 0.02 0.00 0.38 0.00 0.00 41.96 42.30 2b39 s TYR 532 CO 0.03 -0.83 0.11 1.52 -1.52 0.00 0.00 175.55 174.86 2b39 s TYR 533 N -4.02 -0.12 -0.89 -3.49 -0.85 -0.66 -0.90 117.35 106.42 2b39 s TYR 533 Ca 0.23 0.33 0.01 0.00 -0.52 0.00 0.00 57.07 57.11 2b39 s TYR 533 Cb 0.02 0.00 0.31 0.00 0.38 0.00 0.00 41.96 42.67 2b39 s TYR 533 CO 0.06 -0.08 1.33 2.41 -1.52 0.00 0.00 175.55 177.75 2b39 n THR 534 N 3.33 4.54 -2.12 -3.49 -1.04 -1.26 -2.11 114.28 112.14 2b39 n THR 534 Ca -0.16 -5.74 -0.42 0.00 -2.04 0.00 0.00 64.05 55.68 2b39 n THR 534 Cb 0.57 -1.82 -0.03 0.00 -1.82 0.00 0.00 70.33 67.24 2b39 n THR 534 CO 0.00 0.00 0.00 -1.48 -0.64 0.00 0.00 175.07 172.95 2b39 s LEU 535 N -3.28 4.32 -0.45 -4.42 0.05 -1.25 -4.84 118.68 108.81 2b39 s LEU 535 Ca 0.38 2.22 -0.28 0.00 0.05 0.00 0.00 54.13 56.50 2b39 s LEU 535 Cb 0.15 -3.56 -0.01 0.00 -2.05 0.00 0.00 46.19 40.73 2b39 s LEU 535 CO -0.02 -0.80 1.65 0.27 -0.55 0.00 0.00 176.35 176.90 2b39 s ILE 536 N 2.75 3.61 0.35 1.48 -4.36 -1.26 -3.80 121.20 119.96 2b39 s ILE 536 Ca 0.68 0.56 -0.04 0.00 -0.26 0.00 0.00 60.65 61.58 2b39 s ILE 536 Cb -0.34 -3.99 -0.03 0.00 1.25 0.00 0.00 42.46 39.36 2b39 s ILE 536 CO 0.28 -0.74 -0.21 -3.20 0.24 0.00 0.00 174.94 171.31 2b39 n ASN 537 N 10.37 -1.25 0.17 4.36 4.05 -0.55 -4.56 115.26 127.85 2b39 n ASN 537 Ca 0.19 0.00 0.13 0.00 0.45 0.00 0.00 54.58 55.34 2b39 n ASN 537 Cb 0.49 -0.28 0.29 0.00 1.23 0.00 0.00 39.78 41.51 2b39 n ASN 537 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 2b39 h ALA 538 N -0.98 1.00 -0.60 5.20 0.00 -1.91 -2.40 119.26 119.57 2b39 h ALA 538 Ca -0.05 0.00 -0.37 0.00 0.00 0.00 0.00 54.91 54.49 2b39 h ALA 538 Cb 0.19 0.00 -0.22 0.00 0.00 0.00 0.00 17.79 17.75 2b39 h ALA 538 CO 0.03 0.00 -0.02 1.63 0.00 0.00 0.00 179.25 180.89 2b39 n LYS 539 N -2.72 2.38 -2.05 0.00 5.02 -1.26 -4.96 118.16 114.57 2b39 n LYS 539 Ca 0.05 -3.41 0.00 0.00 -2.02 0.00 0.00 58.31 52.93 2b39 n LYS 539 Cb 0.47 -2.03 0.00 0.00 -0.02 0.00 0.00 35.03 33.46 2b39 n LYS 539 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2b39 n GLY 540 N -1.01 -0.38 3.66 0.72 0.00 -0.90 -4.90 105.19 102.37 2b39 n GLY 540 Ca 0.43 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 46.10 2b39 n GLY 540 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2b39 s GLN 541 N -3.99 3.11 -1.16 1.61 -2.07 -1.26 -4.65 119.66 111.24 2b39 s GLN 541 Ca 0.00 -0.42 -0.21 0.00 -1.82 0.00 0.00 55.36 52.91 2b39 s GLN 541 Cb 0.00 -2.82 -0.06 0.00 -1.09 0.00 0.00 33.01 29.03 2b39 s GLN 541 CO 0.00 0.63 1.90 0.54 -1.32 0.00 0.00 175.29 177.04 2b39 n ARG 542 N 2.37 1.94 -2.50 9.60 1.74 -1.26 -1.48 116.66 127.07 2b39 n ARG 542 Ca -0.18 -2.54 -0.38 0.00 -0.77 0.00 0.00 57.85 53.97 2b39 n ARG 542 Cb 0.53 -3.55 -0.04 0.00 -1.02 0.00 0.00 32.46 28.38 2b39 n ARG 542 CO 0.00 0.00 0.00 -2.00 -1.52 0.00 0.00 177.63 174.11 2b39 s GLU 543 N 5.70 4.34 -0.11 5.56 2.12 -1.25 -4.91 118.70 130.15 2b39 s GLU 543 Ca 0.63 1.65 0.03 0.00 0.36 0.00 0.00 54.97 57.63 2b39 s GLU 543 Cb 0.03 -2.81 0.01 0.00 0.26 0.00 0.00 34.13 31.62 2b39 s GLU 543 CO 0.12 -0.01 -0.19 0.08 -0.54 0.00 0.00 175.26 174.71 2b39 s VAL 544 N -1.44 1.76 -0.14 3.70 1.01 -1.26 -3.77 120.40 120.26 2b39 s VAL 544 Ca 0.52 -0.82 -0.02 0.00 0.00 0.00 0.00 61.98 61.66 2b39 s VAL 544 Cb -0.26 -1.57 -0.03 0.00 0.00 0.00 0.00 36.38 34.52 2b39 s VAL 544 CO 0.34 0.49 -0.06 -0.69 0.00 0.00 0.00 175.10 175.18 2b39 s VAL 545 N 0.74 3.72 0.30 2.92 1.01 -0.89 -4.60 120.40 123.59 2b39 s VAL 545 Ca -0.11 -0.43 0.03 0.00 0.00 0.00 0.00 61.98 61.48 2b39 s VAL 545 Cb -0.16 -2.60 -0.03 0.00 0.00 0.00 0.00 36.38 33.59 2b39 s VAL 545 CO 0.01 0.52 0.27 0.00 0.00 0.00 0.00 175.10 175.90 2b39 s ALA 546 N 0.17 1.47 0.01 5.51 0.00 -1.26 -1.65 121.76 126.01 2b39 s ALA 546 Ca -0.03 -1.87 -0.28 0.00 0.00 0.00 0.00 51.96 49.78 2b39 s ALA 546 Cb -0.14 1.40 0.10 0.00 0.00 0.00 0.00 23.12 24.48 2b39 s ALA 546 CO 0.03 -0.67 1.26 0.34 0.00 0.00 0.00 175.76 176.72 2b39 s ASP 547 N -3.29 -0.02 -0.16 0.00 -1.08 -1.11 -4.56 116.67 106.46 2b39 s ASP 547 Ca 0.38 -0.23 -0.31 0.00 -0.52 0.00 0.00 52.55 51.88 2b39 s ASP 547 Cb 0.03 0.19 0.14 0.00 -1.46 0.00 0.00 42.92 41.82 2b39 s ASP 547 CO 0.22 -0.37 1.10 -0.94 0.52 0.00 0.00 175.17 175.70 2b39 s SER 548 N -3.45 -0.25 0.10 -0.34 1.04 -1.26 -1.94 113.70 107.60 2b39 s SER 548 Ca 0.23 0.16 0.04 0.00 0.48 0.00 0.00 55.95 56.86 2b39 s SER 548 Cb 0.01 0.23 -0.04 0.00 0.10 0.00 0.00 66.02 66.32 2b39 s SER 548 CO -0.01 -0.31 -0.10 -0.69 0.98 0.00 0.00 173.24 173.11 2b39 s VAL 549 N -1.79 0.95 -0.28 5.02 1.01 0.08 -4.48 120.40 120.91 2b39 s VAL 549 Ca 0.04 -1.69 -0.10 0.00 0.00 0.00 0.00 61.98 60.23 2b39 s VAL 549 Cb -0.01 -1.42 -0.04 0.00 0.00 0.00 0.00 36.38 34.91 2b39 s VAL 549 CO -0.04 -0.59 0.17 0.86 0.00 0.00 0.00 175.10 175.51 2b39 s TRP 550 N -2.56 3.19 -0.05 5.22 -0.00 -1.26 -1.47 118.94 122.01 2b39 s TRP 550 Ca 0.07 -0.04 0.03 0.00 -0.00 0.00 0.00 56.10 56.15 2b39 s TRP 550 Cb -0.02 -2.36 0.01 0.00 -0.00 0.00 0.00 33.47 31.09 2b39 s TRP 550 CO -0.00 -0.23 -0.11 0.08 -0.00 0.00 0.00 176.95 176.68 2b39 s VAL 551 N 1.72 1.03 0.11 5.86 1.01 0.67 -5.01 120.40 125.78 2b39 s VAL 551 Ca 0.07 -0.46 0.07 0.00 0.00 0.00 0.00 61.98 61.66 2b39 s VAL 551 Cb -0.16 -0.93 -0.04 0.00 0.00 0.00 0.00 36.38 35.25 2b39 s VAL 551 CO 0.09 0.32 -0.11 1.51 0.00 0.00 0.00 175.10 176.92 2b39 s ASP 552 N 0.43 4.35 0.51 3.32 -4.77 -1.26 0.48 116.67 119.72 2b39 s ASP 552 Ca -0.09 -0.41 0.06 0.00 -3.30 0.00 0.00 52.55 48.82 2b39 s ASP 552 Cb -0.13 -0.81 0.02 0.00 -1.09 0.00 0.00 42.92 40.92 2b39 s ASP 552 CO 0.02 0.18 0.40 0.68 0.70 0.00 0.00 175.17 177.14 2b39 s VAL 553 N -1.22 1.90 -0.39 2.11 -7.23 -1.21 -4.73 120.40 109.63 2b39 s VAL 553 Ca 0.21 -1.46 -0.43 0.00 -1.81 0.00 0.00 61.98 58.48 2b39 s VAL 553 Cb -0.11 -2.36 -0.18 0.00 0.56 0.00 0.00 36.38 34.29 2b39 s VAL 553 CO 0.13 0.00 1.73 1.17 -0.31 0.00 0.00 175.10 177.82 2b39 n LYS 554 N -1.70 0.58 -1.97 4.82 3.00 -1.26 -4.71 118.16 116.92 2b39 n LYS 554 Ca -0.00 0.21 -0.30 0.00 -0.00 0.00 0.00 58.31 58.21 2b39 n LYS 554 Cb 0.64 -1.82 -0.06 0.00 0.00 0.00 0.00 35.03 33.79 2b39 n LYS 554 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.40 173.93 2b39 n ASP 555 N 5.09 3.07 0.00 3.14 2.03 -1.26 -4.79 116.55 123.83 2b39 n ASP 555 Ca 0.31 -2.70 0.00 0.00 0.52 0.00 0.00 54.79 52.91 2b39 n ASP 555 Cb 0.04 -1.67 0.00 0.00 -0.72 0.00 0.00 41.12 38.77 2b39 n ASP 555 CO 0.00 0.00 0.00 -1.54 -1.92 0.00 0.00 177.20 173.74 2b39 n SER 556 N 13.39 0.86 -4.44 1.67 3.41 -1.26 -4.76 113.62 122.49 2b39 n SER 556 Ca 0.46 0.00 -0.26 0.00 -0.26 0.00 0.00 58.87 58.81 2b39 n SER 556 Cb 0.46 0.00 -0.11 0.00 -0.26 0.00 0.00 64.21 64.30 2b39 n SER 556 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2b39 h MET 558 N 2.78 0.00 -3.72 0.00 -0.00 -1.90 -3.44 114.93 108.65 2b39 h MET 558 Ca -0.43 0.00 -0.58 0.00 -0.00 0.00 0.00 59.70 58.69 2b39 h MET 558 Cb 1.23 0.00 -0.40 0.00 -0.00 0.00 0.00 31.60 32.43 2b39 h MET 558 CO 0.53 0.00 -0.76 0.20 -0.00 0.00 0.00 176.91 176.88 2b39 s GLY 559 N -3.83 1.07 0.03 -3.00 0.00 -1.26 -5.07 107.32 95.26 2b39 s GLY 559 Ca 0.08 -1.47 -0.36 0.00 0.00 0.00 0.00 44.72 42.97 2b39 s GLY 559 CO 0.66 1.44 0.93 -1.30 0.00 0.00 0.00 173.10 174.83 2b39 n THR 560 N 4.83 0.30 -3.64 0.90 -2.24 -1.26 -4.75 114.28 108.42 2b39 n THR 560 Ca -0.05 -0.08 -0.22 0.00 -2.27 0.00 0.00 64.05 61.44 2b39 n THR 560 Cb 0.43 0.00 -0.17 0.00 -2.10 0.00 0.00 70.33 68.49 2b39 n THR 560 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 2b39 s LEU 561 N 0.45 0.20 0.04 3.22 1.43 -1.25 -3.95 118.68 118.82 2b39 s LEU 561 Ca 0.82 -0.20 -0.01 0.00 -1.03 0.00 0.00 54.13 53.71 2b39 s LEU 561 Cb -1.15 -0.13 -0.03 0.00 0.03 0.00 0.00 46.19 44.91 2b39 s LEU 561 CO 0.54 -0.29 -0.01 -0.69 0.23 0.00 0.00 176.35 176.12 2b39 s VAL 562 N 2.17 0.18 -0.11 -1.59 1.01 -0.32 -4.60 120.40 117.15 2b39 s VAL 562 Ca 0.04 -1.52 0.02 0.00 0.00 0.00 0.00 61.98 60.52 2b39 s VAL 562 Cb -0.14 -1.16 0.01 0.00 0.00 0.00 0.00 36.38 35.10 2b39 s VAL 562 CO -0.06 -0.84 -0.16 -0.69 0.00 0.00 0.00 175.10 173.35 2b39 s VAL 563 N -3.22 1.58 0.08 2.92 1.01 -1.26 0.23 120.40 121.75 2b39 s VAL 563 Ca 0.00 -0.70 -0.01 0.00 0.00 0.00 0.00 61.98 61.28 2b39 s VAL 563 Cb 0.03 -1.43 -0.04 0.00 0.00 0.00 0.00 36.38 34.94 2b39 s VAL 563 CO -0.07 0.46 0.00 -0.75 0.00 0.00 0.00 175.10 174.74 2b39 s LYS 564 N 0.91 0.74 1.04 2.72 2.20 0.57 -4.87 119.74 123.05 2b39 s LYS 564 Ca -0.08 -1.31 -0.15 0.00 -0.36 0.00 0.00 55.97 54.07 2b39 s LYS 564 Cb -0.15 0.22 0.21 0.00 -1.51 0.00 0.00 37.83 36.59 2b39 s LYS 564 CO -0.01 -0.17 1.14 1.21 -0.36 0.00 0.00 175.35 177.17 2b39 s ASN 565 N -2.97 2.35 -0.03 1.43 3.84 -1.26 0.44 114.94 118.73 2b39 s ASN 565 Ca 0.14 0.80 -0.04 0.00 0.21 0.00 0.00 52.86 53.97 2b39 s ASN 565 Cb 0.08 -1.21 -0.03 0.00 -0.55 0.00 0.00 41.25 39.54 2b39 s ASN 565 CO -0.05 -3.26 -0.10 0.61 -2.79 0.00 0.00 177.10 171.52 2b39 n GLY 566 N -1.74 -0.14 3.15 1.21 0.00 -0.93 -3.97 105.19 102.77 2b39 n GLY 566 Ca 0.10 -0.06 -0.39 0.00 0.00 0.00 0.00 46.02 45.67 2b39 n GLY 566 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2b39 s GLY 567 N -4.76 2.45 0.40 -0.02 0.00 -1.26 -5.04 107.32 99.09 2b39 s GLY 567 Ca -0.09 -3.14 -0.23 0.00 0.00 0.00 0.00 44.72 41.26 2b39 s GLY 567 CO 0.12 1.13 0.65 1.17 0.00 0.00 0.00 173.10 176.17 2b39 n LYS 568 N 3.81 0.72 -3.74 2.90 3.00 -1.26 -4.88 118.16 118.71 2b39 n LYS 568 Ca 0.06 0.26 -0.13 0.00 -0.00 0.00 0.00 58.31 58.50 2b39 n LYS 568 Cb 0.40 -1.60 -0.10 0.00 0.00 0.00 0.00 35.03 33.73 2b39 n LYS 568 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.40 175.40 2b39 s GLU 569 N -1.64 0.45 0.97 1.64 2.56 -1.26 -5.18 118.70 116.24 2b39 s GLU 569 Ca 0.63 0.50 -0.16 0.00 0.00 0.00 0.00 54.97 55.94 2b39 s GLU 569 Cb -0.61 0.22 0.25 0.00 2.00 0.00 0.00 34.13 35.98 2b39 s GLU 569 CO 0.58 -0.06 0.64 -1.91 -0.56 0.00 0.00 175.26 173.95 2b39 n GLU 570 N 2.82 -3.62 0.00 4.30 2.13 -1.26 -4.76 120.64 120.25 2b39 n GLU 570 Ca -0.13 -1.05 0.00 0.00 0.66 0.00 0.00 57.16 56.63 2b39 n GLU 570 Cb 0.57 -1.26 0.00 0.00 0.27 0.00 0.00 31.44 31.03 2b39 n GLU 570 CO 0.00 0.00 0.00 1.17 -0.41 0.00 0.00 177.13 177.89 2b39 n LYS 571 N -4.42 0.32 -3.51 5.31 4.81 -1.26 -4.20 118.16 115.20 2b39 n LYS 571 Ca 0.10 0.00 -0.22 0.00 -0.87 0.00 0.00 58.31 57.32 2b39 n LYS 571 Cb 0.41 -1.33 -0.14 0.00 0.02 0.00 0.00 35.03 33.99 2b39 n LYS 571 CO 0.00 0.00 0.00 -1.01 1.17 0.00 0.00 177.40 177.56 2b39 s HIS 572 N 0.57 -0.09 0.09 5.64 3.76 -1.26 -4.82 115.29 119.17 2b39 s HIS 572 Ca 0.00 -0.18 0.07 0.00 -0.15 0.00 0.00 55.06 54.80 2b39 s HIS 572 Cb 0.00 -0.56 -0.04 0.00 1.11 0.00 0.00 32.58 33.09 2b39 s HIS 572 CO 0.00 -0.68 -0.11 -1.01 -0.85 0.00 0.00 174.74 172.09 2b39 s HIS 573 N 2.25 2.73 -0.12 1.40 3.76 -1.19 -4.90 115.29 119.22 2b39 s HIS 573 Ca 0.07 -0.16 -0.15 0.00 -0.15 0.00 0.00 55.06 54.67 2b39 s HIS 573 Cb -0.16 -1.45 -0.05 0.00 1.11 0.00 0.00 32.58 32.04 2b39 s HIS 573 CO -0.20 0.41 0.38 0.50 -0.85 0.00 0.00 174.74 174.98 2b39 s ARG 574 N -2.07 4.21 0.50 1.40 3.52 -1.26 -1.30 118.95 123.94 2b39 s ARG 574 Ca 0.20 0.28 -0.21 0.00 -0.13 0.00 0.00 55.73 55.87 2b39 s ARG 574 Cb -0.11 -3.39 -0.10 0.00 -1.56 0.00 0.00 34.95 29.80 2b39 s ARG 574 CO 0.12 0.30 0.70 -0.35 -0.81 0.00 0.00 175.30 175.27 2b39 n PRO 575 N 3.26 0.78 0.00 5.12 -0.04 -1.26 -0.69 135.00 142.17 2b39 n PRO 575 Ca -0.11 0.29 0.00 0.00 -0.04 0.00 0.00 63.50 63.64 2b39 n PRO 575 Cb 0.52 -1.79 0.00 0.00 -0.04 0.00 0.00 33.50 32.19 2b39 n PRO 575 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2b39 n GLY 576 N 1.57 0.86 2.76 0.55 0.00 -1.01 -4.81 105.19 105.12 2b39 n GLY 576 Ca 0.11 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.77 2b39 n GLY 576 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 2b39 n GLN 577 N 0.00 0.00 -3.03 1.61 7.27 0.14 -3.45 117.38 119.91 2b39 n GLN 577 Ca 0.00 0.00 -0.30 0.00 0.07 0.00 0.00 57.00 56.77 2b39 n GLN 577 Cb 0.00 -0.83 -0.03 0.00 2.41 0.00 0.00 30.24 31.79 2b39 n GLN 577 CO 0.00 0.00 0.00 -1.14 0.07 0.00 0.00 177.06 175.99 2b39 s GLN 578 N -0.83 3.72 -0.14 3.69 0.74 -1.26 -0.82 119.66 124.75 2b39 s GLN 578 Ca 0.50 0.29 -0.14 0.00 0.05 0.00 0.00 55.36 56.06 2b39 s GLN 578 Cb -0.58 -2.49 0.04 0.00 1.10 0.00 0.00 33.01 31.08 2b39 s GLN 578 CO 0.51 0.05 0.39 0.42 -0.55 0.00 0.00 175.29 176.11 2b39 s ILE 579 N -2.27 0.00 0.12 -2.34 1.01 0.28 -4.89 121.20 113.10 2b39 s ILE 579 Ca 0.48 -0.01 0.03 0.00 0.00 0.00 0.00 60.65 61.15 2b39 s ILE 579 Cb -0.10 -0.55 -0.04 0.00 0.01 0.00 0.00 42.46 41.78 2b39 s ILE 579 CO 0.31 -0.01 0.16 0.28 0.00 0.00 0.00 174.94 175.69 2b39 s THR 580 N 0.16 4.85 -0.00 2.92 -1.32 -1.25 0.17 115.64 121.16 2b39 s THR 580 Ca -0.00 -0.77 0.06 0.00 -1.21 0.00 0.00 61.69 59.76 2b39 s THR 580 Cb -0.03 -3.42 -0.02 0.00 -1.51 0.00 0.00 72.50 67.53 2b39 s THR 580 CO 0.01 0.01 -0.18 -0.76 -2.21 0.00 0.00 174.62 171.49 2b39 s LEU 581 N -2.80 2.07 -0.35 9.08 1.43 1.04 -2.20 118.68 126.95 2b39 s LEU 581 Ca 0.32 -0.37 -0.13 0.00 -1.03 0.00 0.00 54.13 52.92 2b39 s LEU 581 Cb -0.11 -0.91 -0.01 0.00 0.03 0.00 0.00 46.19 45.18 2b39 s LEU 581 CO 0.25 0.20 0.26 -0.75 0.23 0.00 0.00 176.35 176.53 2b39 s LYS 582 N -0.60 3.46 -0.38 1.70 2.20 1.50 -0.36 119.74 127.26 2b39 s LYS 582 Ca 0.07 -0.66 -0.07 0.00 -0.36 0.00 0.00 55.97 54.95 2b39 s LYS 582 Cb -0.07 -3.82 0.07 0.00 -1.51 0.00 0.00 37.83 32.49 2b39 s LYS 582 CO -0.00 -0.48 0.18 0.42 -0.36 0.00 0.00 175.35 175.12 2b39 s ILE 583 N 1.75 3.89 -0.32 5.43 1.01 0.12 -0.31 121.20 132.76 2b39 s ILE 583 Ca 0.06 -1.39 -0.14 0.00 0.00 0.00 0.00 60.65 59.18 2b39 s ILE 583 Cb -0.17 -3.34 -0.02 0.00 0.01 0.00 0.00 42.46 38.93 2b39 s ILE 583 CO 0.11 -0.39 0.34 -1.61 0.00 0.00 0.00 174.94 173.38 2b39 s GLU 584 N 1.37 3.73 0.19 2.79 2.02 0.14 -1.39 118.70 127.54 2b39 s GLU 584 Ca 0.02 -0.30 -0.01 0.00 0.02 0.00 0.00 54.97 54.70 2b39 s GLU 584 Cb -0.22 -3.75 -0.04 0.00 0.10 0.00 0.00 34.13 30.23 2b39 s GLU 584 CO 0.01 -0.41 0.11 0.00 0.02 0.00 0.00 175.26 174.99 2b39 s ALA 585 N 1.98 1.16 0.93 5.21 0.00 -1.26 -1.18 121.76 128.61 2b39 s ALA 585 Ca 0.12 -1.67 -0.12 0.00 0.00 0.00 0.00 51.96 50.29 2b39 s ALA 585 Cb -0.16 1.24 0.15 0.00 0.00 0.00 0.00 23.12 24.35 2b39 s ALA 585 CO 0.11 -0.55 1.12 -0.51 0.00 0.00 0.00 175.76 175.93 2b39 s ASP 586 N -3.15 3.29 0.66 0.00 1.11 -1.25 -2.13 116.67 115.18 2b39 s ASP 586 Ca 0.36 1.06 -0.17 0.00 0.18 0.00 0.00 52.55 53.98 2b39 s ASP 586 Cb 0.07 -1.67 -0.00 0.00 1.07 0.00 0.00 42.92 42.39 2b39 s ASP 586 CO 0.10 -2.70 1.20 -1.58 1.18 0.00 0.00 175.17 173.37 2b39 s GLN 587 N -5.17 2.62 -0.84 8.23 0.74 -1.26 -3.45 119.66 120.54 2b39 s GLN 587 Ca 0.64 1.74 0.00 0.00 0.05 0.00 0.00 55.36 57.79 2b39 s GLN 587 Cb -0.16 -1.89 0.00 0.00 1.10 0.00 0.00 33.01 32.06 2b39 s GLN 587 CO 0.55 -1.46 0.00 0.41 -0.55 0.00 0.00 175.29 174.24 2b39 n GLY 588 N 0.32 0.75 3.83 2.59 0.00 -1.23 -4.42 105.19 107.04 2b39 n GLY 588 Ca 0.13 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.83 2b39 n GLY 588 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2b39 s ALA 589 N -1.58 3.02 -0.13 4.61 0.00 -1.22 -4.39 121.76 122.07 2b39 s ALA 589 Ca 0.00 0.24 0.02 0.00 0.00 0.00 0.00 51.96 52.23 2b39 s ALA 589 Cb 0.00 -3.14 0.00 0.00 0.00 0.00 0.00 23.12 19.98 2b39 s ALA 589 CO 0.00 -0.27 -0.20 1.03 0.00 0.00 0.00 175.76 176.31 2b39 s ARG 590 N -3.96 3.12 0.08 0.00 1.81 -0.78 -4.61 118.95 114.62 2b39 s ARG 590 Ca 0.60 -0.82 0.04 0.00 -1.72 0.00 0.00 55.73 53.83 2b39 s ARG 590 Cb -0.11 -2.45 -0.04 0.00 -0.45 0.00 0.00 34.95 31.90 2b39 s ARG 590 CO 0.30 0.10 0.03 0.08 -0.68 0.00 0.00 175.30 175.12 2b39 s VAL 591 N 0.57 4.22 -0.21 3.52 1.01 -1.13 -1.31 120.40 127.08 2b39 s VAL 591 Ca -0.12 -0.89 -0.04 0.00 0.00 0.00 0.00 61.98 60.93 2b39 s VAL 591 Cb -0.16 -3.02 -0.01 0.00 0.00 0.00 0.00 36.38 33.18 2b39 s VAL 591 CO 0.04 0.13 -0.03 -0.83 0.00 0.00 0.00 175.10 174.40 2b39 s GLY 592 N -2.32 1.64 -0.05 4.51 0.00 0.14 -2.03 107.32 109.21 2b39 s GLY 592 Ca 0.27 -1.09 0.03 0.00 0.00 0.00 0.00 44.72 43.94 2b39 s GLY 592 CO 0.20 0.32 -0.13 1.08 0.00 0.00 0.00 173.10 174.56 2b39 s LEU 593 N 1.24 2.82 -0.22 0.66 1.43 -0.71 -0.65 118.68 123.24 2b39 s LEU 593 Ca 0.03 -0.17 -0.08 0.00 -1.03 0.00 0.00 54.13 52.87 2b39 s LEU 593 Cb -0.14 -1.59 0.09 0.00 0.03 0.00 0.00 46.19 44.58 2b39 s LEU 593 CO -0.01 0.34 0.48 -0.69 0.23 0.00 0.00 176.35 176.71 2b39 s VAL 594 N -0.77 -0.62 0.07 -1.59 1.01 -0.85 -3.08 120.40 114.58 2b39 s VAL 594 Ca 0.12 0.12 -0.10 0.00 0.00 0.00 0.00 61.98 62.12 2b39 s VAL 594 Cb -0.11 -0.75 -0.06 0.00 0.00 0.00 0.00 36.38 35.47 2b39 s VAL 594 CO 0.01 0.05 0.40 0.00 0.00 0.00 0.00 175.10 175.55 2b39 s ALA 595 N 2.48 3.73 0.10 5.51 0.00 0.11 -1.24 121.76 132.45 2b39 s ALA 595 Ca -0.04 -0.38 -0.06 0.00 0.00 0.00 0.00 51.96 51.47 2b39 s ALA 595 Cb -0.11 -2.27 -0.01 0.00 0.00 0.00 0.00 23.12 20.73 2b39 s ALA 595 CO -0.14 0.57 0.16 0.08 0.00 0.00 0.00 175.76 176.42 2b39 s VAL 596 N -1.39 0.13 0.39 0.00 1.01 -0.95 -2.68 120.40 116.92 2b39 s VAL 596 Ca 0.33 -1.43 -0.23 0.00 0.00 0.00 0.00 61.98 60.65 2b39 s VAL 596 Cb -0.14 -1.57 -0.10 0.00 0.00 0.00 0.00 36.38 34.57 2b39 s VAL 596 CO 0.18 -0.61 0.96 -0.62 0.00 0.00 0.00 175.10 175.01 2b39 s ASP 597 N -2.92 7.04 0.13 3.32 2.15 -1.26 -0.84 116.67 124.29 2b39 s ASP 597 Ca 0.10 1.80 -0.08 0.00 0.43 0.00 0.00 52.55 54.80 2b39 s ASP 597 Cb 0.05 -2.56 -0.07 0.00 -0.30 0.00 0.00 42.92 40.04 2b39 s ASP 597 CO -0.07 -0.29 1.35 0.50 -0.17 0.00 0.00 175.17 176.49 2b39 h LYS 598 N 2.42 0.61 0.00 4.34 3.64 -1.17 -3.17 116.57 123.24 2b39 h LYS 598 Ca -0.48 -0.52 0.00 0.00 -1.27 0.00 0.00 60.65 58.38 2b39 h LYS 598 Cb 1.19 0.12 0.00 0.00 -0.41 0.00 0.00 32.23 33.13 2b39 h LYS 598 CO 0.62 1.14 0.50 0.78 -2.27 0.00 0.00 179.45 180.22 2b39 h GLY 599 N 0.88 0.00 0.00 5.01 0.00 -1.93 0.10 103.07 107.13 2b39 h GLY 599 Ca -0.05 0.00 -0.32 0.00 0.00 0.00 0.00 47.33 46.96 2b39 h GLY 599 CO 0.15 0.00 -2.21 -0.62 0.00 0.00 0.00 176.54 173.86 2b39 n VAL 600 N -2.23 1.22 0.20 4.60 0.31 -1.20 -4.13 118.33 117.09 2b39 n VAL 600 Ca -0.01 -0.46 0.18 0.00 -0.01 0.00 0.00 64.34 64.05 2b39 n VAL 600 Cb 0.52 -1.27 0.82 0.00 -0.91 0.00 0.00 33.84 32.99 2b39 n VAL 600 CO 0.00 0.00 0.00 0.15 -1.32 0.00 0.00 176.83 175.66 2b39 h PHE 601 N -0.03 0.00 0.00 3.52 3.57 -0.78 -1.85 116.94 121.36 2b39 h PHE 601 Ca -0.48 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.02 2b39 h PHE 601 Cb 1.72 0.00 0.00 0.00 2.79 0.00 0.00 35.95 40.46 2b39 h PHE 601 CO 0.02 0.00 -1.92 0.28 -2.23 0.00 0.00 178.31 174.46 2b39 n VAL 602 N -3.56 0.00 0.00 1.41 0.31 -1.08 -4.79 118.33 110.62 2b39 n VAL 602 Ca 0.03 -0.46 0.00 0.00 -0.01 0.00 0.00 64.34 63.89 2b39 n VAL 602 Cb 0.43 0.04 0.00 0.00 -0.91 0.00 0.00 33.84 33.40 2b39 n VAL 602 CO 0.00 0.00 0.00 -0.11 -1.32 0.00 0.00 176.83 175.40 2b39 n LEU 603 N -2.20 0.00 -4.12 7.52 7.94 -0.70 -4.42 117.00 121.02 2b39 n LEU 603 Ca -0.04 0.37 -0.38 0.00 -1.11 0.00 0.00 56.01 54.86 2b39 n LEU 603 Cb 0.53 0.00 -0.08 0.00 0.53 0.00 0.00 43.42 44.40 2b39 n LEU 603 CO 0.43 0.00 0.12 0.21 -1.11 0.00 0.00 177.39 177.04 2b39 s ASN 604 N -2.36 5.47 0.22 1.96 3.84 -1.25 -4.97 114.94 117.84 2b39 s ASN 604 Ca 0.00 -2.93 -0.04 0.00 0.21 0.00 0.00 52.86 50.10 2b39 s ASN 604 Cb 0.00 -1.90 0.20 0.00 -0.55 0.00 0.00 41.25 39.00 2b39 s ASN 604 CO 0.00 -0.37 1.64 0.11 -2.79 0.00 0.00 177.10 175.69 2b39 h LYS 605 N 7.01 0.77 -0.69 0.43 1.57 -1.87 -3.31 116.57 120.47 2b39 h LYS 605 Ca 0.02 -0.30 0.20 0.00 -1.87 0.00 0.00 60.65 58.70 2b39 h LYS 605 Cb 0.95 -0.04 -0.03 0.00 0.08 0.00 0.00 32.23 33.19 2b39 h LYS 605 CO 0.73 0.91 0.65 1.57 -0.57 0.00 0.00 179.45 182.74 2b39 h LYS 606 N 0.68 0.00 -0.01 3.15 2.10 -1.98 0.39 116.57 120.90 2b39 h LYS 606 Ca 0.10 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.75 2b39 h LYS 606 Cb 0.71 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.04 2b39 h LYS 606 CO 0.05 0.00 -0.23 0.09 -2.00 0.00 0.00 179.45 177.37 2b39 n ASN 607 N -3.80 1.04 -4.84 7.07 3.02 -1.24 -4.90 115.26 111.60 2b39 n ASN 607 Ca 0.14 -0.93 -0.35 0.00 -0.03 0.00 0.00 54.58 53.41 2b39 n ASN 607 Cb 0.90 0.11 -0.06 0.00 -0.61 0.00 0.00 39.78 40.12 2b39 n ASN 607 CO 0.00 0.00 0.00 -1.59 -2.62 0.00 0.00 177.26 173.05 2b39 s LYS 608 N -2.46 4.00 0.10 3.52 -2.85 0.13 -4.81 119.74 117.36 2b39 s LYS 608 Ca 0.26 0.52 -0.28 0.00 -1.00 0.00 0.00 55.97 55.47 2b39 s LYS 608 Cb 0.19 -2.94 -0.06 0.00 -2.06 0.00 0.00 37.83 32.96 2b39 s LYS 608 CO 0.50 0.48 0.87 -0.51 0.10 0.00 0.00 175.35 176.79 2b39 s LEU 609 N -1.93 4.50 0.01 2.77 1.43 -1.26 -5.04 118.68 119.17 2b39 s LEU 609 Ca 0.38 1.67 -0.01 0.00 -1.03 0.00 0.00 54.13 55.13 2b39 s LEU 609 Cb -0.15 -3.43 -0.01 0.00 0.03 0.00 0.00 46.19 42.62 2b39 s LEU 609 CO 0.19 0.01 0.00 0.28 0.23 0.00 0.00 176.35 177.06 2b39 s THR 610 N -0.21 0.10 0.28 5.49 -1.32 -1.26 -5.04 115.64 113.67 2b39 s THR 610 Ca 0.42 -0.79 -0.04 0.00 -1.21 0.00 0.00 61.69 60.08 2b39 s THR 610 Cb -0.22 -0.27 0.26 0.00 -1.51 0.00 0.00 72.50 70.76 2b39 s THR 610 CO 0.27 -0.44 1.94 1.56 -2.21 0.00 0.00 174.62 175.75 2b39 h GLN 611 N 4.71 1.19 -0.68 7.08 1.08 -1.92 -2.13 115.11 124.45 2b39 h GLN 611 Ca -0.31 -0.07 0.13 0.00 -1.45 0.00 0.00 58.65 56.95 2b39 h GLN 611 Cb 1.21 -0.27 -0.09 0.00 -0.05 0.00 0.00 27.48 28.27 2b39 h GLN 611 CO 0.42 0.79 0.19 -0.09 -0.95 0.00 0.00 178.83 179.18 2b39 h ARG 612 N 1.23 0.30 -0.71 1.46 2.43 -1.92 -0.73 114.38 116.44 2b39 h ARG 612 Ca 0.35 -0.02 -0.05 0.00 -0.81 0.00 0.00 59.98 59.45 2b39 h ARG 612 Cb -0.10 -0.07 -0.03 0.00 -0.42 0.00 0.00 29.97 29.35 2b39 h ARG 612 CO -0.08 0.20 0.24 0.87 -1.51 0.00 0.00 179.97 179.69 2b39 h LYS 613 N 0.31 1.09 0.00 0.20 1.57 -1.80 -2.45 116.57 115.50 2b39 h LYS 613 Ca 0.37 -0.23 -0.03 0.00 -1.87 0.00 0.00 60.65 58.89 2b39 h LYS 613 Cb 0.57 -0.16 -0.00 0.00 0.08 0.00 0.00 32.23 32.71 2b39 h LYS 613 CO -0.43 0.93 -0.13 -0.84 -0.57 0.00 0.00 179.45 178.41 2b39 h ILE 614 N 1.04 0.52 -0.05 1.86 3.07 -0.89 -2.24 117.51 120.82 2b39 h ILE 614 Ca 0.23 -0.62 -0.03 0.00 1.55 0.00 0.00 64.86 65.99 2b39 h ILE 614 Cb 0.28 1.42 0.00 0.00 -0.27 0.00 0.00 36.82 38.25 2b39 h ILE 614 CO -0.01 0.13 -0.09 -0.50 -1.05 0.00 0.00 178.15 176.62 2b39 h TRP 615 N 0.00 0.19 -0.77 0.16 -0.00 -0.87 -2.62 115.95 112.05 2b39 h TRP 615 Ca -0.00 -0.07 0.22 0.00 -0.00 0.00 0.00 58.89 59.04 2b39 h TRP 615 Cb 0.41 -0.04 -0.03 0.00 -0.00 0.00 0.00 29.16 29.50 2b39 h TRP 615 CO 0.00 0.68 0.72 -0.44 -0.00 0.00 0.00 178.44 179.40 2b39 h ASP 616 N -0.36 0.00 -0.18 -3.49 3.32 -1.04 1.17 116.42 115.85 2b39 h ASP 616 Ca 0.00 0.00 -0.03 0.00 0.02 0.00 0.00 57.03 57.02 2b39 h ASP 616 Cb 0.67 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.21 2b39 h ASP 616 CO 0.02 0.00 -0.02 0.58 -1.72 0.00 0.00 179.24 178.10 2b39 h VAL 617 N 0.00 1.27 0.00 -1.35 2.07 -1.08 -1.63 116.25 115.53 2b39 h VAL 617 Ca 0.37 -0.93 -0.01 0.00 0.82 0.00 0.00 66.70 66.94 2b39 h VAL 617 Cb 1.81 1.53 -0.00 0.00 -1.52 0.00 0.00 31.29 33.11 2b39 h VAL 617 CO -0.00 0.28 -0.17 0.58 0.02 0.00 0.00 177.57 178.27 2b39 h VAL 618 N 0.06 0.32 -0.26 2.57 2.07 0.79 -3.18 116.25 118.61 2b39 h VAL 618 Ca 0.05 -1.26 0.06 0.00 0.82 0.00 0.00 66.70 66.36 2b39 h VAL 618 Cb 0.43 0.62 -0.08 0.00 -1.52 0.00 0.00 31.29 30.75 2b39 h VAL 618 CO 0.01 0.11 -0.39 -0.08 0.02 0.00 0.00 177.57 177.24 2b39 h GLU 619 N -1.00 -0.37 0.00 1.57 4.81 0.79 0.53 114.58 120.91 2b39 h GLU 619 Ca -0.02 0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.24 2b39 h GLU 619 Cb 0.32 0.08 0.00 0.00 0.63 0.00 0.00 28.75 29.79 2b39 h GLU 619 CO -0.01 -0.25 0.00 1.63 -0.73 0.00 0.00 179.01 179.65 2b39 n LYS 620 N -5.42 0.65 0.00 1.92 5.02 -0.61 -4.13 118.16 115.58 2b39 n LYS 620 Ca -0.02 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.27 2b39 n LYS 620 Cb 0.35 -1.28 0.00 0.00 -0.02 0.00 0.00 35.03 34.08 2b39 n LYS 620 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2b39 n ALA 621 N -0.78 0.05 -0.17 7.82 0.00 0.16 -4.92 120.51 122.68 2b39 n ALA 621 Ca 0.09 0.00 0.14 0.00 0.00 0.00 0.00 53.44 53.67 2b39 n ALA 621 Cb 0.04 0.00 0.23 0.00 0.00 0.00 0.00 19.45 19.72 2b39 n ALA 621 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2b39 n ASP 622 N 0.00 0.05 -3.78 0.00 8.00 0.12 -4.67 116.55 116.26 2b39 n ASP 622 Ca 0.00 0.41 -0.13 0.00 0.71 0.00 0.00 54.79 55.78 2b39 n ASP 622 Cb 0.00 -0.20 0.05 0.00 -0.02 0.00 0.00 41.12 40.94 2b39 n ASP 622 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2b39 n ILE 623 N -3.11 0.00 -1.46 0.53 3.06 -1.25 -4.39 119.36 112.75 2b39 n ILE 623 Ca 0.13 -0.02 -0.16 0.00 -2.50 0.00 0.00 62.75 60.20 2b39 n ILE 623 Cb 0.54 -0.13 0.16 0.00 0.54 0.00 0.00 39.64 40.74 2b39 n ILE 623 CO 0.00 0.00 0.00 0.61 -2.50 0.00 0.00 176.55 174.66 2b39 n GLY 624 N 2.94 5.13 0.98 4.50 0.00 -1.26 -4.92 105.19 112.56 2b39 n GLY 624 Ca 0.01 -1.52 0.13 0.00 0.00 0.00 0.00 46.02 44.63 2b39 n GLY 624 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2b39 n THR 626 N -3.65 0.00 1.30 0.00 5.66 -1.26 -4.51 114.28 111.82 2b39 n THR 626 Ca -0.02 0.00 0.13 0.00 -3.05 0.00 0.00 64.05 61.11 2b39 n THR 626 Cb 0.46 -0.19 0.39 0.00 -1.55 0.00 0.00 70.33 69.44 2b39 n THR 626 CO 0.00 0.00 0.00 -0.81 -3.05 0.00 0.00 175.07 171.21 2b39 n PRO 627 N 0.81 1.21 0.00 1.09 -0.04 -1.26 -4.67 135.00 132.14 2b39 n PRO 627 Ca 0.00 -0.75 0.00 0.00 -0.04 0.00 0.00 63.50 62.71 2b39 n PRO 627 Cb 0.00 -1.48 0.00 0.00 -0.04 0.00 0.00 33.50 31.98 2b39 n PRO 627 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2b39 n GLY 628 N 1.29 -1.80 0.52 0.55 0.00 -1.26 -4.33 105.19 100.16 2b39 n GLY 628 Ca 0.14 -1.22 -0.04 0.00 0.00 0.00 0.00 46.02 44.91 2b39 n GLY 628 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2b39 n SER 629 N 0.00 1.20 0.00 1.61 3.41 -1.26 -4.71 113.62 113.87 2b39 n SER 629 Ca 0.00 0.19 0.00 0.00 -0.26 0.00 0.00 58.87 58.80 2b39 n SER 629 Cb 0.00 -0.49 0.00 0.00 -0.26 0.00 0.00 64.21 63.46 2b39 n SER 629 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2b39 n GLY 630 N 2.41 4.03 3.60 5.00 0.00 -1.26 -3.97 105.19 114.99 2b39 n GLY 630 Ca -0.06 -1.43 -0.43 0.00 0.00 0.00 0.00 46.02 44.10 2b39 n GLY 630 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2b39 s ARG 631 N -4.41 3.78 0.19 1.61 0.52 -1.26 -4.36 118.95 115.02 2b39 s ARG 631 Ca 0.00 0.60 0.00 0.00 -0.52 0.00 0.00 55.73 55.81 2b39 s ARG 631 Cb 0.00 -3.86 0.00 0.00 0.52 0.00 0.00 34.95 31.61 2b39 s ARG 631 CO 0.00 -1.21 0.00 0.09 0.02 0.00 0.00 175.30 174.20 2b39 n ASN 632 N 7.40 -3.89 -0.27 0.23 5.03 -1.26 -2.68 115.26 119.83 2b39 n ASN 632 Ca 0.10 0.39 -0.06 0.00 0.87 0.00 0.00 54.58 55.87 2b39 n ASN 632 Cb 0.48 -2.05 0.05 0.00 -1.02 0.00 0.00 39.78 37.25 2b39 n ASN 632 CO 0.00 0.00 0.00 0.10 -1.83 0.00 0.00 177.26 175.53 2b39 h TYR 633 N -0.62 1.15 0.24 3.10 -0.00 -1.83 -2.79 116.97 116.22 2b39 h TYR 633 Ca -0.02 -0.10 -0.01 0.00 0.00 0.00 0.00 58.73 58.60 2b39 h TYR 633 Cb 0.60 -0.34 -0.00 0.00 0.00 0.00 0.00 36.73 36.99 2b39 h TYR 633 CO -0.60 0.89 -0.13 0.00 -0.00 0.00 0.00 178.16 178.33 2b39 h ALA 634 N 1.13 -0.34 0.10 0.10 0.00 -1.85 -2.90 119.26 115.51 2b39 h ALA 634 Ca 0.24 -0.07 0.02 0.00 0.00 0.00 0.00 54.91 55.10 2b39 h ALA 634 Cb 0.25 0.15 -0.04 0.00 0.00 0.00 0.00 17.79 18.15 2b39 h ALA 634 CO -0.01 -0.69 -0.35 0.78 0.00 0.00 0.00 179.25 178.98 2b39 h GLY 635 N -0.34 -0.66 0.45 0.00 0.00 -1.43 -1.67 103.07 99.42 2b39 h GLY 635 Ca -0.03 0.41 0.08 0.00 0.00 0.00 0.00 47.33 47.80 2b39 h GLY 635 CO 0.04 -0.25 0.21 -2.08 0.00 0.00 0.00 176.54 174.46 2b39 h VAL 636 N -0.57 0.80 0.53 4.60 2.07 -1.53 0.19 116.25 122.34 2b39 h VAL 636 Ca 0.03 -0.13 -0.03 0.00 0.82 0.00 0.00 66.70 67.39 2b39 h VAL 636 Cb 0.60 0.37 0.01 0.00 -1.52 0.00 0.00 31.29 30.75 2b39 h VAL 636 CO -0.21 0.07 -0.26 -0.26 0.02 0.00 0.00 177.57 176.93 2b39 h PHE 637 N 0.39 -0.66 -0.59 1.57 0.04 -1.35 -3.06 116.94 113.28 2b39 h PHE 637 Ca 0.28 -0.02 0.03 0.00 2.80 0.00 0.00 57.97 61.07 2b39 h PHE 637 Cb 0.32 0.22 -0.03 0.00 2.20 0.00 0.00 35.95 38.66 2b39 h PHE 637 CO -0.16 -0.34 0.39 1.79 -0.60 0.00 0.00 178.31 179.39 2b39 h THR 638 N -0.92 1.07 0.00 -1.55 1.35 -1.11 0.31 112.91 112.07 2b39 h THR 638 Ca -0.07 -0.23 -0.00 0.00 -0.55 0.00 0.00 66.41 65.55 2b39 h THR 638 Cb 0.62 0.33 -0.00 0.00 -1.73 0.00 0.00 68.15 67.36 2b39 h THR 638 CO 0.12 0.12 -0.02 0.44 -0.25 0.00 0.00 175.52 175.93 2b39 h ASP 639 N 0.68 0.00 -0.12 5.36 3.32 -0.55 -1.53 116.42 123.58 2b39 h ASP 639 Ca 0.24 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.29 2b39 h ASP 639 Cb 0.10 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.65 2b39 h ASP 639 CO -0.06 0.02 0.00 0.00 -1.72 0.00 0.00 179.24 177.48 2b39 n ALA 640 N -2.33 2.43 -0.38 3.45 0.00 -0.53 -4.20 120.51 118.95 2b39 n ALA 640 Ca -0.03 -0.75 0.00 0.00 0.00 0.00 0.00 53.44 52.66 2b39 n ALA 640 Cb 0.11 -0.55 0.00 0.00 0.00 0.00 0.00 19.45 19.01 2b39 n ALA 640 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2b39 n GLY 641 N 0.90 1.03 3.44 0.00 0.00 -0.58 -4.44 105.19 105.54 2b39 n GLY 641 Ca 0.11 -0.11 -0.22 0.00 0.00 0.00 0.00 46.02 45.80 2b39 n GLY 641 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2b39 s LEU 642 N -0.15 2.59 -0.30 0.99 1.43 0.99 0.22 118.68 124.46 2b39 s LEU 642 Ca 0.00 -1.05 -0.09 0.00 -1.03 0.00 0.00 54.13 51.96 2b39 s LEU 642 Cb 0.00 -0.95 0.18 0.00 0.03 0.00 0.00 46.19 45.45 2b39 s LEU 642 CO 0.00 -0.06 0.91 0.42 0.23 0.00 0.00 176.35 177.85 2b39 s THR 643 N -2.67 -0.54 0.01 5.49 -4.23 -0.93 -2.99 115.64 109.79 2b39 s THR 643 Ca 0.28 0.00 0.00 0.00 -1.18 0.00 0.00 61.69 60.79 2b39 s THR 643 Cb -0.03 -1.00 -0.01 0.00 1.34 0.00 0.00 72.50 72.80 2b39 s THR 643 CO 0.13 0.00 -0.02 -0.76 -0.54 0.00 0.00 174.62 173.42 2b39 s LEU 644 N 2.91 2.17 0.04 4.79 1.43 -1.26 -3.97 118.68 124.78 2b39 s LEU 644 Ca 0.06 -0.35 0.07 0.00 -1.03 0.00 0.00 54.13 52.88 2b39 s LEU 644 Cb -0.12 0.05 -0.03 0.00 0.03 0.00 0.00 46.19 46.12 2b39 s LEU 644 CO -0.14 -0.20 -0.18 -0.75 0.23 0.00 0.00 176.35 175.30 2b39 s LYS 645 N -1.02 2.06 0.38 1.70 2.20 -1.26 -4.03 119.74 119.78 2b39 s LYS 645 Ca -0.11 -0.98 0.06 0.00 -0.36 0.00 0.00 55.97 54.58 2b39 s LYS 645 Cb -0.07 -2.18 -0.07 0.00 -1.51 0.00 0.00 37.83 34.00 2b39 s LYS 645 CO -0.01 0.54 0.03 0.95 -0.36 0.00 0.00 175.35 176.50 2b39 s THR 646 N -0.91 1.66 -1.12 3.43 -4.23 0.28 -4.97 115.64 109.78 2b39 s THR 646 Ca 0.14 -2.00 0.10 0.00 -1.18 0.00 0.00 61.69 58.76 2b39 s THR 646 Cb -0.10 -2.90 0.11 0.00 1.34 0.00 0.00 72.50 70.95 2b39 s THR 646 CO 0.05 0.00 1.30 -1.20 -0.54 0.00 0.00 174.62 174.23 2b39 n SER 647 N -0.87 0.00 -0.98 3.99 7.64 -1.26 -1.27 113.62 120.86 2b39 n SER 647 Ca -0.04 0.40 0.09 0.00 1.01 0.00 0.00 58.87 60.32 2b39 n SER 647 Cb 0.67 -0.44 0.22 0.00 -1.01 0.00 0.00 64.21 63.65 2b39 n SER 647 CO 0.00 0.00 0.00 1.67 -3.01 0.00 0.00 175.04 173.70 2b39 n GLN 648 N -1.44 2.66 -0.51 1.43 -0.06 -1.26 -4.95 117.38 113.25 2b39 n GLN 648 Ca 0.03 -2.29 0.00 0.00 -2.00 0.00 0.00 57.00 52.74 2b39 n GLN 648 Cb 0.11 -1.42 0.00 0.00 -4.06 0.00 0.00 30.24 24.87 2b39 n GLN 648 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 2b39 n GLY 649 N 1.09 0.78 3.61 1.69 0.00 -0.40 -5.01 105.19 106.96 2b39 n GLY 649 Ca 0.17 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.77 2b39 n GLY 649 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2b39 s LEU 650 N 0.00 3.57 0.15 0.99 1.02 -1.26 -4.80 118.68 118.35 2b39 s LEU 650 Ca 0.00 1.46 -0.25 0.00 0.02 0.00 0.00 54.13 55.36 2b39 s LEU 650 Cb 0.00 -3.52 0.06 0.00 0.02 0.00 0.00 46.19 42.75 2b39 s LEU 650 CO 0.00 -1.66 0.94 -1.83 0.02 0.00 0.00 176.35 173.82 2b39 s GLU 651 N 5.57 1.19 0.09 1.70 -1.05 -1.26 -0.56 118.70 124.39 2b39 s GLU 651 Ca 0.82 -0.65 0.08 0.00 -0.15 0.00 0.00 54.97 55.07 2b39 s GLU 651 Cb -0.25 0.42 -0.04 0.00 -0.44 0.00 0.00 34.13 33.82 2b39 s GLU 651 CO 0.34 -0.55 -0.16 0.95 0.95 0.00 0.00 175.26 176.79 2b39 s THR 652 N -3.30 2.95 0.45 1.83 -4.23 -1.26 -4.72 115.64 107.35 2b39 s THR 652 Ca 0.12 -1.36 0.04 0.00 -1.18 0.00 0.00 61.69 59.30 2b39 s THR 652 Cb -0.02 -2.33 0.06 0.00 1.34 0.00 0.00 72.50 71.55 2b39 s THR 652 CO 0.02 0.17 0.73 0.00 -0.54 0.00 0.00 174.62 175.00 2b39 n GLN 653 N 0.99 0.02 0.00 3.99 3.00 -1.26 -4.77 117.38 119.34 2b39 n GLN 653 Ca -0.15 0.67 0.00 0.00 -0.01 0.00 0.00 57.00 57.50 2b39 n GLN 653 Cb 0.52 -1.77 0.00 0.00 0.00 0.00 0.00 30.24 28.99 2b39 n GLN 653 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.06 178.00 2b39 n GLN 654 N -2.04 0.00 -0.01 -1.09 0.00 -1.26 -4.87 117.38 108.11 2b39 n GLN 654 Ca 0.03 0.00 -0.00 0.00 -0.00 0.00 0.00 57.00 57.03 2b39 n GLN 654 Cb 0.77 -2.79 -0.00 0.00 0.00 0.00 0.00 30.24 28.22 2b39 n GLN 654 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.06 174.93 2b39 n ARG 655 N -1.55 0.00 -4.06 3.69 0.63 -1.26 -4.64 116.66 109.47 2b39 n ARG 655 Ca 0.00 0.00 -0.36 0.00 -0.92 0.00 0.00 57.85 56.57 2b39 n ARG 655 Cb 0.00 -0.01 -0.07 0.00 0.45 0.00 0.00 32.46 32.83 2b39 n ARG 655 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 2b39 s ALA 656 N -0.00 3.67 0.00 5.13 0.00 -1.26 -4.96 121.76 124.33 2b39 s ALA 656 Ca 0.01 -0.70 0.00 0.00 0.00 0.00 0.00 51.96 51.27 2b39 s ALA 656 Cb -0.01 -1.79 0.00 0.00 0.00 0.00 0.00 23.12 21.32 2b39 s ALA 656 CO 0.00 0.61 0.00 -0.25 0.00 0.00 0.00 175.76 176.12 2b39 n ASP 657 N 2.04 0.00 0.34 0.00 8.00 -1.26 -5.06 116.55 120.62 2b39 n ASP 657 Ca -0.19 0.00 -0.16 0.00 0.71 0.00 0.00 54.79 55.15 2b39 n ASP 657 Cb 0.54 0.00 -0.08 0.00 -0.02 0.00 0.00 41.12 41.57 2b39 n ASP 657 CO 0.00 0.00 0.00 1.55 -0.39 0.00 0.00 177.20 178.36 2b39 h PRO 658 N 0.00 -0.92 0.00 -0.24 0.13 -2.00 -3.42 132.00 125.55 2b39 h PRO 658 Ca 0.00 0.06 0.00 0.00 -0.87 0.00 0.00 66.00 65.19 2b39 h PRO 658 Cb 0.00 0.21 0.00 0.00 0.13 0.00 0.00 31.00 31.34 2b39 h PRO 658 CO 0.00 -0.62 0.00 1.04 -0.23 0.00 0.00 178.00 178.19 2b39 n GLN 659 N -4.85 0.50 -4.29 0.86 6.02 -1.26 -4.96 117.38 109.40 2b39 n GLN 659 Ca -0.12 0.00 -0.19 0.00 -0.01 0.00 0.00 57.00 56.69 2b39 n GLN 659 Cb 0.40 0.00 -0.13 0.00 1.02 0.00 0.00 30.24 31.53 2b39 n GLN 659 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2b39 n PRO 661 N 1.88 0.00 -0.94 0.00 -0.02 -1.26 -5.13 135.00 129.53 2b39 n PRO 661 Ca -0.18 0.00 0.05 0.00 -2.02 0.00 0.00 63.50 61.34 2b39 n PRO 661 Cb 0.55 -0.68 -0.03 0.00 -0.02 0.00 0.00 33.50 33.32 2b39 n PRO 661 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 2b39 n GLN 662 N 0.68 -2.34 0.00 -0.52 6.02 -1.26 -5.18 117.38 114.78 2b39 n GLN 662 Ca 0.10 1.86 0.00 0.00 -0.01 0.00 0.00 57.00 58.95 2b39 n GLN 662 Cb 0.06 -2.46 0.00 0.00 1.02 0.00 0.00 30.24 28.86 2b39 n GLN 662 CO 0.00 0.00 0.00 0.43 -1.01 0.00 0.00 177.06 176.48 2b39 n SER 670 N -2.75 0.00 -0.67 1.08 7.64 -1.26 -5.28 113.62 112.38 2b39 n SER 670 Ca -0.03 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.85 2b39 n SER 670 Cb 0.36 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.56 2b39 n SER 670 CO 0.00 0.00 0.00 0.52 -3.01 0.00 0.00 175.04 172.55 2b39 n VAL 671 N 0.77 0.00 -0.11 0.44 0.31 -1.26 -4.59 118.33 113.89 2b39 n VAL 671 Ca 0.00 0.00 -0.14 0.00 -0.01 0.00 0.00 64.34 64.19 2b39 n VAL 671 Cb 0.00 0.00 -0.13 0.00 -0.91 0.00 0.00 33.84 32.80 2b39 n VAL 671 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2b39 n GLN 672 N -0.67 0.70 -0.04 5.55 10.64 -1.26 -4.43 117.38 127.87 2b39 n GLN 672 Ca 0.00 0.08 -0.07 0.00 -1.83 0.00 0.00 57.00 55.18 2b39 n GLN 672 Cb 0.00 -1.50 -0.03 0.00 -0.86 0.00 0.00 30.24 27.84 2b39 n GLN 672 CO 0.00 0.00 0.00 1.47 -1.83 0.00 0.00 177.06 176.70 2b39 n LEU 673 N -3.02 1.70 0.32 2.61 -0.00 -1.26 -4.51 117.00 112.82 2b39 n LEU 673 Ca -0.39 0.04 0.20 0.00 -0.00 0.00 0.00 56.01 55.85 2b39 n LEU 673 Cb 1.04 -0.26 1.07 0.00 -0.00 0.00 0.00 43.42 45.27 2b39 n LEU 673 CO 0.32 0.39 1.16 0.24 -0.00 0.00 0.00 177.39 179.50 2b39 h MET 674 N -0.16 0.00 0.21 1.47 2.86 -1.87 -0.71 114.93 116.73 2b39 h MET 674 Ca -0.20 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.43 2b39 h MET 674 Cb 1.23 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.89 2b39 h MET 674 CO -0.08 0.00 -0.10 1.49 1.06 0.00 0.00 176.91 179.28 2b39 h GLU 675 N 0.00 -0.27 -0.33 1.72 4.57 -1.80 -2.92 114.58 115.54 2b39 h GLU 675 Ca 0.01 0.02 0.07 0.00 -1.18 0.00 0.00 59.36 58.28 2b39 h GLU 675 Cb 0.10 0.06 -0.02 0.00 -0.16 0.00 0.00 28.75 28.74 2b39 h GLU 675 CO -0.00 -0.18 0.23 0.87 -1.18 0.00 0.00 179.01 178.75 2b39 h LYS 676 N -0.31 0.12 -0.49 1.92 1.57 -1.69 -0.24 116.57 117.44 2b39 h LYS 676 Ca -0.03 -0.01 0.14 0.00 -1.87 0.00 0.00 60.65 58.89 2b39 h LYS 676 Cb 0.22 -0.03 -0.02 0.00 0.08 0.00 0.00 32.23 32.48 2b39 h LYS 676 CO 0.05 0.08 0.37 -0.09 -0.57 0.00 0.00 179.45 179.28 2b39 h ARG 677 N 0.12 0.00 0.00 3.15 1.12 -1.04 -1.39 114.38 116.34 2b39 h ARG 677 Ca 0.15 0.00 -0.35 0.00 -1.11 0.00 0.00 59.98 58.67 2b39 h ARG 677 Cb 0.45 0.00 -0.06 0.00 -0.01 0.00 0.00 29.97 30.35 2b39 h ARG 677 CO -0.02 0.00 -2.32 -1.33 -3.11 0.00 0.00 179.97 173.20 2b39 n MET 678 N -4.32 0.76 -0.30 0.20 2.81 -0.16 -3.35 117.12 112.76 2b39 n MET 678 Ca 0.09 0.07 -0.00 0.00 -1.81 0.00 0.00 57.70 56.05 2b39 n MET 678 Cb 0.58 -1.47 0.12 0.00 -0.71 0.00 0.00 33.22 31.74 2b39 n MET 678 CO 0.00 0.00 0.00 -0.44 1.51 0.00 0.00 175.97 177.04 2b39 h ASP 679 N 0.00 0.81 0.35 7.83 3.32 -1.17 0.31 116.42 127.87 2b39 h ASP 679 Ca -0.52 0.01 -0.02 0.00 0.02 0.00 0.00 57.03 56.53 2b39 h ASP 679 Cb 1.96 -0.16 0.00 0.00 0.22 0.00 0.00 39.33 41.35 2b39 h ASP 679 CO -0.04 0.53 -0.17 0.50 -1.72 0.00 0.00 179.24 178.35 2b39 h LYS 680 N 0.95 -0.46 0.00 3.56 1.63 -1.46 -2.54 116.57 118.26 2b39 h LYS 680 Ca 0.35 0.03 0.00 0.00 -0.85 0.00 0.00 60.65 60.18 2b39 h LYS 680 Cb 0.13 0.10 0.00 0.00 -0.60 0.00 0.00 32.23 31.86 2b39 h LYS 680 CO -0.16 -0.14 0.31 0.00 -3.45 0.00 0.00 179.45 176.01 2b39 h ALA 681 N -0.31 1.24 0.08 5.00 0.00 -1.35 -0.06 119.26 123.86 2b39 h ALA 681 Ca -0.05 0.00 -0.27 0.00 0.00 0.00 0.00 54.91 54.59 2b39 h ALA 681 Cb 0.52 0.00 0.02 0.00 0.00 0.00 0.00 17.79 18.33 2b39 h ALA 681 CO 0.08 -0.24 -1.15 0.78 0.00 0.00 0.00 179.25 178.72 2b39 h GLY 682 N 0.00 0.60 0.64 0.00 0.00 0.04 -3.20 103.07 101.16 2b39 h GLY 682 Ca 0.00 -1.20 0.06 0.00 0.00 0.00 0.00 47.33 46.19 2b39 h GLY 682 CO 0.00 1.06 0.62 1.46 0.00 0.00 0.00 176.54 179.68 2b39 h GLN 683 N 0.25 0.00 -6.07 4.80 4.20 -1.02 -3.40 115.11 113.87 2b39 h GLN 683 Ca -0.15 0.00 -0.60 0.00 0.06 0.00 0.00 58.65 57.96 2b39 h GLN 683 Cb 1.82 0.00 -0.06 0.00 0.30 0.00 0.00 27.48 29.54 2b39 h GLN 683 CO 0.21 0.00 -0.53 0.71 -0.67 0.00 0.00 178.83 178.55 2b39 s TYR 684 N -4.22 3.35 0.09 2.96 2.02 -1.21 -5.07 117.35 115.27 2b39 s TYR 684 Ca -0.03 0.12 0.07 0.00 -0.37 0.00 0.00 57.07 56.87 2b39 s TYR 684 Cb 0.09 -1.65 -0.03 0.00 -0.40 0.00 0.00 41.96 39.96 2b39 s TYR 684 CO 0.29 0.54 -0.18 -1.54 -1.57 0.00 0.00 175.55 173.09 2b39 s SER 685 N -2.74 2.20 0.58 2.29 1.04 -1.26 -4.51 113.70 111.31 2b39 s SER 685 Ca 0.32 -0.67 0.00 0.00 0.48 0.00 0.00 55.95 56.08 2b39 s SER 685 Cb -0.12 -0.10 0.00 0.00 0.10 0.00 0.00 66.02 65.90 2b39 s SER 685 CO 0.26 -0.00 0.00 -1.54 0.98 0.00 0.00 173.24 172.93 2b39 n SER 686 N 1.09 0.00 -0.12 7.02 3.41 -1.26 -2.12 113.62 121.64 2b39 n SER 686 Ca -0.20 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.41 2b39 n SER 686 Cb 0.54 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.49 2b39 n SER 686 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 2b39 n ASP 687 N -1.32 0.03 -0.12 4.04 9.92 -1.26 -0.90 116.55 126.94 2b39 n ASP 687 Ca 0.00 -0.24 -0.22 0.00 -0.53 0.00 0.00 54.79 53.80 2b39 n ASP 687 Cb 0.00 -0.01 -0.10 0.00 -0.64 0.00 0.00 41.12 40.37 2b39 n ASP 687 CO 0.00 0.00 0.00 0.18 0.13 0.00 0.00 177.20 177.51 2b39 n LEU 688 N -0.28 2.31 0.07 0.64 4.77 -0.90 -3.96 117.00 119.65 2b39 n LEU 688 Ca 0.00 0.12 0.17 0.00 -0.03 0.00 0.00 56.01 56.27 2b39 n LEU 688 Cb 0.01 -0.78 0.69 0.00 -2.33 0.00 0.00 43.42 41.01 2b39 n LEU 688 CO 0.00 0.69 1.16 -0.09 -1.33 0.00 0.00 177.39 177.82 2b39 h ARG 689 N -0.51 0.00 -0.14 3.23 2.43 -0.99 0.12 114.38 118.52 2b39 h ARG 689 Ca -0.59 0.00 -0.09 0.00 -0.81 0.00 0.00 59.98 58.48 2b39 h ARG 689 Cb 1.68 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 31.23 2b39 h ARG 689 CO -0.25 0.00 -0.27 0.87 -1.51 0.00 0.00 179.97 178.80 2b39 h LYS 690 N 0.00 0.43 -0.97 0.20 1.57 -1.73 -0.16 116.57 115.91 2b39 h LYS 690 Ca 0.18 -0.28 0.06 0.00 -1.87 0.00 0.00 60.65 58.75 2b39 h LYS 690 Cb 0.76 0.03 -0.06 0.00 0.08 0.00 0.00 32.23 33.04 2b39 h LYS 690 CO -0.00 0.88 0.63 0.00 -0.57 0.00 0.00 179.45 180.39 2b39 h GLU 693 N -1.18 -0.21 0.00 0.00 5.08 -0.84 0.44 114.58 117.87 2b39 h GLU 693 Ca -0.10 0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.27 2b39 h GLU 693 Cb 0.74 0.05 0.00 0.00 0.50 0.00 0.00 28.75 30.04 2b39 h GLU 693 CO 0.16 -0.14 0.33 -0.44 -1.00 0.00 0.00 179.01 177.93 2b39 h ASP 694 N -0.22 0.00 0.82 1.42 3.32 -1.21 0.51 116.42 121.06 2b39 h ASP 694 Ca 0.20 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.25 2b39 h ASP 694 Cb 0.55 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.10 2b39 h ASP 694 CO -0.62 0.00 -0.59 0.61 -1.72 0.00 0.00 179.24 176.91 2b39 n GLY 695 N -1.26 -1.39 1.17 2.75 0.00 0.15 -3.75 105.19 102.86 2b39 n GLY 695 Ca -0.01 -0.26 0.12 0.00 0.00 0.00 0.00 46.02 45.87 2b39 n GLY 695 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2b39 n MET 696 N -2.01 2.52 -2.74 1.61 2.81 0.18 -4.22 117.12 115.26 2b39 n MET 696 Ca 0.04 -2.31 -0.32 0.00 -1.81 0.00 0.00 57.70 53.31 2b39 n MET 696 Cb 0.42 -1.52 -0.04 0.00 -0.71 0.00 0.00 33.22 31.37 2b39 n MET 696 CO 0.00 0.00 0.00 1.03 1.51 0.00 0.00 175.97 178.51 2b39 s ARG 697 N -1.49 3.92 0.99 0.03 0.52 -1.22 -5.05 118.95 116.64 2b39 s ARG 697 Ca 0.39 0.73 -0.12 0.00 -0.52 0.00 0.00 55.73 56.21 2b39 s ARG 697 Cb 0.23 -2.29 0.18 0.00 0.52 0.00 0.00 34.95 33.59 2b39 s ARG 697 CO 0.32 -0.08 1.08 0.34 0.02 0.00 0.00 175.30 176.98 2b39 s ASP 698 N -2.89 2.55 -0.18 0.23 -1.08 -1.26 -5.05 116.67 108.99 2b39 s ASP 698 Ca 0.55 1.57 -0.04 0.00 -0.52 0.00 0.00 52.55 54.11 2b39 s ASP 698 Cb -0.10 -2.23 0.08 0.00 -1.46 0.00 0.00 42.92 39.21 2b39 s ASP 698 CO 0.27 -3.23 0.19 0.21 0.52 0.00 0.00 175.17 173.13 2b39 s ASN 699 N -3.05 1.49 0.27 -0.34 3.84 -1.26 -5.05 114.94 110.84 2b39 s ASN 699 Ca 0.66 -0.23 -0.00 0.00 0.21 0.00 0.00 52.86 53.50 2b39 s ASN 699 Cb -0.21 0.25 0.61 0.00 -0.55 0.00 0.00 41.25 41.35 2b39 s ASN 699 CO 0.59 -0.32 1.37 -2.65 -2.79 0.00 0.00 177.10 173.30 2b39 n PRO 700 N 5.31 -0.07 -0.04 0.43 -0.02 -1.26 0.48 135.00 139.83 2b39 n PRO 700 Ca -0.06 1.32 -0.17 0.00 -2.02 0.00 0.00 63.50 62.58 2b39 n PRO 700 Cb 0.49 -2.07 -0.07 0.00 -0.02 0.00 0.00 33.50 31.84 2b39 n PRO 700 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2b39 h MET 701 N 0.00 0.77 -0.64 -0.52 -0.00 -1.96 -3.47 114.93 109.11 2b39 h MET 701 Ca 0.51 -0.59 0.00 0.00 -0.00 0.00 0.00 59.70 59.61 2b39 h MET 701 Cb 1.00 0.11 0.00 0.00 -0.00 0.00 0.00 31.60 32.71 2b39 h MET 701 CO -0.84 1.21 0.00 1.63 -0.00 0.00 0.00 176.91 178.91 2b39 n LYS 702 N -4.01 0.00 -2.13 -0.10 4.01 0.18 -5.04 118.16 111.07 2b39 n LYS 702 Ca -0.07 0.00 -0.39 0.00 -0.51 0.00 0.00 58.31 57.34 2b39 n LYS 702 Cb 0.70 -2.07 -0.01 0.00 -0.51 0.00 0.00 35.03 33.14 2b39 n LYS 702 CO 0.00 0.00 0.00 -0.06 -1.11 0.00 0.00 177.40 176.23 2b39 s PHE 703 N -2.64 2.88 0.42 2.13 0.08 -1.26 -4.97 117.98 114.62 2b39 s PHE 703 Ca 0.00 1.46 -0.25 0.00 0.12 0.00 0.00 56.93 58.26 2b39 s PHE 703 Cb 0.00 -3.57 -0.08 0.00 -0.57 0.00 0.00 43.02 38.80 2b39 s PHE 703 CO 0.00 -1.85 1.27 -1.25 -0.10 0.00 0.00 175.22 173.29 2b39 s PRO 704 N -2.30 3.88 0.32 0.24 0.04 -1.26 -4.65 135.00 131.27 2b39 s PRO 704 Ca 0.58 2.06 0.18 0.00 0.04 0.00 0.00 61.00 63.86 2b39 s PRO 704 Cb -0.35 -2.65 1.15 0.00 0.04 0.00 0.00 34.50 32.68 2b39 s PRO 704 CO 0.45 -0.53 1.34 0.00 0.04 0.00 0.00 177.00 178.29 2b39 h GLN 706 N 0.00 0.22 0.05 0.00 4.20 -1.98 -2.11 115.11 115.50 2b39 h GLN 706 Ca 0.72 -0.06 -0.07 0.00 0.06 0.00 0.00 58.65 59.30 2b39 h GLN 706 Cb 1.93 -0.03 0.01 0.00 0.30 0.00 0.00 27.48 29.69 2b39 h GLN 706 CO -0.64 0.41 -0.32 -0.09 -0.67 0.00 0.00 178.83 177.52 2b39 h ARG 707 N 0.20 0.12 -0.78 1.46 9.65 0.18 -3.29 114.38 121.93 2b39 h ARG 707 Ca 0.04 -0.20 0.15 0.00 -1.10 0.00 0.00 59.98 58.86 2b39 h ARG 707 Cb 0.46 0.07 -0.10 0.00 -1.39 0.00 0.00 29.97 29.02 2b39 h ARG 707 CO 0.03 1.09 0.33 0.00 2.80 0.00 0.00 179.97 184.22 2b39 h ARG 708 N -0.74 0.46 -0.79 0.20 3.08 -1.30 -1.20 114.38 114.10 2b39 h ARG 708 Ca -0.06 -0.03 0.23 0.00 0.07 0.00 0.00 59.98 60.20 2b39 h ARG 708 Cb 1.24 -0.10 -0.03 0.00 0.08 0.00 0.00 29.97 31.16 2b39 h ARG 708 CO 0.06 0.30 0.59 0.00 -1.07 0.00 0.00 179.97 179.86 2b39 h ALA 709 N 1.56 2.71 0.00 0.04 0.00 -1.45 -0.13 119.26 121.99 2b39 h ALA 709 Ca 0.43 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.30 2b39 h ALA 709 Cb 0.65 0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.50 2b39 h ALA 709 CO -0.40 -1.00 -0.04 1.96 0.00 0.00 0.00 179.25 179.77 2b39 h GLN 710 N 0.00 0.00 -0.00 0.00 4.20 -1.33 0.12 115.11 118.10 2b39 h GLN 710 Ca 0.37 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.08 2b39 h GLN 710 Cb 1.56 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.34 2b39 h GLN 710 CO -0.00 0.04 -0.27 1.19 -0.67 0.00 0.00 178.83 179.12 2b39 n PHE 711 N -3.72 0.00 -2.19 2.96 3.01 -0.06 -4.82 117.46 112.64 2b39 n PHE 711 Ca -0.03 0.00 -0.42 0.00 1.01 0.00 0.00 57.45 58.01 2b39 n PHE 711 Cb 0.14 -0.25 -0.03 0.00 -0.01 0.00 0.00 39.48 39.33 2b39 n PHE 711 CO 0.00 0.00 0.00 0.42 1.01 0.00 0.00 176.76 178.19 2b39 s ILE 712 N -2.77 3.40 -0.03 4.37 1.01 0.03 -3.97 121.20 123.23 2b39 s ILE 712 Ca 0.19 0.98 0.00 0.00 0.00 0.00 0.00 60.65 61.82 2b39 s ILE 712 Cb 0.19 -3.63 0.01 0.00 0.01 0.00 0.00 42.46 39.03 2b39 s ILE 712 CO 0.58 0.07 0.73 -0.11 0.00 0.00 0.00 174.94 176.21 2b39 n LEU 713 N 4.13 1.48 0.15 2.97 7.94 -1.26 -4.65 117.00 127.76 2b39 n LEU 713 Ca 0.12 -1.45 0.13 0.00 -1.11 0.00 0.00 56.01 53.69 2b39 n LEU 713 Cb 0.43 -0.00 0.39 0.00 0.53 0.00 0.00 43.42 44.77 2b39 n LEU 713 CO 0.58 0.37 0.87 1.56 -1.11 0.00 0.00 177.39 179.67 2b39 h GLN 714 N 0.06 0.00 0.00 1.96 7.50 -1.90 -3.49 115.11 119.24 2b39 h GLN 714 Ca 0.00 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.15 2b39 h GLN 714 Cb 0.24 0.00 0.00 0.00 0.05 0.00 0.00 27.48 27.77 2b39 h GLN 714 CO 0.00 0.00 0.00 0.41 -1.50 0.00 0.00 178.83 177.74 2b39 n GLY 715 N 0.94 2.23 0.00 3.46 0.00 -1.26 -4.76 105.19 105.80 2b39 n GLY 715 Ca 0.04 -1.71 0.00 0.00 0.00 0.00 0.00 46.02 44.35 2b39 n GLY 715 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2b39 n ASP 716 N 0.00 0.00 -0.28 1.61 8.00 -1.26 -0.42 116.55 124.20 2b39 n ASP 716 Ca 0.00 0.00 0.07 0.00 0.71 0.00 0.00 54.79 55.57 2b39 n ASP 716 Cb 0.00 0.00 0.22 0.00 -0.02 0.00 0.00 41.12 41.32 2b39 n ASP 716 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2b39 h ALA 717 N 0.00 1.21 0.00 2.24 0.00 -2.01 -1.50 119.26 119.21 2b39 h ALA 717 Ca 0.00 0.10 -0.10 0.00 0.00 0.00 0.00 54.91 54.91 2b39 h ALA 717 Cb 0.00 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 2b39 h ALA 717 CO 0.00 -0.15 -0.47 0.00 0.00 0.00 0.00 179.25 178.63 2b39 h VAL 719 N 0.00 1.55 -0.69 0.00 2.07 -1.26 -1.96 116.25 115.97 2b39 h VAL 719 Ca -0.00 -1.67 0.13 0.00 0.82 0.00 0.00 66.70 65.98 2b39 h VAL 719 Cb 1.02 2.67 -0.09 0.00 -1.52 0.00 0.00 31.29 33.37 2b39 h VAL 719 CO 0.06 0.44 0.24 0.11 0.02 0.00 0.00 177.57 178.44 2b39 h LYS 720 N -0.67 0.37 0.26 1.57 1.79 -1.37 0.47 116.57 119.00 2b39 h LYS 720 Ca -0.00 -0.02 -0.01 0.00 -2.18 0.00 0.00 60.65 58.43 2b39 h LYS 720 Cb 0.73 -0.08 0.00 0.00 -1.58 0.00 0.00 32.23 31.29 2b39 h LYS 720 CO 0.01 0.25 -0.14 0.00 -1.08 0.00 0.00 179.45 178.48 2b39 h ALA 721 N 1.51 -0.37 -0.02 3.86 0.00 -1.55 -0.78 119.26 121.92 2b39 h ALA 721 Ca 0.37 -0.08 0.01 0.00 0.00 0.00 0.00 54.91 55.21 2b39 h ALA 721 Cb 0.55 0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.47 2b39 h ALA 721 CO -0.39 -0.71 -0.22 0.35 0.00 0.00 0.00 179.25 178.28 2b39 h PHE 722 N -0.37 -0.64 -1.02 0.00 3.04 -0.07 -0.68 116.94 117.20 2b39 h PHE 722 Ca -0.03 0.02 0.29 0.00 3.98 0.00 0.00 57.97 62.23 2b39 h PHE 722 Cb 0.29 0.28 -0.14 0.00 2.56 0.00 0.00 35.95 38.95 2b39 h PHE 722 CO -0.07 -0.23 0.60 -0.07 -2.02 0.00 0.00 178.31 176.52 2b39 h LEU 723 N -0.26 0.56 0.00 0.59 -0.00 -0.13 -0.34 115.31 115.73 2b39 h LEU 723 Ca 0.01 0.16 0.00 0.00 -0.00 0.00 0.00 57.88 58.05 2b39 h LEU 723 Cb 0.28 0.09 0.00 0.00 -0.00 0.00 0.00 40.66 41.03 2b39 h LEU 723 CO -0.15 -0.03 0.00 -0.67 -0.00 0.00 0.00 178.44 177.58 2b39 n ASP 724 N -4.95 0.00 -0.22 -0.43 4.64 -0.30 -2.04 116.55 113.25 2b39 n ASP 724 Ca 0.30 0.73 0.31 0.00 -1.38 0.00 0.00 54.79 54.74 2b39 n ASP 724 Cb 0.91 -0.23 0.73 0.00 -1.04 0.00 0.00 41.12 41.49 2b39 n ASP 724 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 2b39 h GLU 727 N 0.00 0.20 -0.00 0.00 4.11 -1.31 -0.85 114.58 116.73 2b39 h GLU 727 Ca 0.00 -0.01 0.00 0.00 0.07 0.00 0.00 59.36 59.42 2b39 h GLU 727 Cb 0.00 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.19 2b39 h GLU 727 CO 0.00 0.13 -0.12 -0.92 0.07 0.00 0.00 179.01 178.17 2b39 h TYR 728 N 0.21 -0.37 0.00 2.06 3.20 -1.48 -0.76 116.97 119.83 2b39 h TYR 728 Ca 0.69 0.01 0.00 0.00 3.14 0.00 0.00 58.73 62.57 2b39 h TYR 728 Cb 2.09 0.16 0.00 0.00 1.54 0.00 0.00 36.73 40.52 2b39 h TYR 728 CO -0.00 -0.13 0.00 -0.84 -1.64 0.00 0.00 178.16 175.54 2b39 h ILE 729 N -0.16 0.00 0.47 1.81 -0.00 -1.26 -0.21 117.51 118.17 2b39 h ILE 729 Ca 0.00 -0.43 -0.02 0.00 -0.00 0.00 0.00 64.86 64.41 2b39 h ILE 729 Cb 0.17 1.33 0.00 0.00 -0.00 0.00 0.00 36.82 38.32 2b39 h ILE 729 CO -0.08 0.00 -0.24 0.74 -0.00 0.00 0.00 178.15 178.57 2b39 h THR 730 N 0.00 0.52 -0.02 0.16 2.02 -0.32 0.44 112.91 115.71 2b39 h THR 730 Ca 0.00 0.00 -0.03 0.00 0.77 0.00 0.00 66.41 67.15 2b39 h THR 730 Cb 0.50 0.52 0.00 0.00 -1.74 0.00 0.00 68.15 67.43 2b39 h THR 730 CO 0.00 0.00 -0.09 0.06 0.37 0.00 0.00 175.52 175.86 2b39 h GLN 731 N -0.65 0.10 -0.95 6.66 3.07 -1.06 -2.25 115.11 120.03 2b39 h GLN 731 Ca -0.06 -0.08 0.28 0.00 0.09 0.00 0.00 58.65 58.87 2b39 h GLN 731 Cb 0.50 0.01 -0.04 0.00 0.08 0.00 0.00 27.48 28.04 2b39 h GLN 731 CO 0.10 0.72 0.82 1.25 0.09 0.00 0.00 178.83 181.81 2b39 h LEU 732 N -0.49 0.00 0.06 0.06 7.12 -0.99 1.14 115.31 122.20 2b39 h LEU 732 Ca -0.00 0.00 -0.29 0.00 0.13 0.00 0.00 57.88 57.72 2b39 h LEU 732 Cb 0.73 0.00 -0.03 0.00 -0.53 0.00 0.00 40.66 40.84 2b39 h LEU 732 CO 0.02 0.00 -1.53 -0.09 -0.13 0.00 0.00 178.44 176.71 2b39 h ARG 733 N 0.00 0.13 0.00 1.25 2.43 0.11 -2.99 114.38 115.31 2b39 h ARG 733 Ca 0.45 -0.22 0.00 0.00 -0.81 0.00 0.00 59.98 59.41 2b39 h ARG 733 Cb 2.09 0.08 0.00 0.00 -0.42 0.00 0.00 29.97 31.72 2b39 h ARG 733 CO -0.00 0.91 0.00 1.96 -1.51 0.00 0.00 179.97 181.32 2b39 h GLN 734 N 0.03 0.00 0.15 0.20 4.20 0.16 -2.52 115.11 117.34 2b39 h GLN 734 Ca -0.23 0.00 -0.33 0.00 0.06 0.00 0.00 58.65 58.15 2b39 h GLN 734 Cb 1.97 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 29.75 2b39 h GLN 734 CO 0.12 0.00 -1.69 0.37 -0.67 0.00 0.00 178.83 176.96 2b39 h GLN 735 N 0.00 0.31 -0.11 1.46 4.15 -0.13 -2.96 115.11 117.82 2b39 h GLN 735 Ca 0.00 -0.53 0.00 0.00 0.77 0.00 0.00 58.65 58.89 2b39 h GLN 735 Cb 0.55 0.20 0.00 0.00 0.21 0.00 0.00 27.48 28.43 2b39 h GLN 735 CO 0.00 1.19 0.00 0.72 -1.93 0.00 0.00 178.83 178.81 2b39 n HIS 736 N -3.50 0.15 -0.05 3.99 8.25 -1.09 -3.06 115.22 119.90 2b39 n HIS 736 Ca -0.22 -0.07 -0.06 0.00 -0.26 0.00 0.00 57.72 57.11 2b39 n HIS 736 Cb 1.06 0.00 -0.06 0.00 1.12 0.00 0.00 29.99 32.11 2b39 n HIS 736 CO 0.00 0.00 0.00 -1.13 0.64 0.00 0.00 176.34 175.85 2b39 n SER 737 N -0.17 2.98 -0.39 0.41 3.41 -0.97 -3.89 113.62 115.01 2b39 n SER 737 Ca 0.11 -0.03 0.08 0.00 -0.26 0.00 0.00 58.87 58.77 2b39 n SER 737 Cb 0.17 0.22 0.33 0.00 -0.26 0.00 0.00 64.21 64.67 2b39 n SER 737 CO 0.00 0.00 0.00 -2.11 -0.16 0.00 0.00 175.04 172.77 2b39 n ARG 738 N -2.61 1.51 -0.19 4.33 1.85 -1.12 -2.58 116.66 117.85 2b39 n ARG 738 Ca -0.18 -0.77 0.06 0.00 -1.00 0.00 0.00 57.85 55.96 2b39 n ARG 738 Cb 0.75 -1.31 0.08 0.00 -1.05 0.00 0.00 32.46 30.93 2b39 n ARG 738 CO 0.00 0.00 0.00 -0.25 -0.01 0.00 0.00 177.63 177.37 2b39 n ASP 739 N 0.03 1.49 -1.31 2.89 8.00 -1.17 -4.74 116.55 121.73 2b39 n ASP 739 Ca 0.13 -2.55 0.09 0.00 0.71 0.00 0.00 54.79 53.17 2b39 n ASP 739 Cb 0.23 -0.30 0.30 0.00 -0.02 0.00 0.00 41.12 41.33 2b39 n ASP 739 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2b39 n GLY 740 N -0.85 2.19 0.00 0.44 0.00 -1.06 -4.10 105.19 101.81 2b39 n GLY 740 Ca 0.09 -0.72 0.00 0.00 0.00 0.00 0.00 46.02 45.39 2b39 n GLY 740 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2b39 n ALA 741 N 1.18 1.90 0.00 4.61 0.00 -1.26 -5.07 120.51 121.87 2b39 n ALA 741 Ca 0.22 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.66 2b39 n ALA 741 Cb 0.67 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.12 2b39 n ALA 741 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2b39 n LEU 742 N -1.33 0.00 0.00 0.00 4.77 -1.26 -5.24 117.00 113.94 2b39 n LEU 742 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 2b39 n LEU 742 Cb 0.00 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.09 2b39 n LEU 742 CO 0.00 0.00 0.00 -0.67 -1.33 0.00 0.00 177.39 175.39 2b39 n ASP 750 N 0.00 0.00 -0.00 -1.43 -0.08 -1.26 -5.19 116.55 108.58 2b39 n ASP 750 Ca 0.00 0.00 0.02 0.00 -1.51 0.00 0.00 54.79 53.30 2b39 n ASP 750 Cb 0.00 -0.72 -0.03 0.00 2.34 0.00 0.00 41.12 42.71 2b39 n ASP 750 CO 0.00 0.00 0.00 -0.67 0.12 0.00 0.00 177.20 176.65 2b39 n ASP 751 N 0.00 1.32 -2.24 1.67 4.64 -1.26 -4.60 116.55 116.09 2b39 n ASP 751 Ca 0.00 -0.42 -0.32 0.00 -1.38 0.00 0.00 54.79 52.67 2b39 n ASP 751 Cb 0.00 1.06 0.07 0.00 -1.04 0.00 0.00 41.12 41.22 2b39 n ASP 751 CO 0.00 0.00 0.00 -0.67 -0.82 0.00 0.00 177.20 175.71 2b39 n ASP 752 N -1.27 6.90 -4.47 1.67 2.03 -1.26 -4.69 116.55 115.46 2b39 n ASP 752 Ca 0.00 -3.78 -0.32 0.00 0.52 0.00 0.00 54.79 51.22 2b39 n ASP 752 Cb 0.08 -0.84 -0.13 0.00 -0.72 0.00 0.00 41.12 39.52 2b39 n ASP 752 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 2b39 s ILE 753 N -4.70 2.97 -0.15 5.18 1.01 -1.26 -4.99 121.20 119.26 2b39 s ILE 753 Ca 0.61 -0.92 -0.09 0.00 0.00 0.00 0.00 60.65 60.26 2b39 s ILE 753 Cb 0.49 -2.20 0.05 0.00 0.01 0.00 0.00 42.46 40.81 2b39 s ILE 753 CO 0.00 0.48 0.37 -0.63 0.00 0.00 0.00 174.94 175.16 2b39 s ILE 754 N -0.82 -0.02 0.00 2.92 1.09 -1.26 -5.06 121.20 118.04 2b39 s ILE 754 Ca 0.13 0.09 0.00 0.00 -1.10 0.00 0.00 60.65 59.77 2b39 s ILE 754 Cb -0.11 -0.55 0.00 0.00 -1.06 0.00 0.00 42.46 40.75 2b39 s ILE 754 CO 0.03 0.04 0.00 -0.81 -0.10 0.00 0.00 174.94 174.10 2b39 n PRO 755 N 4.01 -0.21 -3.44 2.79 -0.04 -1.26 -5.05 135.00 131.81 2b39 n PRO 755 Ca -0.22 0.00 -0.27 0.00 -0.04 0.00 0.00 63.50 62.97 2b39 n PRO 755 Cb 0.55 0.00 -0.11 0.00 -0.04 0.00 0.00 33.50 33.90 2b39 n PRO 755 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 2b39 s GLU 756 N -1.51 0.56 0.00 0.54 2.02 -1.26 -5.08 118.70 113.97 2b39 s GLU 756 Ca 0.00 -1.23 0.00 0.00 0.02 0.00 0.00 54.97 53.76 2b39 s GLU 756 Cb 0.00 -1.18 0.00 0.00 0.10 0.00 0.00 34.13 33.05 2b39 s GLU 756 CO 0.00 -1.21 0.00 0.39 0.02 0.00 0.00 175.26 174.46 2b39 n GLU 757 N 4.08 0.00 -3.07 1.61 1.02 -1.26 -3.12 120.64 119.90 2b39 n GLU 757 Ca 0.12 0.00 -0.42 0.00 -0.02 0.00 0.00 57.16 56.84 2b39 n GLU 757 Cb 0.39 0.00 -0.06 0.00 -0.02 0.00 0.00 31.44 31.74 2b39 n GLU 757 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 2b39 s ASP 758 N 0.00 6.46 -0.13 1.62 1.01 -1.26 -5.04 116.67 119.33 2b39 s ASP 758 Ca 0.00 0.21 -0.02 0.00 0.71 0.00 0.00 52.55 53.45 2b39 s ASP 758 Cb 0.00 -2.34 -0.02 0.00 1.01 0.00 0.00 42.92 41.56 2b39 s ASP 758 CO 0.00 -0.62 -0.07 -0.63 0.21 0.00 0.00 175.17 174.06 2b39 s ILE 759 N 2.80 3.60 -0.11 0.77 1.01 -1.18 -5.11 121.20 122.98 2b39 s ILE 759 Ca 0.26 -0.47 -0.16 0.00 0.00 0.00 0.00 60.65 60.28 2b39 s ILE 759 Cb -0.14 -2.54 -0.05 0.00 0.01 0.00 0.00 42.46 39.74 2b39 s ILE 759 CO 0.15 0.52 0.41 -0.63 0.00 0.00 0.00 174.94 175.40 2b39 s ILE 760 N 0.16 5.19 0.51 2.92 1.01 -1.26 -4.95 121.20 124.78 2b39 s ILE 760 Ca -0.03 0.82 -0.07 0.00 0.00 0.00 0.00 60.65 61.37 2b39 s ILE 760 Cb -0.14 -3.75 0.11 0.00 0.01 0.00 0.00 42.46 38.69 2b39 s ILE 760 CO 0.04 0.39 0.70 -1.54 0.00 0.00 0.00 174.94 174.52 2b39 n SER 761 N 3.33 0.24 -4.73 3.58 3.41 -1.26 -4.88 113.62 113.30 2b39 n SER 761 Ca -0.10 -1.37 -0.42 0.00 -0.26 0.00 0.00 58.87 56.73 2b39 n SER 761 Cb 0.52 -0.52 -0.03 0.00 -0.26 0.00 0.00 64.21 63.92 2b39 n SER 761 CO 0.00 0.00 0.00 -0.60 -0.16 0.00 0.00 175.04 174.28 2b39 s ARG 762 N -4.44 4.31 0.00 4.33 3.52 -1.26 -4.75 118.95 120.65 2b39 s ARG 762 Ca 0.41 2.19 0.00 0.00 -0.13 0.00 0.00 55.73 58.20 2b39 s ARG 762 Cb -0.01 -3.17 0.00 0.00 -1.56 0.00 0.00 34.95 30.21 2b39 s ARG 762 CO 0.28 -0.40 0.14 -1.13 -0.81 0.00 0.00 175.30 173.39 2b39 n SER 763 N 3.00 0.28 -4.39 -2.12 3.41 -1.21 -5.01 113.62 107.59 2b39 n SER 763 Ca 0.09 -0.82 -0.44 0.00 -0.26 0.00 0.00 58.87 57.44 2b39 n SER 763 Cb 0.41 0.08 -0.04 0.00 -0.26 0.00 0.00 64.21 64.40 2b39 n SER 763 CO 0.00 0.00 0.00 -1.58 -0.16 0.00 0.00 175.04 173.30 2b39 s GLN 764 N -0.08 3.05 -0.03 4.33 2.00 -1.10 -4.59 119.66 123.25 2b39 s GLN 764 Ca 0.00 -1.24 0.07 0.00 -2.00 0.00 0.00 55.36 52.19 2b39 s GLN 764 Cb 0.00 -4.26 -0.02 0.00 0.80 0.00 0.00 33.01 29.53 2b39 s GLN 764 CO 0.00 -1.59 -0.24 -0.06 -0.50 0.00 0.00 175.29 172.91 2b39 s PHE 765 N 2.90 2.19 0.41 1.67 0.40 -1.26 -4.99 117.98 119.30 2b39 s PHE 765 Ca 0.13 -0.47 -0.18 0.00 -0.60 0.00 0.00 56.93 55.81 2b39 s PHE 765 Cb -0.23 -1.42 -0.14 0.00 0.51 0.00 0.00 43.02 41.74 2b39 s PHE 765 CO 0.07 -0.08 -0.01 -0.35 0.70 0.00 0.00 175.22 175.55 2b39 n PRO 766 N 2.61 0.00 -2.72 0.24 -0.04 -1.26 -4.82 135.00 129.01 2b39 n PRO 766 Ca -0.16 0.00 -0.40 0.00 -0.04 0.00 0.00 63.50 62.90 2b39 n PRO 766 Cb 0.52 -0.92 -0.06 0.00 -0.04 0.00 0.00 33.50 33.00 2b39 n PRO 766 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 2b39 s GLU 767 N -0.92 4.82 0.25 0.54 2.02 -1.26 -4.59 118.70 119.56 2b39 s GLU 767 Ca 0.54 1.52 -0.30 0.00 0.02 0.00 0.00 54.97 56.74 2b39 s GLU 767 Cb -0.53 -3.28 -0.10 0.00 0.10 0.00 0.00 34.13 30.32 2b39 s GLU 767 CO 0.59 0.45 1.43 -1.12 0.02 0.00 0.00 175.26 176.63 2b39 s SER 768 N -1.00 6.66 0.00 -0.19 0.01 -1.26 -4.95 113.70 112.98 2b39 s SER 768 Ca 0.42 2.67 0.00 0.00 1.31 0.00 0.00 55.95 60.35 2b39 s SER 768 Cb -0.26 -2.63 0.00 0.00 0.21 0.00 0.00 66.02 63.34 2b39 s SER 768 CO 0.33 -0.69 0.00 -2.67 0.41 0.00 0.00 173.24 170.62 2b39 n TRP 769 N 2.20 0.00 -1.43 2.43 4.27 -1.09 -4.82 117.44 119.01 2b39 n TRP 769 Ca 0.06 0.00 -0.14 0.00 -3.89 0.00 0.00 57.50 53.53 2b39 n TRP 769 Cb 0.40 0.00 -0.06 0.00 -1.36 0.00 0.00 31.31 30.30 2b39 n TRP 769 CO 0.00 0.00 0.00 -0.11 -2.29 0.00 0.00 177.69 175.29 2b39 n LEU 770 N 0.00 -1.04 -4.55 5.67 7.94 -1.26 0.05 117.00 123.81 2b39 n LEU 770 Ca 0.00 0.34 -0.37 0.00 -1.11 0.00 0.00 56.01 54.87 2b39 n LEU 770 Cb 0.00 -2.09 -0.03 0.00 0.53 0.00 0.00 43.42 41.83 2b39 n LEU 770 CO 0.00 -0.72 1.45 0.86 -1.11 0.00 0.00 177.39 177.88 2b39 s TRP 771 N -2.52 1.89 0.05 1.96 -0.11 -1.26 -3.96 118.94 114.99 2b39 s TRP 771 Ca 0.00 0.45 -0.21 0.00 1.22 0.00 0.00 56.10 57.55 2b39 s TRP 771 Cb 0.00 -4.24 0.05 0.00 -1.50 0.00 0.00 33.47 27.78 2b39 s TRP 771 CO 0.00 -2.12 0.50 -0.08 -4.62 0.00 0.00 176.95 170.63 2b39 s THR 772 N 8.25 0.03 -0.25 5.86 -1.32 -1.18 -5.03 115.64 122.00 2b39 s THR 772 Ca 0.59 -0.28 -0.01 0.00 -1.21 0.00 0.00 61.69 60.78 2b39 s THR 772 Cb -0.09 -0.98 0.03 0.00 -1.51 0.00 0.00 72.50 69.95 2b39 s THR 772 CO 0.13 -0.15 -0.07 -0.69 -2.21 0.00 0.00 174.62 171.62 2b39 s VAL 773 N -2.54 2.73 -0.09 5.08 1.01 -1.26 -1.74 120.40 123.58 2b39 s VAL 773 Ca -0.05 -1.15 -0.30 0.00 0.00 0.00 0.00 61.98 60.49 2b39 s VAL 773 Cb -0.01 -2.42 -0.04 0.00 0.00 0.00 0.00 36.38 33.92 2b39 s VAL 773 CO -0.03 0.16 1.42 -0.63 0.00 0.00 0.00 175.10 176.03 2b39 s ILE 774 N 1.28 3.94 0.00 2.22 1.01 -0.86 -4.86 121.20 123.93 2b39 s ILE 774 Ca -0.01 1.17 0.00 0.00 0.00 0.00 0.00 60.65 61.81 2b39 s ILE 774 Cb -0.17 -3.75 0.00 0.00 0.01 0.00 0.00 42.46 38.54 2b39 s ILE 774 CO -0.05 -0.08 0.00 -0.62 0.00 0.00 0.00 174.94 174.19 2b39 n GLU 775 N 6.55 0.00 -2.06 2.79 -0.58 -1.26 -2.85 120.64 123.22 2b39 n GLU 775 Ca 0.15 0.00 -0.42 0.00 -0.42 0.00 0.00 57.16 56.47 2b39 n GLU 775 Cb 0.44 -0.13 -0.03 0.00 -0.57 0.00 0.00 31.44 31.15 2b39 n GLU 775 CO 0.00 0.00 0.00 0.34 -0.48 0.00 0.00 177.13 176.99 2b39 s ASP 776 N -1.00 6.72 -0.27 1.62 2.15 -1.26 -4.66 116.67 119.97 2b39 s ASP 776 Ca 0.00 2.34 0.21 0.00 0.43 0.00 0.00 52.55 55.53 2b39 s ASP 776 Cb 0.00 -2.57 0.49 0.00 -0.30 0.00 0.00 42.92 40.54 2b39 s ASP 776 CO 0.00 -0.80 1.20 0.18 -0.17 0.00 0.00 175.17 175.58 2b39 n LEU 777 N 5.26 0.96 0.00 -1.34 4.77 -1.26 -5.06 117.00 120.33 2b39 n LEU 777 Ca 0.14 -3.04 0.00 0.00 -0.03 0.00 0.00 56.01 53.08 2b39 n LEU 777 Cb 0.42 0.40 0.00 0.00 -2.33 0.00 0.00 43.42 41.90 2b39 n LEU 777 CO 0.61 1.16 0.00 2.29 -1.33 0.00 0.00 177.39 180.11 2b39 n LYS 778 N -0.77 -0.03 -3.05 3.23 2.85 -1.26 -3.53 118.16 115.60 2b39 n LYS 778 Ca 0.02 0.00 -0.10 0.00 -1.05 0.00 0.00 58.31 57.18 2b39 n LYS 778 Cb 0.82 0.00 0.01 0.00 -0.65 0.00 0.00 35.03 35.21 2b39 n LYS 778 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 177.40 178.39 2b39 n GLN 779 N -0.89 -1.96 -0.40 -1.58 1.13 -1.26 -4.87 117.38 107.55 2b39 n GLN 779 Ca 0.00 1.77 -0.19 0.00 -1.94 0.00 0.00 57.00 56.64 2b39 n GLN 779 Cb 0.00 -5.06 0.18 0.00 0.11 0.00 0.00 30.24 25.47 2b39 n GLN 779 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2b39 n ALA 780 N -0.88 -3.25 0.22 -1.58 0.00 -1.26 -4.63 120.51 109.13 2b39 n ALA 780 Ca 0.03 -0.95 0.12 0.00 0.00 0.00 0.00 53.44 52.64 2b39 n ALA 780 Cb 0.51 -0.08 0.25 0.00 0.00 0.00 0.00 19.45 20.13 2b39 n ALA 780 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2b39 n ASP 781 N -2.61 3.48 0.00 0.00 2.03 -1.12 -4.75 116.55 113.57 2b39 n ASP 781 Ca 0.08 -1.98 0.00 0.00 0.52 0.00 0.00 54.79 53.41 2b39 n ASP 781 Cb 0.37 -0.30 0.00 0.00 -0.72 0.00 0.00 41.12 40.47 2b39 n ASP 781 CO 0.00 0.00 0.00 1.17 -1.92 0.00 0.00 177.20 176.45 2b39 n LYS 782 N 1.47 -1.25 0.00 -0.67 4.81 -1.26 -4.17 118.16 117.09 2b39 n LYS 782 Ca 0.20 0.29 0.00 0.00 -0.87 0.00 0.00 58.31 57.93 2b39 n LYS 782 Cb 0.60 -4.58 0.00 0.00 0.02 0.00 0.00 35.03 31.07 2b39 n LYS 782 CO 0.00 0.00 0.00 -1.71 1.17 0.00 0.00 177.40 176.86 2b39 n ASN 783 N -0.42 0.02 0.00 3.14 2.85 -1.26 -5.09 115.26 114.50 2b39 n ASN 783 Ca 0.00 -0.52 0.00 0.00 -0.11 0.00 0.00 54.58 53.95 2b39 n ASN 783 Cb 0.29 0.01 0.00 0.00 1.24 0.00 0.00 39.78 41.32 2b39 n ASN 783 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 2b39 n GLY 784 N 0.01 2.43 3.28 8.20 0.00 -1.26 -5.05 105.19 112.81 2b39 n GLY 784 Ca 0.00 -0.74 -0.07 0.00 0.00 0.00 0.00 46.02 45.21 2b39 n GLY 784 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2b39 n ILE 785 N 0.00 0.00 -1.66 -0.61 5.41 -1.26 -2.80 119.36 118.43 2b39 n ILE 785 Ca 0.00 -0.28 -0.42 0.00 1.00 0.00 0.00 62.75 63.05 2b39 n ILE 785 Cb 0.00 -0.92 -0.01 0.00 -0.71 0.00 0.00 39.64 38.00 2b39 n ILE 785 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 176.55 175.01 2b39 n SER 786 N 11.68 3.66 -4.09 4.38 3.41 -0.91 -4.42 113.62 127.33 2b39 n SER 786 Ca 0.20 -2.81 -0.29 0.00 -0.26 0.00 0.00 58.87 55.71 2b39 n SER 786 Cb 0.48 -1.56 0.22 0.00 -0.26 0.00 0.00 64.21 63.09 2b39 n SER 786 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 2b39 n THR 787 N 5.34 0.00 -3.61 6.66 -2.24 -1.26 -4.43 114.28 114.74 2b39 n THR 787 Ca 0.51 -0.29 -0.16 0.00 -2.27 0.00 0.00 64.05 61.84 2b39 n THR 787 Cb 0.40 -0.78 -0.07 0.00 -2.10 0.00 0.00 70.33 67.78 2b39 n THR 787 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 2b39 s LYS 788 N -4.00 0.91 0.07 -0.78 2.47 -0.49 -4.94 119.74 112.98 2b39 s LYS 788 Ca 0.59 0.11 0.05 0.00 -1.56 0.00 0.00 55.97 55.16 2b39 s LYS 788 Cb -0.16 0.42 -0.04 0.00 -1.46 0.00 0.00 37.83 36.60 2b39 s LYS 788 CO 0.60 -0.27 -0.03 -0.51 0.16 0.00 0.00 175.35 175.30 2b39 s LEU 789 N -1.21 3.34 -0.12 5.43 1.43 -1.26 0.15 118.68 126.44 2b39 s LEU 789 Ca -0.12 -0.19 -0.05 0.00 -1.03 0.00 0.00 54.13 52.74 2b39 s LEU 789 Cb -0.02 -2.04 0.05 0.00 0.03 0.00 0.00 46.19 44.22 2b39 s LEU 789 CO 0.08 0.21 0.27 -0.32 0.23 0.00 0.00 176.35 176.81 2b39 s MET 790 N -2.04 0.21 -0.20 1.70 1.75 0.51 -4.93 119.30 116.30 2b39 s MET 790 Ca 0.23 0.62 -0.12 0.00 -1.25 0.00 0.00 55.69 55.17 2b39 s MET 790 Cb -0.11 -0.08 -0.05 0.00 2.84 0.00 0.00 34.83 37.43 2b39 s MET 790 CO 0.15 -0.20 0.23 -0.80 -0.65 0.00 0.00 175.02 173.75 2b39 s ASN 791 N 1.62 6.29 0.02 1.11 -0.87 -1.26 0.34 114.94 122.19 2b39 s ASN 791 Ca -0.06 0.33 0.03 0.00 -1.57 0.00 0.00 52.86 51.58 2b39 s ASN 791 Cb -0.11 -2.14 -0.02 0.00 -0.02 0.00 0.00 41.25 38.96 2b39 s ASN 791 CO -0.09 0.09 -0.08 -0.69 -2.57 0.00 0.00 177.10 173.75 2b39 s VAL 792 N 0.71 0.64 -0.27 1.60 1.01 0.45 -4.94 120.40 119.59 2b39 s VAL 792 Ca 0.12 -0.74 -0.16 0.00 0.00 0.00 0.00 61.98 61.21 2b39 s VAL 792 Cb -0.13 -0.61 -0.03 0.00 0.00 0.00 0.00 36.38 35.61 2b39 s VAL 792 CO 0.03 -0.10 0.42 -0.36 0.00 0.00 0.00 175.10 175.09 2b39 s PHE 793 N -0.78 3.25 0.39 5.22 0.08 -1.26 -0.56 117.98 124.32 2b39 s PHE 793 Ca -0.03 0.45 -0.27 0.00 0.12 0.00 0.00 56.93 57.20 2b39 s PHE 793 Cb -0.06 -2.63 -0.10 0.00 -0.57 0.00 0.00 43.02 39.65 2b39 s PHE 793 CO 0.00 -0.26 1.44 1.28 -0.10 0.00 0.00 175.22 177.58 2b39 n LEU 794 N 5.41 4.67 -4.69 -0.37 4.77 -0.00 -4.94 117.00 121.85 2b39 n LEU 794 Ca -0.07 1.19 -0.42 0.00 -0.03 0.00 0.00 56.01 56.68 2b39 n LEU 794 Cb 0.50 -1.59 -0.03 0.00 -2.33 0.00 0.00 43.42 39.97 2b39 n LEU 794 CO 0.38 -0.04 0.99 -0.54 -1.33 0.00 0.00 177.39 176.85 2b39 s LYS 795 N -2.17 4.34 -1.30 3.23 -0.14 -1.26 -2.41 119.74 120.04 2b39 s LYS 795 Ca 0.56 1.76 -0.18 0.00 -1.36 0.00 0.00 55.97 56.75 2b39 s LYS 795 Cb -0.48 -3.54 0.05 0.00 -1.68 0.00 0.00 37.83 32.18 2b39 s LYS 795 CO 0.62 -0.46 1.79 -0.40 -0.76 0.00 0.00 175.35 176.13 2b39 n ASP 796 N 5.13 4.70 -3.67 2.83 5.75 -1.26 -4.24 116.55 125.79 2b39 n ASP 796 Ca 0.11 -2.89 -0.09 0.00 -0.01 0.00 0.00 54.79 51.91 2b39 n ASP 796 Cb 0.45 -1.74 -0.09 0.00 -1.03 0.00 0.00 41.12 38.71 2b39 n ASP 796 CO 0.00 0.00 0.00 -0.94 -0.11 0.00 0.00 177.20 176.15 2b39 s SER 797 N 4.36 -0.51 0.00 -1.12 1.04 -1.26 -4.80 113.70 111.42 2b39 s SER 797 Ca 0.55 1.05 -0.14 0.00 0.48 0.00 0.00 55.95 57.90 2b39 s SER 797 Cb 0.04 1.18 -0.17 0.00 0.10 0.00 0.00 66.02 67.18 2b39 s SER 797 CO 0.08 -0.22 1.00 2.30 0.98 0.00 0.00 173.24 177.38 2b39 n ILE 798 N 4.81 0.00 -4.13 -1.02 -6.64 -1.26 -4.83 119.36 106.28 2b39 n ILE 798 Ca -0.16 -0.15 -0.10 0.00 -1.77 0.00 0.00 62.75 60.57 2b39 n ILE 798 Cb 0.53 -1.11 -0.10 0.00 -1.44 0.00 0.00 39.64 37.52 2b39 n ILE 798 CO 0.00 0.00 0.00 0.28 -1.77 0.00 0.00 176.55 175.06 2b39 s THR 799 N 4.85 0.51 -0.35 7.28 -1.32 -1.21 -4.98 115.64 120.43 2b39 s THR 799 Ca 0.30 -1.81 -0.19 0.00 -1.21 0.00 0.00 61.69 58.78 2b39 s THR 799 Cb 0.07 -1.52 -0.00 0.00 -1.51 0.00 0.00 72.50 69.53 2b39 s THR 799 CO 0.15 -0.87 0.57 -0.89 -2.21 0.00 0.00 174.62 171.36 2b39 s THR 800 N -3.52 4.96 0.87 5.08 2.01 -1.26 -2.30 115.64 121.49 2b39 s THR 800 Ca 0.08 0.47 -0.14 0.00 0.31 0.00 0.00 61.69 62.42 2b39 s THR 800 Cb 0.05 -4.01 0.13 0.00 0.01 0.00 0.00 72.50 68.68 2b39 s THR 800 CO -0.06 -0.24 1.23 0.26 -0.69 0.00 0.00 174.62 175.12 2b39 s TRP 801 N 2.52 2.42 -0.31 4.92 0.52 -0.44 -0.68 118.94 127.90 2b39 s TRP 801 Ca 0.21 0.59 0.04 0.00 0.02 0.00 0.00 56.10 56.96 2b39 s TRP 801 Cb -0.15 -3.73 0.17 0.00 -1.15 0.00 0.00 33.47 28.61 2b39 s TRP 801 CO 0.14 -2.13 0.48 -1.21 0.02 0.00 0.00 176.95 174.25 2b39 s GLU 802 N -5.69 0.51 -0.16 4.98 2.02 -0.02 -2.36 118.70 117.98 2b39 s GLU 802 Ca 0.67 0.16 -0.29 0.00 0.02 0.00 0.00 54.97 55.52 2b39 s GLU 802 Cb -0.08 -0.12 -0.00 0.00 0.10 0.00 0.00 34.13 34.02 2b39 s GLU 802 CO 0.51 -1.07 1.03 0.42 0.02 0.00 0.00 175.26 176.17 2b39 s ILE 803 N 2.49 4.73 -0.16 -1.63 1.09 -1.02 -2.24 121.20 124.45 2b39 s ILE 803 Ca 0.11 2.03 -0.01 0.00 -1.10 0.00 0.00 60.65 61.68 2b39 s ILE 803 Cb -0.11 -4.31 -0.01 0.00 -1.06 0.00 0.00 42.46 36.98 2b39 s ILE 803 CO -0.25 -0.08 -0.12 -0.76 -0.10 0.00 0.00 174.94 173.63 2b39 s LEU 804 N 2.57 2.64 0.24 2.97 1.02 -0.37 -0.95 118.68 126.79 2b39 s LEU 804 Ca 0.46 -0.41 0.08 0.00 0.02 0.00 0.00 54.13 54.29 2b39 s LEU 804 Cb -0.17 -1.61 -0.04 0.00 0.02 0.00 0.00 46.19 44.39 2b39 s LEU 804 CO 0.13 0.09 0.09 0.00 0.02 0.00 0.00 176.35 176.68 2b39 s ALA 805 N 0.80 3.38 -0.30 4.21 0.00 -1.25 -2.00 121.76 126.60 2b39 s ALA 805 Ca -0.04 -1.48 0.01 0.00 0.00 0.00 0.00 51.96 50.44 2b39 s ALA 805 Cb -0.15 -1.08 0.19 0.00 0.00 0.00 0.00 23.12 22.08 2b39 s ALA 805 CO 0.01 0.31 0.59 0.08 0.00 0.00 0.00 175.76 176.75 2b39 s VAL 806 N -2.11 -0.99 -0.06 0.00 1.01 0.17 -1.66 120.40 116.77 2b39 s VAL 806 Ca 0.31 -0.00 0.06 0.00 0.00 0.00 0.00 61.98 62.35 2b39 s VAL 806 Cb -0.08 -0.99 -0.01 0.00 0.00 0.00 0.00 36.38 35.30 2b39 s VAL 806 CO 0.22 -0.01 -0.24 -0.55 0.00 0.00 0.00 175.10 174.52 2b39 s SER 807 N 2.84 3.02 -0.27 3.32 0.15 -0.97 0.24 113.70 122.03 2b39 s SER 807 Ca 0.18 -0.51 -0.10 0.00 0.70 0.00 0.00 55.95 56.23 2b39 s SER 807 Cb -0.14 -0.91 -0.04 0.00 -1.71 0.00 0.00 66.02 63.22 2b39 s SER 807 CO -0.22 0.23 0.14 -0.22 1.20 0.00 0.00 173.24 174.37 2b39 s LEU 808 N -0.08 3.80 0.21 3.45 0.20 -0.42 -0.66 118.68 125.18 2b39 s LEU 808 Ca -0.06 -0.08 0.05 0.00 0.69 0.00 0.00 54.13 54.73 2b39 s LEU 808 Cb -0.14 -2.04 -0.03 0.00 -0.43 0.00 0.00 46.19 43.54 2b39 s LEU 808 CO 0.04 -0.04 0.24 -0.55 -0.29 0.00 0.00 176.35 175.75 2b39 s SER 809 N 1.69 5.85 -0.07 3.68 0.15 0.18 -1.86 113.70 123.31 2b39 s SER 809 Ca 0.07 -0.08 -0.30 0.00 0.70 0.00 0.00 55.95 56.34 2b39 s SER 809 Cb -0.16 -1.61 -0.02 0.00 -1.71 0.00 0.00 66.02 62.53 2b39 s SER 809 CO 0.08 -0.01 1.03 -0.62 1.20 0.00 0.00 173.24 174.93 2b39 s ASP 810 N -3.63 7.24 -1.12 5.45 -1.08 -1.26 -3.05 116.67 119.22 2b39 s ASP 810 Ca 0.33 1.61 -0.21 0.00 -0.52 0.00 0.00 52.55 53.76 2b39 s ASP 810 Cb -0.09 -2.56 -0.00 0.00 -1.46 0.00 0.00 42.92 38.81 2b39 s ASP 810 CO 0.26 -0.43 0.77 0.29 0.52 0.00 0.00 175.17 176.58 2b39 n LYS 811 N 4.80 -1.12 0.00 4.34 5.02 -1.26 -4.72 118.16 125.22 2b39 n LYS 811 Ca 0.09 0.46 0.00 0.00 -2.02 0.00 0.00 58.31 56.84 2b39 n LYS 811 Cb 0.49 -3.91 0.00 0.00 -0.02 0.00 0.00 35.03 31.59 2b39 n LYS 811 CO 0.00 0.00 0.00 1.17 -0.52 0.00 0.00 177.40 178.05 2b39 n LYS 812 N -4.12 0.00 0.00 1.97 0.00 -1.24 -5.14 118.16 109.62 2b39 n LYS 812 Ca -0.10 0.00 0.00 0.00 0.00 0.00 0.00 58.31 58.21 2b39 n LYS 812 Cb 0.59 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.62 2b39 n LYS 812 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2b39 n GLY 813 N -0.20 -1.44 3.49 3.14 0.00 -1.17 -4.62 105.19 104.39 2b39 n GLY 813 Ca 0.00 -2.14 -0.34 0.00 0.00 0.00 0.00 46.02 43.54 2b39 n GLY 813 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2b39 s ILE 814 N -0.18 3.80 -0.12 -0.61 1.01 -1.26 0.49 121.20 124.33 2b39 s ILE 814 Ca 0.00 -0.40 0.00 0.00 0.00 0.00 0.00 60.65 60.26 2b39 s ILE 814 Cb 0.00 -2.65 0.02 0.00 0.01 0.00 0.00 42.46 39.84 2b39 s ILE 814 CO 0.00 0.51 -0.12 0.00 0.00 0.00 0.00 174.94 175.33 2b39 s VAL 816 N 1.46 3.73 0.00 0.00 1.01 -1.26 -2.29 120.40 123.05 2b39 s VAL 816 Ca 0.02 0.46 0.00 0.00 0.00 0.00 0.00 61.98 62.46 2b39 s VAL 816 Cb -0.13 -4.82 0.00 0.00 0.00 0.00 0.00 36.38 31.43 2b39 s VAL 816 CO -0.08 -1.72 0.00 0.00 0.00 0.00 0.00 175.10 173.30 2b39 n ALA 817 N 9.50 0.00 -2.44 5.51 0.00 -0.67 -4.59 120.51 127.83 2b39 n ALA 817 Ca 0.05 0.00 -0.23 0.00 0.00 0.00 0.00 53.44 53.26 2b39 n ALA 817 Cb 0.49 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.84 2b39 n ALA 817 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2b39 s ASP 818 N -1.86 3.24 -0.19 0.00 -1.08 -1.26 -4.87 116.67 110.65 2b39 s ASP 818 Ca 0.00 -0.97 -0.28 0.00 -0.52 0.00 0.00 52.55 50.78 2b39 s ASP 818 Cb 0.00 -0.24 -0.05 0.00 -1.46 0.00 0.00 42.92 41.17 2b39 s ASP 818 CO 0.00 0.01 2.12 -2.84 0.52 0.00 0.00 175.17 174.97 2b39 s PRO 819 N -3.24 3.33 -0.88 4.34 0.02 -1.26 -4.54 135.00 132.78 2b39 s PRO 819 Ca 0.24 2.05 -0.17 0.00 0.02 0.00 0.00 61.00 63.14 2b39 s PRO 819 Cb -0.05 -4.31 0.17 0.00 0.02 0.00 0.00 34.50 30.33 2b39 s PRO 819 CO 0.11 -1.87 0.96 -0.47 -0.33 0.00 0.00 177.00 175.40 2b39 s TYR 820 N 7.45 3.39 0.60 6.54 5.04 -0.12 -4.95 117.35 135.30 2b39 s TYR 820 Ca 0.95 -1.64 -0.19 0.00 -2.44 0.00 0.00 57.07 53.76 2b39 s TYR 820 Cb -0.33 -4.08 -0.03 0.00 0.35 0.00 0.00 41.96 37.87 2b39 s TYR 820 CO 0.36 -1.27 1.28 -2.00 -1.34 0.00 0.00 175.55 172.58 2b39 s GLU 821 N 1.60 2.87 -0.42 4.97 2.12 -1.26 -2.44 118.70 126.14 2b39 s GLU 821 Ca 0.26 2.03 0.06 0.00 0.36 0.00 0.00 54.97 57.67 2b39 s GLU 821 Cb -0.08 -2.00 0.17 0.00 0.26 0.00 0.00 34.13 32.49 2b39 s GLU 821 CO -0.09 -1.34 0.55 0.08 -0.54 0.00 0.00 175.26 173.92 2b39 s VAL 822 N -1.43 -0.67 -0.09 3.70 1.01 -0.99 -4.95 120.40 116.97 2b39 s VAL 822 Ca 0.78 -0.77 -0.30 0.00 0.00 0.00 0.00 61.98 61.69 2b39 s VAL 822 Cb -0.36 -0.32 -0.02 0.00 0.00 0.00 0.00 36.38 35.68 2b39 s VAL 822 CO 0.39 -0.30 1.05 0.42 0.00 0.00 0.00 175.10 176.67 2b39 s THR 823 N 1.34 4.66 -0.28 3.92 -4.23 -1.26 -1.33 115.64 118.46 2b39 s THR 823 Ca 0.21 1.94 -0.10 0.00 -1.18 0.00 0.00 61.69 62.56 2b39 s THR 823 Cb -0.06 -4.25 -0.03 0.00 1.34 0.00 0.00 72.50 69.50 2b39 s THR 823 CO -0.06 0.01 0.15 -0.69 -0.54 0.00 0.00 174.62 173.48 2b39 s VAL 824 N 2.03 4.85 0.38 2.29 1.01 -0.97 -3.20 120.40 126.80 2b39 s VAL 824 Ca 0.50 -0.07 0.05 0.00 0.00 0.00 0.00 61.98 62.46 2b39 s VAL 824 Cb -0.20 -3.34 -0.03 0.00 0.00 0.00 0.00 36.38 32.82 2b39 s VAL 824 CO 0.19 0.23 0.17 -0.32 0.00 0.00 0.00 175.10 175.38 2b39 s MET 825 N 1.68 1.85 -0.29 2.72 0.00 -0.42 -3.29 119.30 121.56 2b39 s MET 825 Ca 0.06 -2.11 -0.16 0.00 0.00 0.00 0.00 55.69 53.49 2b39 s MET 825 Cb -0.16 -0.30 0.12 0.00 0.00 0.00 0.00 34.83 34.49 2b39 s MET 825 CO 0.08 -0.53 0.85 -1.14 0.00 0.00 0.00 175.02 174.28 2b39 s GLN 826 N -3.65 0.51 0.02 4.11 0.74 -1.26 -4.26 119.66 115.88 2b39 s GLN 826 Ca 0.29 0.93 0.25 0.00 0.05 0.00 0.00 55.36 56.89 2b39 s GLN 826 Cb 0.03 0.17 0.59 0.00 1.10 0.00 0.00 33.01 34.90 2b39 s GLN 826 CO 0.18 -0.12 1.48 -0.25 -0.55 0.00 0.00 175.29 176.04 2b39 n ASP 827 N 4.11 0.46 -3.83 6.67 8.00 -1.26 -4.77 116.55 125.93 2b39 n ASP 827 Ca -0.18 -0.06 -0.27 0.00 0.71 0.00 0.00 54.79 54.99 2b39 n ASP 827 Cb 0.57 0.11 -0.17 0.00 -0.02 0.00 0.00 41.12 41.62 2b39 n ASP 827 CO 0.00 0.00 0.00 0.12 -0.39 0.00 0.00 177.20 176.93 2b39 s PHE 828 N -3.03 1.32 0.21 1.24 5.36 -1.26 -1.88 117.98 119.94 2b39 s PHE 828 Ca 0.11 -0.83 0.11 0.00 -0.96 0.00 0.00 56.93 55.35 2b39 s PHE 828 Cb 0.17 -1.13 -0.04 0.00 -0.34 0.00 0.00 43.02 41.67 2b39 s PHE 828 CO 0.68 -0.55 -0.19 -0.06 -1.46 0.00 0.00 175.22 173.63 2b39 s PHE 829 N 1.76 2.39 -0.23 10.12 0.08 -0.71 -4.97 117.98 126.42 2b39 s PHE 829 Ca 0.01 -0.32 -0.03 0.00 0.12 0.00 0.00 56.93 56.71 2b39 s PHE 829 Cb -0.15 -1.15 0.10 0.00 -0.57 0.00 0.00 43.02 41.25 2b39 s PHE 829 CO -0.07 0.55 0.20 -1.50 -0.10 0.00 0.00 175.22 174.29 2b39 s ILE 830 N -1.85 -0.26 -0.10 0.64 2.07 -1.26 -0.91 121.20 119.54 2b39 s ILE 830 Ca 0.24 -0.33 -0.02 0.00 -1.41 0.00 0.00 60.65 59.12 2b39 s ILE 830 Cb -0.08 -0.79 -0.03 0.00 0.13 0.00 0.00 42.46 41.69 2b39 s ILE 830 CO 0.12 -0.38 -0.00 -0.62 -1.91 0.00 0.00 174.94 172.15 2b39 s ASP 831 N 2.26 5.17 -0.20 4.50 2.15 0.14 -4.52 116.67 126.19 2b39 s ASP 831 Ca 0.07 0.10 -0.06 0.00 0.43 0.00 0.00 52.55 53.09 2b39 s ASP 831 Cb -0.15 -1.52 -0.03 0.00 -0.30 0.00 0.00 42.92 40.92 2b39 s ASP 831 CO -0.21 0.34 0.03 -0.22 -0.17 0.00 0.00 175.17 174.94 2b39 s LEU 832 N -0.67 3.46 -0.24 -1.34 2.96 -1.26 0.15 118.68 121.74 2b39 s LEU 832 Ca 0.11 -0.10 -0.08 0.00 -0.22 0.00 0.00 54.13 53.84 2b39 s LEU 832 Cb -0.12 -1.88 -0.03 0.00 0.50 0.00 0.00 46.19 44.66 2b39 s LEU 832 CO 0.02 0.10 0.08 -0.13 -1.32 0.00 0.00 176.35 175.10 2b39 s ARG 833 N 0.82 3.74 0.09 1.98 1.81 -0.29 -4.99 118.95 122.10 2b39 s ARG 833 Ca 0.02 -0.44 0.08 0.00 -1.72 0.00 0.00 55.73 53.66 2b39 s ARG 833 Cb -0.14 -3.34 -0.03 0.00 -0.45 0.00 0.00 34.95 30.99 2b39 s ARG 833 CO 0.02 -0.11 -0.20 -0.51 -0.68 0.00 0.00 175.30 173.82 2b39 s LEU 834 N 1.43 2.27 0.26 2.53 1.43 -1.26 -2.74 118.68 122.61 2b39 s LEU 834 Ca 0.06 -0.65 -0.30 0.00 -1.03 0.00 0.00 54.13 52.21 2b39 s LEU 834 Cb -0.15 -0.85 -0.09 0.00 0.03 0.00 0.00 46.19 45.13 2b39 s LEU 834 CO 0.04 0.06 1.12 -2.16 0.23 0.00 0.00 176.35 175.64 2b39 s PRO 835 N -1.76 4.60 0.31 1.29 0.04 -1.26 -4.90 135.00 133.32 2b39 s PRO 835 Ca 0.05 1.83 0.18 0.00 0.04 0.00 0.00 61.00 63.10 2b39 s PRO 835 Cb -0.10 -3.20 1.11 0.00 0.04 0.00 0.00 34.50 32.36 2b39 s PRO 835 CO 0.04 0.14 1.29 0.98 0.04 0.00 0.00 177.00 179.49 2b39 n TYR 836 N 1.45 0.94 -4.00 0.56 9.36 -1.26 -4.61 117.16 119.60 2b39 n TYR 836 Ca -0.00 0.95 -0.10 0.00 3.32 0.00 0.00 57.90 62.07 2b39 n TYR 836 Cb 0.45 -1.37 -0.05 0.00 -0.63 0.00 0.00 39.34 37.74 2b39 n TYR 836 CO 0.00 0.00 0.00 0.45 0.22 0.00 0.00 176.86 177.53 2b39 s SER 837 N -4.59 0.03 -0.17 2.98 0.15 -1.26 -4.55 113.70 106.29 2b39 s SER 837 Ca -0.07 -1.01 -0.18 0.00 0.70 0.00 0.00 55.95 55.39 2b39 s SER 837 Cb 0.28 0.61 0.05 0.00 -1.71 0.00 0.00 66.02 65.25 2b39 s SER 837 CO 0.64 -1.19 0.50 -0.69 1.20 0.00 0.00 173.24 173.70 2b39 s VAL 838 N -3.80 0.00 -0.25 4.45 1.01 0.92 -4.69 120.40 118.04 2b39 s VAL 838 Ca 0.23 -0.04 -0.10 0.00 0.00 0.00 0.00 61.98 62.07 2b39 s VAL 838 Cb -0.01 -0.71 -0.05 0.00 0.00 0.00 0.00 36.38 35.61 2b39 s VAL 838 CO 0.11 -0.02 0.16 0.54 0.00 0.00 0.00 175.10 175.88 2b39 s VAL 839 N 0.04 5.25 0.29 2.92 0.11 -1.25 0.44 120.40 128.20 2b39 s VAL 839 Ca -0.02 0.15 -0.18 0.00 -2.93 0.00 0.00 61.98 59.00 2b39 s VAL 839 Cb -0.03 -3.47 -0.13 0.00 -1.53 0.00 0.00 36.38 31.22 2b39 s VAL 839 CO 0.02 0.32 0.14 -2.11 -3.33 0.00 0.00 175.10 170.13 2b39 n ARG 840 N 4.57 0.00 -3.20 1.54 1.85 -0.78 -2.91 116.66 117.73 2b39 n ARG 840 Ca -0.15 0.00 -0.15 0.00 -1.00 0.00 0.00 57.85 56.55 2b39 n ARG 840 Cb 0.52 -0.79 0.06 0.00 -1.05 0.00 0.00 32.46 31.20 2b39 n ARG 840 CO 0.00 0.00 0.00 0.09 -0.01 0.00 0.00 177.63 177.71 2b39 n ASN 841 N 1.80 -3.61 -3.76 2.89 3.02 -0.59 -4.80 115.26 110.20 2b39 n ASN 841 Ca 0.10 -0.44 -0.14 0.00 -0.03 0.00 0.00 54.58 54.07 2b39 n ASN 841 Cb 0.29 -3.96 -0.15 0.00 -0.61 0.00 0.00 39.78 35.36 2b39 n ASN 841 CO 0.00 0.00 0.00 -0.70 -2.62 0.00 0.00 177.26 173.94 2b39 s GLU 842 N -5.49 0.08 -0.12 3.52 2.12 -1.15 -4.87 118.70 112.79 2b39 s GLU 842 Ca 0.21 0.33 -0.23 0.00 0.36 0.00 0.00 54.97 55.64 2b39 s GLU 842 Cb -0.09 -0.17 -0.03 0.00 0.26 0.00 0.00 34.13 34.09 2b39 s GLU 842 CO 0.55 -0.16 0.72 -0.65 -0.54 0.00 0.00 175.26 175.19 2b39 s GLN 843 N 1.09 4.35 -0.06 4.30 -0.21 0.21 -4.07 119.66 125.26 2b39 s GLN 843 Ca -0.09 0.87 0.03 0.00 0.02 0.00 0.00 55.36 56.19 2b39 s GLN 843 Cb -0.11 -3.51 0.01 0.00 1.00 0.00 0.00 33.01 30.40 2b39 s GLN 843 CO -0.05 -0.10 -0.14 0.08 -2.12 0.00 0.00 175.29 172.95 2b39 s VAL 844 N 1.39 1.26 -0.82 1.09 1.01 0.70 0.79 120.40 125.83 2b39 s VAL 844 Ca 0.36 -0.56 -0.15 0.00 0.00 0.00 0.00 61.98 61.63 2b39 s VAL 844 Cb -0.17 -1.13 0.20 0.00 0.00 0.00 0.00 36.38 35.28 2b39 s VAL 844 CO 0.15 0.38 0.80 -0.70 0.00 0.00 0.00 175.10 175.73 2b39 s GLU 845 N 0.53 3.55 0.84 2.72 2.12 -0.51 -0.82 118.70 127.12 2b39 s GLU 845 Ca -0.13 -2.27 -0.14 0.00 0.36 0.00 0.00 54.97 52.78 2b39 s GLU 845 Cb -0.15 -4.49 0.20 0.00 0.26 0.00 0.00 34.13 29.95 2b39 s GLU 845 CO 0.04 -1.37 1.00 0.44 -0.54 0.00 0.00 175.26 174.83 2b39 n ILE 846 N 4.33 0.00 -3.66 -3.70 -0.00 -0.39 -4.32 119.36 111.63 2b39 n ILE 846 Ca 0.13 -0.66 -0.10 0.00 -0.00 0.00 0.00 62.75 62.12 2b39 n ILE 846 Cb 0.47 -1.49 -0.08 0.00 -0.00 0.00 0.00 39.64 38.54 2b39 n ILE 846 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.55 176.55 2b39 s ARG 847 N -5.21 0.65 0.14 6.28 1.70 -1.11 -1.26 118.95 120.14 2b39 s ARG 847 Ca 0.59 1.04 -0.19 0.00 -0.47 0.00 0.00 55.73 56.71 2b39 s ARG 847 Cb -0.03 0.17 -0.07 0.00 -0.57 0.00 0.00 34.95 34.45 2b39 s ARG 847 CO 0.42 -0.13 0.62 0.00 -1.08 0.00 0.00 175.30 175.13 2b39 s ALA 848 N 1.23 3.53 -0.16 7.88 0.00 -1.05 -1.14 121.76 132.05 2b39 s ALA 848 Ca -0.07 0.05 0.01 0.00 0.00 0.00 0.00 51.96 51.95 2b39 s ALA 848 Cb -0.06 -2.68 0.02 0.00 0.00 0.00 0.00 23.12 20.41 2b39 s ALA 848 CO -0.13 0.39 -0.17 0.42 0.00 0.00 0.00 175.76 176.27 2b39 s ILE 849 N -1.32 1.75 -0.20 0.00 1.01 0.39 -0.87 121.20 121.97 2b39 s ILE 849 Ca 0.36 -0.75 -0.08 0.00 0.00 0.00 0.00 60.65 60.18 2b39 s ILE 849 Cb -0.18 -1.61 -0.04 0.00 0.01 0.00 0.00 42.46 40.64 2b39 s ILE 849 CO 0.20 0.49 0.07 -0.76 0.00 0.00 0.00 174.94 174.94 2b39 s LEU 850 N 1.35 3.78 -0.09 2.97 1.43 -0.75 0.28 118.68 127.66 2b39 s LEU 850 Ca 0.04 0.04 0.01 0.00 -1.03 0.00 0.00 54.13 53.18 2b39 s LEU 850 Cb -0.13 -1.97 -0.03 0.00 0.03 0.00 0.00 46.19 44.09 2b39 s LEU 850 CO -0.10 0.13 -0.10 -0.31 0.23 0.00 0.00 176.35 176.20 2b39 s TYR 851 N 0.61 2.86 -0.50 0.29 2.02 -0.08 -2.14 117.35 120.40 2b39 s TYR 851 Ca 0.04 -0.19 0.04 0.00 -0.37 0.00 0.00 57.07 56.58 2b39 s TYR 851 Cb -0.13 -1.74 0.16 0.00 -0.40 0.00 0.00 41.96 39.85 2b39 s TYR 851 CO 0.01 0.14 0.37 0.54 -1.57 0.00 0.00 175.55 175.04 2b39 s ASN 852 N -0.42 2.85 0.00 2.29 4.22 -1.25 -1.74 114.94 120.90 2b39 s ASN 852 Ca 0.06 -3.22 0.08 0.00 -2.14 0.00 0.00 52.86 47.64 2b39 s ASN 852 Cb -0.12 -0.89 0.48 0.00 1.28 0.00 0.00 41.25 42.00 2b39 s ASN 852 CO 0.02 -0.16 0.96 -1.22 -2.04 0.00 0.00 177.10 174.66 2b39 n TYR 853 N 2.72 0.00 -1.70 1.54 4.01 -0.79 -4.11 117.16 118.83 2b39 n TYR 853 Ca 0.23 0.00 -0.43 0.00 -0.16 0.00 0.00 57.90 57.54 2b39 n TYR 853 Cb 0.42 0.00 -0.02 0.00 -0.31 0.00 0.00 39.34 39.43 2b39 n TYR 853 CO 0.00 0.00 0.00 -2.13 -0.46 0.00 0.00 176.86 174.27 2b39 n ARG 854 N -0.73 2.25 -3.00 -0.72 3.00 -1.25 -4.93 116.66 111.28 2b39 n ARG 854 Ca 0.06 0.80 -0.40 0.00 -0.00 0.00 0.00 57.85 58.31 2b39 n ARG 854 Cb 0.03 -2.46 -0.05 0.00 0.00 0.00 0.00 32.46 29.98 2b39 n ARG 854 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.63 175.63 2b39 s GLU 855 N -1.07 4.47 0.00 -0.14 2.56 -1.26 -4.32 118.70 118.94 2b39 s GLU 855 Ca 0.62 1.02 0.00 0.00 0.00 0.00 0.00 54.97 56.61 2b39 s GLU 855 Cb -0.58 -3.38 0.00 0.00 2.00 0.00 0.00 34.13 32.17 2b39 s GLU 855 CO 0.55 0.23 0.00 0.00 -0.56 0.00 0.00 175.26 175.48 2b39 n ALA 856 N 3.04 0.00 -2.58 6.30 0.00 -1.26 -4.94 120.51 121.07 2b39 n ALA 856 Ca -0.02 0.00 -0.32 0.00 0.00 0.00 0.00 53.44 53.10 2b39 n ALA 856 Cb 0.51 -0.76 -0.10 0.00 0.00 0.00 0.00 19.45 19.09 2b39 n ALA 856 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 2b39 s GLU 857 N -0.67 2.45 -0.25 0.00 2.02 -1.26 -5.01 118.70 115.98 2b39 s GLU 857 Ca 0.00 -0.79 -0.10 0.00 0.02 0.00 0.00 54.97 54.10 2b39 s GLU 857 Cb 0.00 -2.44 -0.04 0.00 0.10 0.00 0.00 34.13 31.74 2b39 s GLU 857 CO 0.00 0.58 0.14 -0.80 0.02 0.00 0.00 175.26 175.20 2b39 s ASN 858 N -1.56 5.79 -0.27 -0.19 0.01 -1.26 -4.31 114.94 113.15 2b39 s ASN 858 Ca 0.18 -0.01 -0.20 0.00 -0.71 0.00 0.00 52.86 52.11 2b39 s ASN 858 Cb -0.11 -2.05 -0.02 0.00 0.41 0.00 0.00 41.25 39.48 2b39 s ASN 858 CO 0.09 0.01 0.63 -0.76 -1.51 0.00 0.00 177.10 175.56 2b39 s LEU 859 N 1.35 4.08 0.07 0.60 2.01 -1.15 -4.90 118.68 120.75 2b39 s LEU 859 Ca 0.06 0.62 -0.24 0.00 0.01 0.00 0.00 54.13 54.59 2b39 s LEU 859 Cb -0.15 -2.84 -0.06 0.00 0.01 0.00 0.00 46.19 43.15 2b39 s LEU 859 CO 0.06 -0.40 0.73 -0.75 1.01 0.00 0.00 176.35 177.00 2b39 s LYS 860 N 2.54 4.46 0.05 1.70 2.20 -1.26 -0.44 119.74 128.98 2b39 s LYS 860 Ca 0.26 1.01 -0.01 0.00 -0.36 0.00 0.00 55.97 56.87 2b39 s LYS 860 Cb -0.15 -3.32 -0.03 0.00 -1.51 0.00 0.00 37.83 32.81 2b39 s LYS 860 CO 0.09 0.40 -0.01 0.08 -0.36 0.00 0.00 175.35 175.55 2b39 s VAL 861 N -0.44 0.19 -0.26 4.02 1.01 0.15 -1.65 120.40 123.41 2b39 s VAL 861 Ca 0.36 -1.57 0.01 0.00 0.00 0.00 0.00 61.98 60.78 2b39 s VAL 861 Cb -0.21 -1.23 0.07 0.00 0.00 0.00 0.00 36.38 35.01 2b39 s VAL 861 CO 0.23 -0.87 -0.01 -0.60 0.00 0.00 0.00 175.10 173.85 2b39 s ARG 862 N -3.36 1.44 0.16 2.72 6.06 -0.69 -0.22 118.95 125.06 2b39 s ARG 862 Ca 0.02 -1.12 0.06 0.00 -2.50 0.00 0.00 55.73 52.18 2b39 s ARG 862 Cb 0.04 -2.58 -0.04 0.00 0.06 0.00 0.00 34.95 32.43 2b39 s ARG 862 CO -0.08 -0.71 0.06 0.14 -2.50 0.00 0.00 175.30 172.22 2b39 s VAL 863 N 1.36 4.13 -0.07 7.11 -7.23 -0.78 -1.39 120.40 123.54 2b39 s VAL 863 Ca -0.01 -1.20 -0.12 0.00 -1.81 0.00 0.00 61.98 58.84 2b39 s VAL 863 Cb -0.19 -3.08 0.03 0.00 0.56 0.00 0.00 36.38 33.70 2b39 s VAL 863 CO -0.09 -0.08 0.30 -0.70 -0.31 0.00 0.00 175.10 174.22 2b39 s GLU 864 N -2.93 0.50 -0.44 4.82 2.12 0.15 -1.90 118.70 121.01 2b39 s GLU 864 Ca 0.29 0.12 -0.15 0.00 0.36 0.00 0.00 54.97 55.59 2b39 s GLU 864 Cb -0.10 0.23 0.05 0.00 0.26 0.00 0.00 34.13 34.57 2b39 s GLU 864 CO 0.21 -0.11 0.34 -1.17 -0.54 0.00 0.00 175.26 174.00 2b39 s LEU 865 N -0.55 5.36 0.33 2.70 2.96 -1.25 -0.80 118.68 127.42 2b39 s LEU 865 Ca -0.07 -1.14 -0.29 0.00 -0.22 0.00 0.00 54.13 52.42 2b39 s LEU 865 Cb -0.04 -2.16 -0.12 0.00 0.50 0.00 0.00 46.19 44.37 2b39 s LEU 865 CO 0.02 -0.55 1.50 0.18 -1.32 0.00 0.00 176.35 176.18 2b39 n LEU 866 N 5.17 4.33 -4.73 -0.68 4.77 -0.20 -4.70 117.00 120.96 2b39 n LEU 866 Ca -0.12 1.19 -0.41 0.00 -0.03 0.00 0.00 56.01 56.64 2b39 n LEU 866 Cb 0.45 -1.58 -0.03 0.00 -2.33 0.00 0.00 43.42 39.93 2b39 n LEU 866 CO 0.44 0.02 0.90 -0.47 -1.33 0.00 0.00 177.39 176.95 2b39 s TYR 867 N -0.60 3.41 -0.06 -1.77 5.04 -1.26 -4.66 117.35 117.44 2b39 s TYR 867 Ca 0.59 1.37 0.03 0.00 -2.44 0.00 0.00 57.07 56.61 2b39 s TYR 867 Cb -0.51 -3.45 0.01 0.00 0.35 0.00 0.00 41.96 38.36 2b39 s TYR 867 CO 0.57 -1.32 -0.13 1.21 -1.34 0.00 0.00 175.55 174.53 2b39 s ASN 868 N 0.34 1.84 0.17 4.32 3.84 -1.26 -5.01 114.94 119.18 2b39 s ASN 868 Ca 0.55 -0.31 0.18 0.00 0.21 0.00 0.00 52.86 53.49 2b39 s ASN 868 Cb -0.33 -0.82 0.81 0.00 -0.55 0.00 0.00 41.25 40.37 2b39 s ASN 868 CO 0.35 0.05 1.56 -0.81 -2.79 0.00 0.00 177.10 175.46 2b39 n PRO 869 N 3.73 0.11 0.15 0.43 -0.04 -1.26 -2.64 135.00 135.48 2b39 n PRO 869 Ca -0.22 0.42 0.13 0.00 -0.04 0.00 0.00 63.50 63.79 2b39 n PRO 869 Cb 0.52 -1.75 0.43 0.00 -0.04 0.00 0.00 33.50 32.66 2b39 n PRO 869 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2b39 h ALA 870 N 2.25 1.00 -2.57 0.55 0.00 -1.95 -3.46 119.26 115.08 2b39 h ALA 870 Ca 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 54.91 54.82 2b39 h ALA 870 Cb 0.23 0.00 -0.15 0.00 0.00 0.00 0.00 17.79 17.87 2b39 h ALA 870 CO 0.00 0.00 -0.29 -0.59 0.00 0.00 0.00 179.25 178.37 2b39 s PHE 871 N -3.24 -0.00 0.19 0.00 -0.71 -1.08 -0.15 117.98 112.99 2b39 s PHE 871 Ca 0.07 -0.27 -0.22 0.00 -1.04 0.00 0.00 56.93 55.47 2b39 s PHE 871 Cb 0.10 0.04 -0.08 0.00 -1.21 0.00 0.00 43.02 41.87 2b39 s PHE 871 CO 0.54 -0.53 0.74 0.00 -1.34 0.00 0.00 175.22 174.64 2b39 s SER 873 N -1.38 -0.25 0.56 0.00 1.04 -1.26 -1.60 113.70 110.80 2b39 s SER 873 Ca 0.39 -0.44 0.37 0.00 0.48 0.00 0.00 55.95 56.75 2b39 s SER 873 Cb -0.20 0.59 1.92 0.00 0.10 0.00 0.00 66.02 68.44 2b39 s SER 873 CO 0.23 -1.07 2.13 -0.07 0.98 0.00 0.00 173.24 175.44 2b39 h LEU 874 N 2.00 0.00 -9.06 2.42 3.38 -1.94 -3.41 115.31 108.70 2b39 h LEU 874 Ca -0.22 0.00 -0.59 0.00 0.09 0.00 0.00 57.88 57.16 2b39 h LEU 874 Cb 1.24 0.00 -0.08 0.00 0.09 0.00 0.00 40.66 41.92 2b39 h LEU 874 CO 0.26 0.00 0.53 0.00 0.09 0.00 0.00 178.44 179.32 2b39 s ALA 875 N -3.90 3.64 0.35 1.53 0.00 -1.26 -4.63 121.76 117.49 2b39 s ALA 875 Ca -0.03 -0.05 0.02 0.00 0.00 0.00 0.00 51.96 51.90 2b39 s ALA 875 Cb 0.11 -3.33 -0.02 0.00 0.00 0.00 0.00 23.12 19.87 2b39 s ALA 875 CO 0.39 -0.92 0.53 0.99 0.00 0.00 0.00 175.76 176.76 2b39 s THR 876 N 2.83 4.82 0.22 0.00 2.01 0.13 -4.67 115.64 120.98 2b39 s THR 876 Ca 0.37 -0.62 -0.09 0.00 0.31 0.00 0.00 61.69 61.66 2b39 s THR 876 Cb -0.15 -3.74 0.19 0.00 0.01 0.00 0.00 72.50 68.80 2b39 s THR 876 CO 0.08 -0.44 1.68 0.00 -0.69 0.00 0.00 174.62 175.25 2b39 h ALA 877 N 0.78 0.71 0.03 7.40 0.00 -1.96 -3.15 119.26 123.06 2b39 h ALA 877 Ca -0.49 0.17 -0.38 0.00 0.00 0.00 0.00 54.91 54.21 2b39 h ALA 877 Cb 1.23 0.26 -0.06 0.00 0.00 0.00 0.00 17.79 19.22 2b39 h ALA 877 CO 0.60 -0.36 -2.32 1.17 0.00 0.00 0.00 179.25 178.34 2b39 n LYS 878 N -5.21 0.68 -3.66 0.00 3.00 -1.26 -4.86 118.16 106.85 2b39 n LYS 878 Ca 0.10 0.16 -0.39 0.00 -0.00 0.00 0.00 58.31 58.17 2b39 n LYS 878 Cb 0.37 -1.57 -0.11 0.00 0.00 0.00 0.00 35.03 33.71 2b39 n LYS 878 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.40 175.81 2b39 s LYS 879 N -2.53 2.63 0.72 1.64 -2.85 -1.19 -5.09 119.74 113.08 2b39 s LYS 879 Ca -0.27 -1.30 -0.09 0.00 -1.00 0.00 0.00 55.97 53.31 2b39 s LYS 879 Cb 0.08 -3.65 0.05 0.00 -2.06 0.00 0.00 37.83 32.25 2b39 s LYS 879 CO 0.69 -0.81 1.07 -0.98 0.10 0.00 0.00 175.35 175.42 2b39 s ARG 880 N 1.43 2.38 -0.04 1.78 1.70 -1.25 0.18 118.95 125.12 2b39 s ARG 880 Ca 0.01 0.07 0.01 0.00 -0.47 0.00 0.00 55.73 55.35 2b39 s ARG 880 Cb -0.21 -2.08 0.02 0.00 -0.57 0.00 0.00 34.95 32.11 2b39 s ARG 880 CO 0.03 -1.23 -0.05 -1.58 -1.08 0.00 0.00 175.30 171.39 2b39 s HIS 881 N -3.35 0.73 0.03 5.89 5.65 -1.26 -4.82 115.29 118.17 2b39 s HIS 881 Ca 0.59 -0.20 0.05 0.00 0.25 0.00 0.00 55.06 55.76 2b39 s HIS 881 Cb -0.11 -0.65 -0.02 0.00 -1.18 0.00 0.00 32.58 30.63 2b39 s HIS 881 CO 0.48 -0.18 -0.15 -0.65 -0.65 0.00 0.00 174.74 173.58 2b39 s GLN 882 N 0.85 1.07 0.31 2.88 -0.21 -1.26 -3.90 119.66 119.39 2b39 s GLN 882 Ca -0.11 -0.75 0.10 0.00 0.02 0.00 0.00 55.36 54.62 2b39 s GLN 882 Cb -0.14 -1.09 -0.05 0.00 1.00 0.00 0.00 33.01 32.73 2b39 s GLN 882 CO 0.00 0.28 -0.10 -0.65 -2.12 0.00 0.00 175.29 172.70 2b39 s GLN 883 N -1.01 1.88 -0.05 2.91 -0.21 -0.80 -5.00 119.66 117.39 2b39 s GLN 883 Ca 0.03 -1.77 0.03 0.00 0.02 0.00 0.00 55.36 53.67 2b39 s GLN 883 Cb -0.08 -1.83 0.01 0.00 1.00 0.00 0.00 33.01 32.11 2b39 s GLN 883 CO 0.01 0.24 -0.12 0.99 -2.12 0.00 0.00 175.29 174.29 2b39 s THR 884 N -2.52 1.06 0.02 -0.19 2.01 -1.26 -1.86 115.64 112.90 2b39 s THR 884 Ca 0.32 -0.46 -0.05 0.00 0.31 0.00 0.00 61.69 61.81 2b39 s THR 884 Cb -0.02 -0.96 -0.01 0.00 0.01 0.00 0.00 72.50 71.52 2b39 s THR 884 CO 0.17 0.33 0.08 0.27 -0.69 0.00 0.00 174.62 174.78 2b39 s ILE 885 N 0.50 0.11 -0.32 1.82 -4.36 0.70 -4.95 121.20 114.70 2b39 s ILE 885 Ca -0.11 -0.90 -0.09 0.00 -0.26 0.00 0.00 60.65 59.29 2b39 s ILE 885 Cb -0.14 -0.56 0.01 0.00 1.25 0.00 0.00 42.46 43.02 2b39 s ILE 885 CO 0.03 -0.50 0.14 -0.89 0.24 0.00 0.00 174.94 173.96 2b39 s THR 886 N -1.85 4.41 0.20 8.37 2.01 -1.26 0.32 115.64 127.83 2b39 s THR 886 Ca -0.12 -0.60 -0.30 0.00 0.31 0.00 0.00 61.69 60.98 2b39 s THR 886 Cb -0.06 -3.31 -0.08 0.00 0.01 0.00 0.00 72.50 69.06 2b39 s THR 886 CO -0.01 0.00 1.24 -0.63 -0.69 0.00 0.00 174.62 174.53 2b39 s ILE 887 N 1.57 3.40 1.12 1.82 1.09 0.42 -4.92 121.20 125.69 2b39 s ILE 887 Ca 0.03 1.18 -0.14 0.00 -1.10 0.00 0.00 60.65 60.62 2b39 s ILE 887 Cb -0.18 -3.75 0.25 0.00 -1.06 0.00 0.00 42.46 37.73 2b39 s ILE 887 CO 0.05 0.19 1.06 -2.84 -0.10 0.00 0.00 174.94 173.30 2b39 s PRO 888 N -0.27 -0.59 0.22 2.79 0.02 -1.26 -2.91 135.00 132.99 2b39 s PRO 888 Ca 0.54 0.49 -0.19 0.00 0.02 0.00 0.00 61.00 61.85 2b39 s PRO 888 Cb -0.34 -1.62 0.19 0.00 0.02 0.00 0.00 34.50 32.75 2b39 s PRO 888 CO 0.38 -3.41 1.56 0.00 -0.33 0.00 0.00 177.00 175.19 2b39 h ALA 889 N -2.38 0.06 0.00 -1.55 0.00 -1.89 -3.30 119.26 110.20 2b39 h ALA 889 Ca -0.56 0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.60 2b39 h ALA 889 Cb 1.33 1.01 0.00 0.00 0.00 0.00 0.00 17.79 20.13 2b39 h ALA 889 CO 0.50 -0.67 -0.09 0.54 0.00 0.00 0.00 179.25 179.54 2b39 n ARG 890 N -5.45 3.74 -0.63 0.00 1.74 -1.26 -4.23 116.66 110.58 2b39 n ARG 890 Ca 0.08 0.00 -0.31 0.00 -0.77 0.00 0.00 57.85 56.85 2b39 n ARG 890 Cb 0.38 -0.36 0.19 0.00 -1.02 0.00 0.00 32.46 31.65 2b39 n ARG 890 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54 2b39 n SER 891 N -0.61 -1.72 -0.17 0.55 7.64 -1.24 -4.50 113.62 113.57 2b39 n SER 891 Ca 0.00 0.03 0.00 0.00 1.01 0.00 0.00 58.87 59.91 2b39 n SER 891 Cb 0.00 -1.18 0.00 0.00 -1.01 0.00 0.00 64.21 62.02 2b39 n SER 891 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 2b39 n SER 892 N -3.08 0.00 -3.65 6.43 7.64 -1.26 -3.75 113.62 115.96 2b39 n SER 892 Ca 0.04 0.00 -0.02 0.00 1.01 0.00 0.00 58.87 59.90 2b39 n SER 892 Cb 0.56 0.00 -0.06 0.00 -1.01 0.00 0.00 64.21 63.70 2b39 n SER 892 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 2b39 s VAL 893 N 2.53 0.00 -0.12 0.44 1.01 -0.91 -4.65 120.40 118.70 2b39 s VAL 893 Ca 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 61.98 61.94 2b39 s VAL 893 Cb 0.00 -1.00 -0.03 0.00 0.00 0.00 0.00 36.38 35.35 2b39 s VAL 893 CO 0.00 0.00 0.02 0.00 0.00 0.00 0.00 175.10 175.12 2b39 s ALA 894 N 1.09 3.31 -0.26 5.51 0.00 -1.26 -1.81 121.76 128.34 2b39 s ALA 894 Ca -0.07 -0.78 0.01 0.00 0.00 0.00 0.00 51.96 51.12 2b39 s ALA 894 Cb -0.03 -1.61 0.07 0.00 0.00 0.00 0.00 23.12 21.54 2b39 s ALA 894 CO -0.13 0.46 -0.02 0.14 0.00 0.00 0.00 175.76 176.21 2b39 s VAL 895 N -0.46 1.58 0.17 0.00 -7.23 -0.04 -4.98 120.40 109.43 2b39 s VAL 895 Ca 0.09 -1.44 -0.31 0.00 -1.81 0.00 0.00 61.98 58.51 2b39 s VAL 895 Cb -0.12 -1.94 -0.09 0.00 0.56 0.00 0.00 36.38 34.79 2b39 s VAL 895 CO 0.02 -0.26 1.42 -2.16 -0.31 0.00 0.00 175.10 173.82 2b39 s PRO 896 N 1.34 4.30 -0.31 4.82 0.04 -1.26 -2.54 135.00 141.39 2b39 s PRO 896 Ca -0.01 2.18 -0.01 0.00 0.04 0.00 0.00 61.00 63.21 2b39 s PRO 896 Cb -0.19 -3.19 0.10 0.00 0.04 0.00 0.00 34.50 31.27 2b39 s PRO 896 CO -0.09 -0.43 0.09 0.71 0.04 0.00 0.00 177.00 177.32 2b39 s TYR 897 N 0.67 1.77 0.21 0.56 4.12 -0.39 -5.00 117.35 119.29 2b39 s TYR 897 Ca 0.63 -1.76 -0.30 0.00 0.02 0.00 0.00 57.07 55.66 2b39 s TYR 897 Cb -0.39 -1.74 -0.08 0.00 -1.52 0.00 0.00 41.96 38.22 2b39 s TYR 897 CO 0.35 -0.87 1.10 0.08 0.02 0.00 0.00 175.55 176.23 2b39 s VAL 898 N 1.59 3.74 0.01 0.71 1.01 -1.26 -1.26 120.40 124.95 2b39 s VAL 898 Ca 0.09 1.58 -0.05 0.00 0.00 0.00 0.00 61.98 63.61 2b39 s VAL 898 Cb -0.17 -4.01 -0.01 0.00 0.00 0.00 0.00 36.38 32.19 2b39 s VAL 898 CO -0.24 0.31 0.07 -0.63 0.00 0.00 0.00 175.10 174.61 2b39 s ILE 899 N -0.54 0.10 -0.31 2.22 1.01 0.00 -4.45 121.20 119.23 2b39 s ILE 899 Ca 0.48 -0.85 -0.02 0.00 0.00 0.00 0.00 60.65 60.26 2b39 s ILE 899 Cb -0.30 -0.47 0.10 0.00 0.01 0.00 0.00 42.46 41.80 2b39 s ILE 899 CO 0.37 -0.47 0.11 -0.69 0.00 0.00 0.00 174.94 174.26 2b39 s VAL 900 N -1.64 0.52 0.55 2.92 1.01 -0.63 -0.21 120.40 122.91 2b39 s VAL 900 Ca -0.13 -1.18 -0.20 0.00 0.00 0.00 0.00 61.98 60.46 2b39 s VAL 900 Cb -0.07 -1.41 -0.05 0.00 0.00 0.00 0.00 36.38 34.85 2b39 s VAL 900 CO -0.00 -0.70 1.23 -2.84 0.00 0.00 0.00 175.10 172.78 2b39 s PRO 901 N 1.77 3.20 0.14 2.72 0.02 -1.26 0.03 135.00 141.63 2b39 s PRO 901 Ca 0.10 1.89 0.00 0.00 0.02 0.00 0.00 61.00 63.01 2b39 s PRO 901 Cb -0.17 -2.11 0.00 0.00 0.02 0.00 0.00 34.50 32.24 2b39 s PRO 901 CO -0.29 -1.04 0.00 1.28 -0.33 0.00 0.00 177.00 176.62 2b39 n LEU 902 N -1.21 0.77 -4.76 -5.54 4.77 0.79 -1.55 117.00 110.27 2b39 n LEU 902 Ca 0.11 0.22 -0.40 0.00 -0.03 0.00 0.00 56.01 55.91 2b39 n LEU 902 Cb 0.48 -0.15 -0.05 0.00 -2.33 0.00 0.00 43.42 41.37 2b39 n LEU 902 CO 0.47 -0.76 0.71 -0.54 -1.33 0.00 0.00 177.39 175.94 2b39 s LYS 903 N -1.95 4.70 1.12 3.23 3.01 -1.07 -4.72 119.74 124.06 2b39 s LYS 903 Ca 0.00 1.60 -0.18 0.00 -1.01 0.00 0.00 55.97 56.38 2b39 s LYS 903 Cb 0.00 -3.15 0.26 0.00 -1.01 0.00 0.00 37.83 33.93 2b39 s LYS 903 CO 0.00 0.33 1.20 0.42 0.51 0.00 0.00 175.35 177.81 2b39 s ILE 904 N -1.25 1.74 0.00 2.17 1.01 -1.26 -4.85 121.20 118.76 2b39 s ILE 904 Ca 0.44 0.00 0.00 0.00 0.00 0.00 0.00 60.65 61.09 2b39 s ILE 904 Cb -0.27 -2.69 0.00 0.00 0.01 0.00 0.00 42.46 39.51 2b39 s ILE 904 CO 0.34 0.00 0.00 0.61 0.00 0.00 0.00 174.94 175.89 2b39 n GLY 905 N -2.07 -2.14 3.67 6.18 0.00 -0.33 -4.90 105.19 105.61 2b39 n GLY 905 Ca 0.14 -1.75 -0.38 0.00 0.00 0.00 0.00 46.02 44.04 2b39 n GLY 905 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2b39 s LEU 906 N 0.00 4.15 0.01 0.99 1.43 -1.26 -2.03 118.68 121.96 2b39 s LEU 906 Ca 0.00 0.41 0.08 0.00 -1.03 0.00 0.00 54.13 53.59 2b39 s LEU 906 Cb 0.00 -2.41 -0.02 0.00 0.03 0.00 0.00 46.19 43.79 2b39 s LEU 906 CO 0.00 -0.04 -0.24 -1.00 0.23 0.00 0.00 176.35 175.30 2b39 s HIS 907 N 1.23 2.15 -0.21 0.29 3.76 -1.18 -4.93 115.29 116.40 2b39 s HIS 907 Ca 0.16 -0.40 -0.27 0.00 -0.15 0.00 0.00 55.06 54.39 2b39 s HIS 907 Cb -0.14 -1.35 0.00 0.00 1.11 0.00 0.00 32.58 32.20 2b39 s HIS 907 CO 0.07 0.02 0.95 -1.21 -0.85 0.00 0.00 174.74 173.72 2b39 s GLU 908 N -0.81 4.26 -0.14 1.40 0.41 -1.26 -0.29 118.70 122.26 2b39 s GLU 908 Ca 0.10 1.20 -0.05 0.00 -0.41 0.00 0.00 54.97 55.81 2b39 s GLU 908 Cb -0.09 -3.62 -0.03 0.00 -1.78 0.00 0.00 34.13 28.60 2b39 s GLU 908 CO 0.00 -0.53 0.01 0.08 -0.49 0.00 0.00 175.26 174.34 2b39 s VAL 909 N 2.84 4.35 -0.01 2.63 1.01 0.26 -4.94 120.40 126.55 2b39 s VAL 909 Ca 0.41 -0.20 0.00 0.00 0.00 0.00 0.00 61.98 62.19 2b39 s VAL 909 Cb -0.16 -2.91 0.01 0.00 0.00 0.00 0.00 36.38 33.33 2b39 s VAL 909 CO 0.08 0.52 0.01 -0.70 0.00 0.00 0.00 175.10 175.01 2b39 s GLU 910 N -0.01 0.01 -0.03 2.72 2.12 -1.26 0.03 118.70 122.28 2b39 s GLU 910 Ca 0.03 0.07 0.02 0.00 0.36 0.00 0.00 54.97 55.45 2b39 s GLU 910 Cb -0.13 -0.13 0.01 0.00 0.26 0.00 0.00 34.13 34.14 2b39 s GLU 910 CO 0.02 -0.07 -0.08 0.08 -0.54 0.00 0.00 175.26 174.67 2b39 s VAL 911 N 0.45 0.75 0.26 3.70 1.01 -0.47 -1.03 120.40 125.06 2b39 s VAL 911 Ca -0.04 -0.32 0.11 0.00 0.00 0.00 0.00 61.98 61.73 2b39 s VAL 911 Cb -0.06 -0.68 -0.05 0.00 0.00 0.00 0.00 36.38 35.60 2b39 s VAL 911 CO -0.01 0.24 -0.12 -0.54 0.00 0.00 0.00 175.10 174.67 2b39 s LYS 912 N 0.34 1.93 0.01 2.72 1.02 0.01 -0.22 119.74 125.55 2b39 s LYS 912 Ca -0.05 -1.59 -0.10 0.00 0.02 0.00 0.00 55.97 54.24 2b39 s LYS 912 Cb -0.10 -1.95 0.01 0.00 -0.52 0.00 0.00 37.83 35.27 2b39 s LYS 912 CO 0.01 0.35 0.20 0.00 -0.92 0.00 0.00 175.35 174.99 2b39 s ALA 913 N -2.35 -0.45 -0.07 5.17 0.00 0.21 0.31 121.76 124.58 2b39 s ALA 913 Ca 0.30 -0.08 -0.06 0.00 0.00 0.00 0.00 51.96 52.12 2b39 s ALA 913 Cb -0.06 0.16 0.02 0.00 0.00 0.00 0.00 23.12 23.25 2b39 s ALA 913 CO 0.17 -0.27 0.19 0.00 0.00 0.00 0.00 175.76 175.85 2b39 s ALA 914 N -1.77 -0.46 0.20 0.00 0.00 -0.49 -1.56 121.76 117.68 2b39 s ALA 914 Ca -0.11 0.60 -0.26 0.00 0.00 0.00 0.00 51.96 52.19 2b39 s ALA 914 Cb -0.05 -0.36 -0.08 0.00 0.00 0.00 0.00 23.12 22.63 2b39 s ALA 914 CO 0.00 -0.11 0.82 0.08 0.00 0.00 0.00 175.76 176.55 2b39 s VAL 915 N 0.33 4.31 0.17 0.00 1.01 -0.71 -1.70 120.40 123.82 2b39 s VAL 915 Ca -0.02 1.76 -0.30 0.00 0.00 0.00 0.00 61.98 63.42 2b39 s VAL 915 Cb -0.03 -4.14 -0.08 0.00 0.00 0.00 0.00 36.38 32.13 2b39 s VAL 915 CO -0.01 0.47 1.17 -0.31 0.00 0.00 0.00 175.10 176.41 2b39 s TYR 916 N -1.22 3.48 -1.47 5.22 1.51 -0.66 -3.84 117.35 120.37 2b39 s TYR 916 Ca 0.38 1.47 -0.02 0.00 -1.01 0.00 0.00 57.07 57.89 2b39 s TYR 916 Cb -0.23 -3.38 0.00 0.00 -0.11 0.00 0.00 41.96 38.24 2b39 s TYR 916 CO 0.27 -1.02 0.21 0.09 -1.11 0.00 0.00 175.55 173.99 2b39 n ASN 917 N 2.59 0.08 -3.58 2.29 5.03 -1.26 -4.78 115.26 115.63 2b39 n ASN 917 Ca 0.04 -1.17 -0.06 0.00 0.87 0.00 0.00 54.58 54.26 2b39 n ASN 917 Cb 0.45 -2.19 -0.03 0.00 -1.02 0.00 0.00 39.78 36.99 2b39 n ASN 917 CO 0.00 0.00 0.00 -2.28 -1.83 0.00 0.00 177.26 173.15 2b39 s HIS 918 N -4.16 -0.22 -0.95 3.10 2.46 -1.25 -5.10 115.29 109.17 2b39 s HIS 918 Ca 0.04 0.23 -0.11 0.00 0.47 0.00 0.00 55.06 55.70 2b39 s HIS 918 Cb -0.02 0.50 0.24 0.00 -0.13 0.00 0.00 32.58 33.18 2b39 s HIS 918 CO 0.95 -0.29 0.91 0.12 -2.47 0.00 0.00 174.74 173.96 2b39 s PHE 919 N -2.07 3.98 -0.08 3.88 5.36 -1.26 -4.61 117.98 123.18 2b39 s PHE 919 Ca 0.06 -2.41 0.01 0.00 -0.96 0.00 0.00 56.93 53.63 2b39 s PHE 919 Cb -0.01 -3.76 0.02 0.00 -0.34 0.00 0.00 43.02 38.93 2b39 s PHE 919 CO -0.05 -0.95 -0.11 0.42 -1.46 0.00 0.00 175.22 173.08 2b39 s ILE 920 N -0.58 1.11 -0.16 3.12 -1.09 -1.26 -5.00 121.20 117.33 2b39 s ILE 920 Ca 0.24 -0.42 -0.01 0.00 -2.23 0.00 0.00 60.65 58.23 2b39 s ILE 920 Cb -0.10 -1.05 0.05 0.00 -1.58 0.00 0.00 42.46 39.77 2b39 s ILE 920 CO -0.08 0.36 -0.01 -0.55 -1.23 0.00 0.00 174.94 173.43 2b39 s SER 921 N 1.05 2.67 -0.08 3.58 0.15 -1.26 -1.73 113.70 118.07 2b39 s SER 921 Ca -0.07 -0.64 -0.16 0.00 0.70 0.00 0.00 55.95 55.78 2b39 s SER 921 Cb -0.15 -0.71 0.04 0.00 -1.71 0.00 0.00 66.02 63.49 2b39 s SER 921 CO -0.01 -0.23 0.40 -0.62 1.20 0.00 0.00 173.24 173.98 2b39 s ASP 922 N 1.77 -0.36 0.25 5.45 -1.08 -0.60 -5.03 116.67 117.07 2b39 s ASP 922 Ca 0.01 0.51 -0.20 0.00 -0.52 0.00 0.00 52.55 52.35 2b39 s ASP 922 Cb -0.16 0.59 0.02 0.00 -1.46 0.00 0.00 42.92 41.92 2b39 s ASP 922 CO -0.07 -0.33 0.64 -0.83 0.52 0.00 0.00 175.17 175.10 2b39 s GLY 923 N -0.60 -0.07 -0.02 2.66 0.00 -1.26 0.64 107.32 108.68 2b39 s GLY 923 Ca -0.07 -0.28 -0.07 0.00 0.00 0.00 0.00 44.72 44.30 2b39 s GLY 923 CO 0.03 -0.16 0.16 -1.34 0.00 0.00 0.00 173.10 171.79 2b39 s VAL 924 N -3.91 0.05 0.03 1.40 -7.23 0.69 -4.96 120.40 106.48 2b39 s VAL 924 Ca 0.11 -0.45 0.04 0.00 -1.81 0.00 0.00 61.98 59.87 2b39 s VAL 924 Cb -0.04 -0.38 -0.02 0.00 0.56 0.00 0.00 36.38 36.50 2b39 s VAL 924 CO 0.03 -0.25 -0.13 -1.59 -0.31 0.00 0.00 175.10 172.85 2b39 s LYS 925 N -0.89 0.89 0.10 4.82 -2.85 -1.26 -1.37 119.74 119.19 2b39 s LYS 925 Ca -0.10 -0.70 -0.03 0.00 -1.00 0.00 0.00 55.97 54.14 2b39 s LYS 925 Cb -0.05 -0.88 -0.03 0.00 -2.06 0.00 0.00 37.83 34.81 2b39 s LYS 925 CO 0.01 0.22 0.08 0.15 0.10 0.00 0.00 175.35 175.91 2b39 s LYS 926 N -1.04 0.85 -0.08 1.78 1.02 0.10 -4.94 119.74 117.43 2b39 s LYS 926 Ca 0.01 -1.27 -0.11 0.00 0.02 0.00 0.00 55.97 54.62 2b39 s LYS 926 Cb -0.07 0.26 -0.05 0.00 -0.52 0.00 0.00 37.83 37.45 2b39 s LYS 926 CO 0.01 -0.24 0.27 0.99 -0.92 0.00 0.00 175.35 175.46 2b39 s THR 927 N -3.97 5.29 -0.37 2.17 2.01 -1.26 0.90 115.64 120.41 2b39 s THR 927 Ca 0.15 0.51 -0.07 0.00 0.31 0.00 0.00 61.69 62.59 2b39 s THR 927 Cb 0.07 -3.56 0.06 0.00 0.01 0.00 0.00 72.50 69.07 2b39 s THR 927 CO -0.04 0.57 0.16 -0.22 -0.69 0.00 0.00 174.62 174.39 2b39 s LEU 928 N -0.80 4.63 -0.25 4.42 2.96 0.60 -4.92 118.68 125.31 2b39 s LEU 928 Ca 0.19 -1.31 -0.28 0.00 -0.22 0.00 0.00 54.13 52.50 2b39 s LEU 928 Cb -0.14 -1.90 -0.04 0.00 0.50 0.00 0.00 46.19 44.62 2b39 s LEU 928 CO 0.08 -0.40 1.96 -0.54 -1.32 0.00 0.00 176.35 176.13 2b39 s LYS 929 N 1.39 3.35 -0.47 1.98 -0.14 -1.26 -3.08 119.74 121.50 2b39 s LYS 929 Ca 0.00 1.78 -0.08 0.00 -1.36 0.00 0.00 55.97 56.31 2b39 s LYS 929 Cb -0.21 -4.25 0.12 0.00 -1.68 0.00 0.00 37.83 31.81 2b39 s LYS 929 CO 0.02 -1.85 0.34 0.08 -0.76 0.00 0.00 175.35 173.18 2b39 s VAL 930 N 7.15 4.09 0.12 3.17 1.01 -0.86 -0.05 120.40 135.03 2b39 s VAL 930 Ca 0.88 -1.86 -0.11 0.00 0.00 0.00 0.00 61.98 60.89 2b39 s VAL 930 Cb -0.28 -3.71 -0.06 0.00 0.00 0.00 0.00 36.38 32.33 2b39 s VAL 930 CO 0.34 -0.77 0.46 -0.69 0.00 0.00 0.00 175.10 174.44 2b39 s VAL 931 N 1.28 5.01 0.60 2.92 1.01 0.17 -1.18 120.40 130.21 2b39 s VAL 931 Ca 0.06 0.54 -0.16 0.00 0.00 0.00 0.00 61.98 62.42 2b39 s VAL 931 Cb -0.25 -3.67 -0.03 0.00 0.00 0.00 0.00 36.38 32.43 2b39 s VAL 931 CO -0.01 0.22 1.08 -2.16 0.00 0.00 0.00 175.10 174.23 2b39 s PRO 932 N -2.07 3.19 1.19 2.72 0.04 -1.26 -1.87 135.00 136.93 2b39 s PRO 932 Ca 0.37 1.33 -0.18 0.00 0.04 0.00 0.00 61.00 62.56 2b39 s PRO 932 Cb -0.14 -2.01 0.28 0.00 0.04 0.00 0.00 34.50 32.67 2b39 s PRO 932 CO 0.19 -0.93 1.08 -1.83 0.04 0.00 0.00 177.00 175.55 2b39 s GLU 933 N -3.91 -1.10 0.24 4.56 1.03 -1.26 -4.88 118.70 113.38 2b39 s GLU 933 Ca 0.66 0.11 0.00 0.00 0.03 0.00 0.00 54.97 55.78 2b39 s GLU 933 Cb -0.19 -1.59 0.00 0.00 -0.80 0.00 0.00 34.13 31.55 2b39 s GLU 933 CO 0.36 -3.67 0.00 0.41 -1.33 0.00 0.00 175.26 171.03 2b39 n GLY 934 N -0.62 -2.79 3.84 -3.83 0.00 -1.26 -4.82 105.19 95.72 2b39 n GLY 934 Ca 0.11 -1.30 -0.32 0.00 0.00 0.00 0.00 46.02 44.51 2b39 n GLY 934 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2b39 s VAL 935 N -3.31 4.55 -0.71 1.61 -7.23 -0.48 -4.80 120.40 110.02 2b39 s VAL 935 Ca 0.00 1.18 -0.20 0.00 -1.81 0.00 0.00 61.98 61.15 2b39 s VAL 935 Cb 0.00 -3.71 0.10 0.00 0.56 0.00 0.00 36.38 33.33 2b39 s VAL 935 CO 0.00 -0.62 0.92 -0.60 -0.31 0.00 0.00 175.10 174.49 2b39 s ARG 936 N -3.93 3.23 0.02 4.82 3.52 -1.26 -1.09 118.95 124.25 2b39 s ARG 936 Ca 0.58 -1.27 -0.25 0.00 -0.13 0.00 0.00 55.73 54.66 2b39 s ARG 936 Cb -0.10 -4.41 -0.05 0.00 -1.56 0.00 0.00 34.95 28.83 2b39 s ARG 936 CO 0.29 -1.70 0.77 0.08 -0.81 0.00 0.00 175.30 173.93 2b39 s VAL 937 N 3.17 4.81 -0.54 7.11 1.01 -0.53 -4.94 120.40 130.48 2b39 s VAL 937 Ca 0.21 1.63 0.07 0.00 0.00 0.00 0.00 61.98 63.89 2b39 s VAL 937 Cb -0.16 -4.12 0.29 0.00 0.00 0.00 0.00 36.38 32.40 2b39 s VAL 937 CO 0.03 0.32 0.78 -3.20 0.00 0.00 0.00 175.10 173.04 2b39 n ASN 938 N 3.11 3.06 -4.65 3.32 2.85 -1.26 -0.64 115.26 121.05 2b39 n ASN 938 Ca -0.01 -3.35 -0.43 0.00 -0.11 0.00 0.00 54.58 50.68 2b39 n ASN 938 Cb 0.50 -0.62 -0.03 0.00 1.24 0.00 0.00 39.78 40.88 2b39 n ASN 938 CO 0.00 0.00 0.00 -0.75 -2.11 0.00 0.00 177.26 174.40 2b39 s LYS 939 N -2.62 4.09 -0.03 1.20 2.20 -0.93 -4.00 119.74 119.65 2b39 s LYS 939 Ca 0.42 1.98 -0.30 0.00 -0.36 0.00 0.00 55.97 57.72 2b39 s LYS 939 Cb 0.22 -3.97 -0.03 0.00 -1.51 0.00 0.00 37.83 32.55 2b39 s LYS 939 CO -0.08 -0.94 1.00 -0.08 -0.36 0.00 0.00 175.35 174.90 2b39 s THR 940 N 4.25 4.79 -0.08 3.43 -1.32 -1.26 -1.55 115.64 123.90 2b39 s THR 940 Ca 0.70 2.02 0.07 0.00 -1.21 0.00 0.00 61.69 63.27 2b39 s THR 940 Cb -0.30 -4.29 -0.24 0.00 -1.51 0.00 0.00 72.50 66.16 2b39 s THR 940 CO 0.27 0.10 0.52 0.52 -2.21 0.00 0.00 174.62 173.83 2b39 n VAL 941 N 4.14 1.65 -3.56 5.08 0.31 0.63 -4.93 118.33 121.64 2b39 n VAL 941 Ca 0.07 -0.75 -0.12 0.00 -0.01 0.00 0.00 64.34 63.53 2b39 n VAL 941 Cb 0.50 -1.23 -0.05 0.00 -0.91 0.00 0.00 33.84 32.15 2b39 n VAL 941 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2b39 s ALA 942 N -2.58 -1.90 -0.18 3.52 0.00 -0.90 -4.86 121.76 114.86 2b39 s ALA 942 Ca -0.11 1.52 -0.04 0.00 0.00 0.00 0.00 51.96 53.33 2b39 s ALA 942 Cb 0.07 -0.55 0.09 0.00 0.00 0.00 0.00 23.12 22.73 2b39 s ALA 942 CO 0.80 -0.33 0.27 0.08 0.00 0.00 0.00 175.76 176.58 2b39 s VAL 943 N -1.20 -0.42 0.01 0.00 1.01 -1.26 0.45 120.40 118.97 2b39 s VAL 943 Ca -0.03 0.07 0.01 0.00 0.00 0.00 0.00 61.98 62.03 2b39 s VAL 943 Cb -0.00 -0.60 -0.01 0.00 0.00 0.00 0.00 36.38 35.77 2b39 s VAL 943 CO 0.03 -0.04 -0.04 -0.13 0.00 0.00 0.00 175.10 174.91 2b39 s ARG 944 N 2.42 0.34 0.42 2.72 0.52 0.05 -4.86 118.95 120.54 2b39 s ARG 944 Ca 0.05 -0.26 -0.20 0.00 -0.52 0.00 0.00 55.73 54.80 2b39 s ARG 944 Cb -0.14 -0.26 -0.10 0.00 0.52 0.00 0.00 34.95 34.96 2b39 s ARG 944 CO -0.11 0.07 0.92 -0.08 0.02 0.00 0.00 175.30 176.11 2b39 s THR 945 N -0.38 4.45 -0.39 0.02 -1.32 -1.26 -1.09 115.64 115.66 2b39 s THR 945 Ca -0.02 1.38 -0.05 0.00 -1.21 0.00 0.00 61.69 61.80 2b39 s THR 945 Cb -0.03 -3.61 0.08 0.00 -1.51 0.00 0.00 72.50 67.43 2b39 s THR 945 CO -0.00 -0.32 0.18 -0.76 -2.21 0.00 0.00 174.62 171.50 2b39 s LEU 946 N -3.20 4.89 -0.42 9.08 1.43 -0.31 -4.86 118.68 125.28 2b39 s LEU 946 Ca 0.60 -1.65 0.06 0.00 -1.03 0.00 0.00 54.13 52.11 2b39 s LEU 946 Cb -0.09 -1.86 0.21 0.00 0.03 0.00 0.00 46.19 44.47 2b39 s LEU 946 CO 0.15 -0.47 0.48 -3.20 0.23 0.00 0.00 176.35 173.54 2b39 n ASN 947 N 4.72 -0.73 -0.46 2.29 2.85 -1.26 0.13 115.26 122.80 2b39 n ASN 947 Ca -0.08 -2.60 0.38 0.00 -0.11 0.00 0.00 54.58 52.17 2b39 n ASN 947 Cb 0.42 -0.18 0.67 0.00 1.24 0.00 0.00 39.78 41.93 2b39 n ASN 947 CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 2b39 h PRO 948 N 4.88 0.08 0.00 1.20 0.11 -1.75 0.42 132.00 136.94 2b39 h PRO 948 Ca 0.15 -0.00 -0.08 0.00 0.11 0.00 0.00 66.00 66.17 2b39 h PRO 948 Cb 0.93 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 32.01 2b39 h PRO 948 CO 0.36 0.05 -0.38 1.49 -0.21 0.00 0.00 178.00 179.31 2b39 h GLU 949 N 0.08 0.00 0.00 1.05 4.81 -1.84 -0.89 114.58 117.79 2b39 h GLU 949 Ca 0.82 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 60.05 2b39 h GLU 949 Cb 2.66 0.00 0.00 0.00 0.63 0.00 0.00 28.75 32.04 2b39 h GLU 949 CO -0.37 0.38 -0.69 1.58 -0.73 0.00 0.00 179.01 179.19 2b39 n HIS 950 N -3.43 0.00 0.18 0.92 -0.00 0.12 -4.60 115.22 108.41 2b39 n HIS 950 Ca 0.00 0.00 0.03 0.00 0.46 0.00 0.00 57.72 58.21 2b39 n HIS 950 Cb 0.55 -0.06 -0.03 0.00 -0.12 0.00 0.00 29.99 30.33 2b39 n HIS 950 CO 0.00 0.00 0.00 1.28 0.46 0.00 0.00 176.34 178.08 2b39 n LEU 951 N -1.37 0.18 -4.86 0.27 4.77 0.63 -5.03 117.00 111.59 2b39 n LEU 951 Ca 0.00 -0.37 -0.31 0.00 -0.03 0.00 0.00 56.01 55.30 2b39 n LEU 951 Cb 0.12 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.18 2b39 n LEU 951 CO 0.12 0.05 0.55 -0.83 -1.33 0.00 0.00 177.39 175.95 2b39 s GLY 952 N -1.79 2.00 -0.59 -0.72 0.00 -0.34 -4.76 107.32 101.11 2b39 s GLY 952 Ca 0.01 -0.03 -0.10 0.00 0.00 0.00 0.00 44.72 44.61 2b39 s GLY 952 CO 0.22 0.20 0.48 1.20 0.00 0.00 0.00 173.10 175.20 2b39 s GLN 953 N -3.95 2.81 -0.50 2.90 1.11 -0.30 -4.58 119.66 117.14 2b39 s GLN 953 Ca 0.55 -2.09 -0.02 0.00 0.01 0.00 0.00 55.36 53.81 2b39 s GLN 953 Cb -0.10 -4.04 -0.02 0.00 -1.01 0.00 0.00 33.01 27.84 2b39 s GLN 953 CO 0.31 -1.23 0.45 0.41 0.01 0.00 0.00 175.29 175.25 2b39 n GLY 954 N 4.42 -0.52 4.27 3.09 0.00 -1.26 -3.76 105.19 111.43 2b39 n GLY 954 Ca -0.00 0.19 0.00 0.00 0.00 0.00 0.00 46.02 46.21 2b39 n GLY 954 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2b39 n GLY 955 N -1.39 1.93 3.51 -0.02 0.00 -1.26 -4.96 105.19 103.00 2b39 n GLY 955 Ca -0.02 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.66 2b39 n GLY 955 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2b39 s VAL 956 N -0.23 3.74 -0.53 1.61 1.01 -1.25 -4.37 120.40 120.39 2b39 s VAL 956 Ca 0.00 -0.43 -0.01 0.00 0.00 0.00 0.00 61.98 61.54 2b39 s VAL 956 Cb 0.00 -2.60 0.14 0.00 0.00 0.00 0.00 36.38 33.92 2b39 s VAL 956 CO 0.00 0.53 0.32 -1.58 0.00 0.00 0.00 175.10 174.37 2b39 s GLN 957 N -0.02 2.24 0.32 2.72 0.74 -0.62 -1.15 119.66 123.89 2b39 s GLN 957 Ca 0.00 -2.31 -0.23 0.00 0.05 0.00 0.00 55.36 52.87 2b39 s GLN 957 Cb -0.13 -3.59 -0.10 0.00 1.10 0.00 0.00 33.01 30.29 2b39 s GLN 957 CO 0.03 -1.12 0.88 1.03 -0.55 0.00 0.00 175.29 175.56 2b39 s ARG 958 N 0.29 4.38 -0.04 1.67 3.00 -1.26 -1.91 118.95 125.08 2b39 s ARG 958 Ca 0.14 1.12 -0.00 0.00 0.00 0.00 0.00 55.73 56.99 2b39 s ARG 958 Cb -0.22 -2.65 0.03 0.00 0.00 0.00 0.00 34.95 32.11 2b39 s ARG 958 CO -0.03 0.23 0.01 -1.21 0.00 0.00 0.00 175.30 174.30 2b39 s GLU 959 N -2.35 0.27 -0.46 3.54 0.41 0.11 -4.97 118.70 115.24 2b39 s GLU 959 Ca 0.51 0.13 -0.09 0.00 -0.41 0.00 0.00 54.97 55.12 2b39 s GLU 959 Cb -0.15 -0.55 0.11 0.00 -1.78 0.00 0.00 34.13 31.76 2b39 s GLU 959 CO 0.20 -0.19 0.33 -2.00 -0.49 0.00 0.00 175.26 173.12 2b39 s GLU 960 N 1.35 2.49 0.09 1.61 -6.30 -1.26 0.22 118.70 116.90 2b39 s GLU 960 Ca -0.05 -1.72 -0.28 0.00 -2.50 0.00 0.00 54.97 50.41 2b39 s GLU 960 Cb -0.13 -3.91 -0.06 0.00 0.00 0.00 0.00 34.13 30.03 2b39 s GLU 960 CO -0.02 -1.16 0.89 0.08 0.02 0.00 0.00 175.26 175.07 2b39 s VAL 961 N 1.37 4.56 0.23 3.70 1.01 -0.68 -4.98 120.40 125.62 2b39 s VAL 961 Ca 0.05 1.92 0.02 0.00 0.00 0.00 0.00 61.98 63.98 2b39 s VAL 961 Cb -0.26 -4.25 0.04 0.00 0.00 0.00 0.00 36.38 31.91 2b39 s VAL 961 CO -0.00 0.34 0.31 -0.81 0.00 0.00 0.00 175.10 174.94 2b39 n PRO 962 N 2.73 0.65 -3.46 2.72 -0.04 -1.26 -0.77 135.00 135.57 2b39 n PRO 962 Ca 0.00 -1.05 -0.38 0.00 -0.04 0.00 0.00 63.50 62.04 2b39 n PRO 962 Cb 0.49 -0.15 -0.06 0.00 -0.04 0.00 0.00 33.50 33.75 2b39 n PRO 962 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2b39 s ALA 963 N -2.52 3.68 0.12 0.55 0.00 -1.26 -4.39 121.76 117.94 2b39 s ALA 963 Ca 0.22 -0.19 -0.30 0.00 0.00 0.00 0.00 51.96 51.69 2b39 s ALA 963 Cb -0.02 -2.42 -0.07 0.00 0.00 0.00 0.00 23.12 20.61 2b39 s ALA 963 CO 0.14 0.47 1.21 0.00 0.00 0.00 0.00 175.76 177.59 2b39 s ALA 964 N -1.13 3.43 -1.22 0.00 0.00 -1.26 -4.92 121.76 116.66 2b39 s ALA 964 Ca 0.26 0.92 -0.21 0.00 0.00 0.00 0.00 51.96 52.92 2b39 s ALA 964 Cb -0.17 -3.44 -0.03 0.00 0.00 0.00 0.00 23.12 19.48 2b39 s ALA 964 CO 0.15 -0.42 1.87 0.34 0.00 0.00 0.00 175.76 177.70 2b39 s ASP 965 N 0.62 5.63 -0.37 0.00 2.15 -1.26 -4.77 116.67 118.67 2b39 s ASP 965 Ca 0.56 -1.91 -0.03 0.00 0.43 0.00 0.00 52.55 51.61 2b39 s ASP 965 Cb -0.32 -2.59 0.11 0.00 -0.30 0.00 0.00 42.92 39.83 2b39 s ASP 965 CO 0.33 -2.45 2.49 0.18 -0.17 0.00 0.00 175.17 175.55 2b39 n LEU 966 N 12.39 6.41 0.25 -1.34 4.77 -1.26 -4.52 117.00 133.70 2b39 n LEU 966 Ca 0.46 -3.68 0.17 0.00 -0.03 0.00 0.00 56.01 52.93 2b39 n LEU 966 Cb 0.46 -1.17 0.71 0.00 -2.33 0.00 0.00 43.42 41.09 2b39 n LEU 966 CO 0.71 1.51 0.99 0.77 -1.33 0.00 0.00 177.39 180.03 2b39 h SER 967 N 2.32 0.00 -0.42 -1.43 4.64 -2.00 -3.10 113.55 113.56 2b39 h SER 967 Ca 0.34 0.00 -0.24 0.00 -0.47 0.00 0.00 61.79 61.41 2b39 h SER 967 Cb 0.85 0.00 -0.15 0.00 -0.31 0.00 0.00 62.40 62.79 2b39 h SER 967 CO 0.79 0.00 -0.14 -0.90 -0.87 0.00 0.00 176.83 175.71 2b39 n ASP 968 N -2.91 2.98 -4.75 4.97 3.85 -1.26 -5.00 116.55 114.43 2b39 n ASP 968 Ca 0.00 -3.80 -0.39 0.00 -0.71 0.00 0.00 54.79 49.89 2b39 n ASP 968 Cb 0.26 -0.62 -0.05 0.00 -1.35 0.00 0.00 41.12 39.36 2b39 n ASP 968 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 2b39 s GLN 969 N -3.33 4.36 -0.41 0.11 -2.07 -1.17 -1.63 119.66 115.51 2b39 s GLN 969 Ca 0.46 0.78 -0.36 0.00 -1.82 0.00 0.00 55.36 54.42 2b39 s GLN 969 Cb 0.41 -3.36 -0.13 0.00 -1.09 0.00 0.00 33.01 28.84 2b39 s GLN 969 CO -0.00 0.30 2.21 0.28 -1.32 0.00 0.00 175.29 176.76 2b39 n VAL 970 N 2.93 0.14 0.00 3.63 0.31 0.36 -4.84 118.33 120.86 2b39 n VAL 970 Ca -0.05 -0.22 0.00 0.00 -0.01 0.00 0.00 64.34 64.06 2b39 n VAL 970 Cb 0.51 -1.43 0.00 0.00 -0.91 0.00 0.00 33.84 32.01 2b39 n VAL 970 CO 0.00 0.00 0.00 -2.65 -1.32 0.00 0.00 176.83 172.86 2b39 n PRO 971 N 8.12 0.00 0.00 5.55 -0.02 -1.26 -0.78 135.00 146.60 2b39 n PRO 971 Ca 0.45 0.00 0.12 0.00 -2.02 0.00 0.00 63.50 62.04 2b39 n PRO 971 Cb 0.18 0.00 0.13 0.00 -0.02 0.00 0.00 33.50 33.80 2b39 n PRO 971 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 2b39 n ASP 972 N -3.73 1.82 -4.82 2.55 2.03 -1.26 -4.97 116.55 108.18 2b39 n ASP 972 Ca 0.00 -1.39 -0.32 0.00 0.52 0.00 0.00 54.79 53.60 2b39 n ASP 972 Cb 0.00 0.32 0.01 0.00 -0.72 0.00 0.00 41.12 40.73 2b39 n ASP 972 CO 0.00 0.00 0.00 0.42 -1.92 0.00 0.00 177.20 175.70 2b39 s THR 973 N -2.42 4.02 0.00 5.18 -4.23 0.04 -5.08 115.64 113.15 2b39 s THR 973 Ca 0.22 0.89 0.00 0.00 -1.18 0.00 0.00 61.69 61.61 2b39 s THR 973 Cb 0.19 -3.47 0.00 0.00 1.34 0.00 0.00 72.50 70.56 2b39 s THR 973 CO 0.52 -0.63 0.00 -0.62 -0.54 0.00 0.00 174.62 173.35 2b39 n GLU 974 N -2.19 1.39 -3.64 3.99 1.02 -1.26 -4.93 120.64 115.01 2b39 n GLU 974 Ca 0.08 0.00 -0.09 0.00 -0.02 0.00 0.00 57.16 57.13 2b39 n GLU 974 Cb 0.53 0.00 -0.07 0.00 -0.02 0.00 0.00 31.44 31.88 2b39 n GLU 974 CO 0.00 0.00 0.00 -1.54 1.18 0.00 0.00 177.13 176.77 2b39 s SER 975 N -1.00 -0.75 -0.11 1.62 1.04 -1.26 -4.37 113.70 108.87 2b39 s SER 975 Ca 0.00 1.31 0.03 0.00 0.48 0.00 0.00 55.95 57.77 2b39 s SER 975 Cb 0.00 1.32 0.01 0.00 0.10 0.00 0.00 66.02 67.45 2b39 s SER 975 CO 0.00 -0.22 -0.21 -0.70 0.98 0.00 0.00 173.24 173.09 2b39 s GLU 976 N 0.94 2.82 -0.28 4.02 2.12 -0.64 -4.36 118.70 123.32 2b39 s GLU 976 Ca -0.04 -0.79 -0.01 0.00 0.36 0.00 0.00 54.97 54.49 2b39 s GLU 976 Cb -0.05 -2.21 0.05 0.00 0.26 0.00 0.00 34.13 32.18 2b39 s GLU 976 CO -0.10 0.08 -0.03 -0.08 -0.54 0.00 0.00 175.26 174.59 2b39 s THR 977 N 0.59 2.80 -0.07 -1.70 -1.32 0.78 -0.32 115.64 116.39 2b39 s THR 977 Ca -0.14 -1.38 -0.20 0.00 -1.21 0.00 0.00 61.69 58.77 2b39 s THR 977 Cb -0.17 -2.58 -0.04 0.00 -1.51 0.00 0.00 72.50 68.20 2b39 s THR 977 CO 0.04 -0.04 0.57 -0.54 -2.21 0.00 0.00 174.62 172.45 2b39 s LYS 978 N 1.23 4.36 -0.22 7.08 1.02 -0.61 -2.27 119.74 130.34 2b39 s LYS 978 Ca -0.05 0.65 -0.05 0.00 0.02 0.00 0.00 55.97 56.54 2b39 s LYS 978 Cb -0.19 -3.41 -0.02 0.00 -0.52 0.00 0.00 37.83 33.68 2b39 s LYS 978 CO -0.02 0.19 0.00 0.42 -0.92 0.00 0.00 175.35 175.01 2b39 s ILE 979 N 0.46 3.83 -0.07 2.17 1.01 0.39 -2.15 121.20 126.84 2b39 s ILE 979 Ca 0.31 -0.34 0.01 0.00 0.00 0.00 0.00 60.65 60.62 2b39 s ILE 979 Cb -0.17 -2.75 0.02 0.00 0.01 0.00 0.00 42.46 39.57 2b39 s ILE 979 CO 0.14 0.40 -0.08 -0.22 0.00 0.00 0.00 174.94 175.19 2b39 s LEU 980 N 1.33 1.37 0.01 2.97 2.96 -1.04 -0.99 118.68 125.29 2b39 s LEU 980 Ca 0.04 -0.23 -0.00 0.00 -0.22 0.00 0.00 54.13 53.72 2b39 s LEU 980 Cb -0.15 -0.69 -0.04 0.00 0.50 0.00 0.00 46.19 45.82 2b39 s LEU 980 CO 0.01 -0.04 0.09 -0.76 -1.32 0.00 0.00 176.35 174.33 2b39 s LEU 981 N 1.07 3.94 -0.03 -0.68 1.43 -1.07 -2.51 118.68 120.83 2b39 s LEU 981 Ca -0.08 0.14 0.01 0.00 -1.03 0.00 0.00 54.13 53.18 2b39 s LEU 981 Cb -0.14 -2.36 0.01 0.00 0.03 0.00 0.00 46.19 43.73 2b39 s LEU 981 CO -0.01 0.25 -0.05 -1.10 0.23 0.00 0.00 176.35 175.68 2b39 s GLN 982 N -1.88 0.70 0.50 1.70 -0.21 -0.11 -3.10 119.66 117.26 2b39 s GLN 982 Ca 0.25 -0.13 0.29 0.00 0.02 0.00 0.00 55.36 55.79 2b39 s GLN 982 Cb -0.12 -0.71 1.09 0.00 1.00 0.00 0.00 33.01 34.27 2b39 s GLN 982 CO 0.16 -0.02 1.88 0.78 -2.12 0.00 0.00 175.29 175.97 2b39 h GLY 983 N 6.84 0.00 -4.94 3.09 0.00 -1.57 -1.98 103.07 104.50 2b39 h GLY 983 Ca -0.36 0.00 -0.17 0.00 0.00 0.00 0.00 47.33 46.80 2b39 h GLY 983 CO 0.48 0.00 -0.65 -0.51 0.00 0.00 0.00 176.54 175.86 2b39 s THR 984 N -3.60 0.10 -1.53 4.70 -4.23 -1.26 -4.12 115.64 105.70 2b39 s THR 984 Ca 0.02 -0.83 0.10 0.00 -1.18 0.00 0.00 61.69 59.79 2b39 s THR 984 Cb 0.09 -0.29 0.20 0.00 1.34 0.00 0.00 72.50 73.83 2b39 s THR 984 CO 0.59 -0.46 1.19 -0.81 -0.54 0.00 0.00 174.62 174.59 2b39 n PRO 985 N 1.60 0.18 -0.07 3.99 -0.04 -1.26 -2.15 135.00 137.25 2b39 n PRO 985 Ca -0.23 0.16 0.04 0.00 -0.04 0.00 0.00 63.50 63.42 2b39 n PRO 985 Cb 0.55 -1.50 0.07 0.00 -0.04 0.00 0.00 33.50 32.58 2b39 n PRO 985 CO 0.00 0.00 0.00 1.55 -0.04 0.00 0.00 175.50 177.01 2b39 n VAL 986 N -1.23 0.52 0.00 0.52 3.14 -1.26 -4.80 118.33 115.22 2b39 n VAL 986 Ca 0.05 -0.76 0.00 0.00 -2.96 0.00 0.00 64.34 60.67 2b39 n VAL 986 Cb 0.07 0.82 0.00 0.00 -1.06 0.00 0.00 33.84 33.67 2b39 n VAL 986 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 2b39 n ALA 987 N 0.32 -0.00 -0.30 1.55 0.00 -0.91 -1.58 120.51 119.58 2b39 n ALA 987 Ca 0.06 0.00 -0.08 0.00 0.00 0.00 0.00 53.44 53.43 2b39 n ALA 987 Cb 0.29 0.06 -0.07 0.00 0.00 0.00 0.00 19.45 19.72 2b39 n ALA 987 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44 2b39 n GLN 988 N -0.62 -0.32 -0.14 0.00 0.00 -1.26 -1.55 117.38 113.49 2b39 n GLN 988 Ca 0.00 1.29 -0.08 0.00 -0.00 0.00 0.00 57.00 58.21 2b39 n GLN 988 Cb 0.00 -1.90 -0.02 0.00 0.00 0.00 0.00 30.24 28.32 2b39 n GLN 988 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 177.06 177.58 2b39 h MET 989 N 0.00 -0.25 -0.47 3.69 2.86 -1.88 -0.98 114.93 117.89 2b39 h MET 989 Ca 0.12 0.02 -0.04 0.00 -2.06 0.00 0.00 59.70 57.73 2b39 h MET 989 Cb 0.30 0.06 -0.02 0.00 0.06 0.00 0.00 31.60 31.99 2b39 h MET 989 CO -0.68 -0.17 0.11 1.79 1.06 0.00 0.00 176.91 179.03 2b39 h THR 990 N -0.26 1.21 0.46 2.22 1.35 -0.64 -0.95 112.91 116.30 2b39 h THR 990 Ca 0.17 -0.75 -0.02 0.00 -0.55 0.00 0.00 66.41 65.26 2b39 h THR 990 Cb 0.56 0.73 0.00 0.00 -1.73 0.00 0.00 68.15 67.71 2b39 h THR 990 CO -0.58 0.28 -0.22 -0.08 -0.25 0.00 0.00 175.52 174.66 2b39 h GLU 991 N 0.70 -0.59 -0.98 4.72 4.81 -0.18 -2.75 114.58 120.31 2b39 h GLU 991 Ca 0.16 0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.43 2b39 h GLU 991 Cb 0.27 0.13 0.00 0.00 0.63 0.00 0.00 28.75 29.78 2b39 h GLU 991 CO -0.00 -0.39 0.00 -0.40 -0.73 0.00 0.00 179.01 177.48 2b39 n ASP 992 N -3.87 1.24 -0.02 1.04 5.75 -0.49 -2.09 116.55 118.11 2b39 n ASP 992 Ca -0.08 -1.94 0.08 0.00 -0.01 0.00 0.00 54.79 52.85 2b39 n ASP 992 Cb 0.24 -0.48 -0.09 0.00 -1.03 0.00 0.00 41.12 39.76 2b39 n ASP 992 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2b39 n ALA 993 N 0.09 4.14 -0.09 2.12 0.00 -0.36 -1.51 120.51 124.89 2b39 n ALA 993 Ca 0.00 -0.48 -0.13 0.00 0.00 0.00 0.00 53.44 52.83 2b39 n ALA 993 Cb 0.28 -0.61 -0.14 0.00 0.00 0.00 0.00 19.45 18.98 2b39 n ALA 993 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 2b39 n ILE 994 N -1.33 1.48 -2.00 0.00 5.41 -0.89 -4.42 119.36 117.61 2b39 n ILE 994 Ca 0.03 -0.75 -0.42 0.00 1.00 0.00 0.00 62.75 62.61 2b39 n ILE 994 Cb 0.26 -0.92 -0.03 0.00 -0.71 0.00 0.00 39.64 38.25 2b39 n ILE 994 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 176.55 175.93 2b39 s ASP 995 N -5.99 6.54 0.32 4.38 -1.08 -1.21 -4.69 116.67 114.93 2b39 s ASP 995 Ca -0.18 2.10 0.09 0.00 -0.52 0.00 0.00 52.55 54.04 2b39 s ASP 995 Cb 0.07 -2.53 0.88 0.00 -1.46 0.00 0.00 42.92 39.88 2b39 s ASP 995 CO 0.76 -1.05 1.73 1.23 0.52 0.00 0.00 175.17 178.36 2b39 h GLY 996 N 10.79 1.90 0.84 2.66 0.00 -1.91 0.50 103.07 117.85 2b39 h GLY 996 Ca -0.38 -0.31 0.00 0.00 0.00 0.00 0.00 47.33 46.63 2b39 h GLY 996 CO 0.96 -0.23 -1.02 1.18 0.00 0.00 0.00 176.54 177.44 2b39 n GLU 997 N -4.88 0.46 0.07 4.80 -0.58 -1.26 -4.16 120.64 115.10 2b39 n GLU 997 Ca 0.27 0.05 -0.19 0.00 -0.42 0.00 0.00 57.16 56.88 2b39 n GLU 997 Cb 0.73 -1.71 -0.14 0.00 -0.57 0.00 0.00 31.44 29.75 2b39 n GLU 997 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2b39 h ARG 998 N 0.00 0.30 -0.82 3.49 2.47 -1.53 -3.37 114.38 114.92 2b39 h ARG 998 Ca 0.00 -0.51 0.20 0.00 -1.26 0.00 0.00 59.98 58.41 2b39 h ARG 998 Cb 0.88 0.19 -0.13 0.00 -1.65 0.00 0.00 29.97 29.25 2b39 h ARG 998 CO 0.00 1.18 0.16 1.25 0.56 0.00 0.00 179.97 183.12 2b39 h LEU 999 N 0.08 -0.09 0.00 3.04 5.85 0.16 0.41 115.31 124.76 2b39 h LEU 999 Ca -0.26 0.19 0.00 0.00 0.84 0.00 0.00 57.88 58.64 2b39 h LEU 999 Cb 2.04 0.27 0.00 0.00 0.37 0.00 0.00 40.66 43.35 2b39 h LEU 999 CO 0.17 -0.14 0.00 1.17 -0.34 0.00 0.00 178.44 179.31 2b39 n LYS 1000N -5.24 0.53 -0.33 1.25 4.81 -1.26 -2.82 118.16 115.09 2b39 n LYS 1000Ca 0.18 0.00 0.08 0.00 -0.87 0.00 0.00 58.31 57.70 2b39 n LYS 1000Cb 0.58 -1.22 0.22 0.00 0.02 0.00 0.00 35.03 34.63 2b39 n LYS 1000CO 0.00 0.00 0.00 0.72 1.17 0.00 0.00 177.40 179.29 2b39 n HIS 1001N -0.72 0.69 -0.06 5.64 8.25 0.15 -4.50 115.22 124.67 2b39 n HIS 1001Ca 0.06 -0.85 -0.02 0.00 -0.26 0.00 0.00 57.72 56.65 2b39 n HIS 1001Cb 0.03 -0.25 -0.01 0.00 1.12 0.00 0.00 29.99 30.88 2b39 n HIS 1001CO 0.00 0.00 0.00 -0.07 0.64 0.00 0.00 176.34 176.91 2b39 h LEU 1002N 1.43 0.00-10.15 2.41 3.38 -1.64 -3.46 115.31 107.28 2b39 h LEU 1002Ca 0.00 -0.03 -0.55 0.00 0.09 0.00 0.00 57.88 57.40 2b39 h LEU 1002Cb 1.26 0.00 0.16 0.00 0.09 0.00 0.00 40.66 42.17 2b39 h LEU 1002CO 0.15 0.58 0.44 -0.63 0.09 0.00 0.00 178.44 179.06 2b39 s ILE 1003N -1.73 2.10 -0.11 1.22 -1.09 -1.26 -4.55 121.20 115.78 2b39 s ILE 1003Ca -0.04 0.05 0.08 0.00 -2.23 0.00 0.00 60.65 58.51 2b39 s ILE 1003Cb 0.00 -2.77 -0.11 0.00 -1.58 0.00 0.00 42.46 38.01 2b39 s ILE 1003CO 0.07 -0.02 0.21 1.67 -1.23 0.00 0.00 174.94 175.64 2b39 n GLN 1004N -2.50 1.55 -3.68 2.79 7.27 0.71 -5.00 117.38 118.53 2b39 n GLN 1004Ca 0.15 -0.05 -0.27 0.00 0.07 0.00 0.00 57.00 56.89 2b39 n GLN 1004Cb 0.49 -1.08 -0.03 0.00 2.41 0.00 0.00 30.24 32.03 2b39 n GLN 1004CO 0.00 0.00 0.00 0.95 0.07 0.00 0.00 177.06 178.08 2b39 s THR 1005N -2.28 5.20 0.39 1.69 -4.23 -1.24 -5.07 115.64 110.09 2b39 s THR 1005Ca -0.01 -0.35 -0.27 0.00 -1.18 0.00 0.00 61.69 59.88 2b39 s THR 1005Cb 0.05 -3.73 -0.09 0.00 1.34 0.00 0.00 72.50 70.07 2b39 s THR 1005CO 0.32 -0.18 1.33 -2.16 -0.54 0.00 0.00 174.62 173.38 2b39 s PRO 1006N -3.33 4.07 0.00 3.99 0.04 -1.26 -5.00 135.00 133.50 2b39 s PRO 1006Ca 0.39 2.22 0.00 0.00 0.04 0.00 0.00 61.00 63.65 2b39 s PRO 1006Cb -0.11 -2.85 0.00 0.00 0.04 0.00 0.00 34.50 31.58 2b39 s PRO 1006CO 0.29 -0.43 0.00 -1.13 0.04 0.00 0.00 177.00 175.77 2b39 n SER 1007N 0.31 0.00 -0.12 6.66 3.41 -1.26 -4.89 113.62 117.74 2b39 n SER 1007Ca 0.03 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.64 2b39 n SER 1007Cb 0.43 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.38 2b39 n SER 1007CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2b39 n GLY 1008N 5.00 1.13 3.59 5.00 0.00 -1.26 -4.85 105.19 113.80 2b39 n GLY 1008Ca 0.00 -0.25 -0.15 0.00 0.00 0.00 0.00 46.02 45.62 2b39 n GLY 1008CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2b39 n GLY 1010N 2.04 0.00 0.09 0.00 0.00 0.26 -1.61 105.19 105.98 2b39 n GLY 1010Ca -0.16 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.68 2b39 n GLY 1010CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2b39 h GLU 1011N 0.00 0.00 -0.75 1.61 4.22 -1.89 -3.39 114.58 114.38 2b39 h GLU 1011Ca 0.00 0.00 0.10 0.00 0.08 0.00 0.00 59.36 59.54 2b39 h GLU 1011Cb 0.00 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.20 2b39 h GLU 1011CO 0.00 0.91 0.49 1.96 -2.18 0.00 0.00 179.01 180.19 2b39 h GLN 1012N -1.00 0.62 0.00 1.92 7.50 -1.67 -1.14 115.11 121.35 2b39 h GLN 1012Ca -0.23 -0.04 0.00 0.00 0.50 0.00 0.00 58.65 58.88 2b39 h GLN 1012Cb 1.14 -0.14 0.00 0.00 0.05 0.00 0.00 27.48 28.53 2b39 h GLN 1012CO -0.14 0.41 0.00 -0.97 -1.50 0.00 0.00 178.83 176.63 2b39 h ASN 1013N 0.64 0.00 0.02 1.46 -1.24 -1.50 -2.05 115.58 112.90 2b39 h ASN 1013Ca 0.35 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.36 2b39 h ASN 1013Cb 0.50 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.55 2b39 h ASN 1013CO -0.13 0.00 0.00 0.23 -1.29 0.00 0.00 177.43 176.24 2b39 n MET 1014N -2.54 0.28 0.27 6.67 2.81 -0.43 -1.93 117.12 122.26 2b39 n MET 1014Ca -0.02 0.02 0.12 0.00 -1.81 0.00 0.00 57.70 56.01 2b39 n MET 1014Cb 0.05 -1.50 0.75 0.00 -0.71 0.00 0.00 33.22 31.80 2b39 n MET 1014CO 0.00 0.00 0.00 0.97 1.51 0.00 0.00 175.97 178.45 2b39 h ILE 1015N 0.00 0.72 -0.71 2.02 2.10 -1.59 -1.04 117.51 119.00 2b39 h ILE 1015Ca 0.00 -0.28 0.07 0.00 1.08 0.00 0.00 64.86 65.74 2b39 h ILE 1015Cb 0.01 1.16 -0.06 0.00 -1.09 0.00 0.00 36.82 36.84 2b39 h ILE 1015CO 0.00 0.07 0.38 1.23 -1.08 0.00 0.00 178.15 178.75 2b39 h GLY 1016N 0.35 1.06 0.00 8.18 0.00 -1.66 -3.40 103.07 107.60 2b39 h GLY 1016Ca -0.00 -0.26 0.00 0.00 0.00 0.00 0.00 47.33 47.07 2b39 h GLY 1016CO 0.01 0.13 -0.06 1.03 0.00 0.00 0.00 176.54 177.65 2b39 n MET 1017N -4.80 0.03 -0.08 4.80 2.81 -0.46 -4.48 117.12 114.94 2b39 n MET 1017Ca 0.10 0.01 -0.02 0.00 -1.81 0.00 0.00 57.70 55.98 2b39 n MET 1017Cb 0.22 -0.54 -0.02 0.00 -0.71 0.00 0.00 33.22 32.16 2b39 n MET 1017CO 0.00 0.00 0.00 2.41 1.51 0.00 0.00 175.97 179.89 2b39 n THR 1018N -2.61 -0.14 0.26 2.03 -1.04 -0.82 0.08 114.28 112.04 2b39 n THR 1018Ca -0.01 0.52 0.15 0.00 -2.04 0.00 0.00 64.05 62.67 2b39 n THR 1018Cb 0.03 -0.65 0.57 0.00 -1.82 0.00 0.00 70.33 68.46 2b39 n THR 1018CO 0.00 0.00 0.00 1.55 -0.64 0.00 0.00 175.07 175.98 2b39 h PRO 1019N 0.00 0.00 0.14 -2.82 0.13 -1.82 -2.62 132.00 125.02 2b39 h PRO 1019Ca 0.03 0.00 -0.27 0.00 -0.87 0.00 0.00 66.00 64.89 2b39 h PRO 1019Cb 0.08 0.00 0.01 0.00 0.13 0.00 0.00 31.00 31.22 2b39 h PRO 1019CO -0.19 0.06 -1.34 1.15 -0.23 0.00 0.00 178.00 177.46 2b39 h THR 1020N 0.00 1.13 -0.92 1.56 2.02 -0.57 -2.58 112.91 113.56 2b39 h THR 1020Ca -0.00 -2.46 0.17 0.00 0.77 0.00 0.00 66.41 64.89 2b39 h THR 1020Cb 0.63 2.84 -0.08 0.00 -1.74 0.00 0.00 68.15 69.80 2b39 h THR 1020CO 0.01 0.73 0.59 0.58 0.37 0.00 0.00 175.52 177.80 2b39 h VAL 1021N -0.24 0.77 0.00 3.16 2.07 -0.96 -0.20 116.25 120.85 2b39 h VAL 1021Ca -0.27 -0.22 -0.14 0.00 0.82 0.00 0.00 66.70 66.88 2b39 h VAL 1021Cb 1.80 0.08 -0.02 0.00 -1.52 0.00 0.00 31.29 31.62 2b39 h VAL 1021CO 0.10 0.12 -1.02 0.16 0.02 0.00 0.00 177.57 176.95 2b39 h ILE 1022N 0.64 0.70 -0.32 4.57 3.07 -1.55 -2.86 117.51 121.77 2b39 h ILE 1022Ca 0.48 -2.15 -0.04 0.00 1.55 0.00 0.00 64.86 64.70 2b39 h ILE 1022Cb 0.86 2.23 -0.01 0.00 -0.27 0.00 0.00 36.82 39.63 2b39 h ILE 1022CO -0.23 0.40 0.03 0.00 -1.05 0.00 0.00 178.15 177.30 2b39 h ALA 1023N 1.44 0.43 0.73 0.16 0.00 -0.67 -2.11 119.26 119.23 2b39 h ALA 1023Ca -0.09 -0.21 -0.04 0.00 0.00 0.00 0.00 54.91 54.57 2b39 h ALA 1023Cb 1.51 -0.12 0.01 0.00 0.00 0.00 0.00 17.79 19.19 2b39 h ALA 1023CO 0.06 0.15 -0.35 0.28 0.00 0.00 0.00 179.25 179.38 2b39 h VAL 1024N 0.36 0.00 -1.32 0.00 2.07 -1.23 -1.58 116.25 114.55 2b39 h VAL 1024Ca 0.09 -0.13 0.39 0.00 0.82 0.00 0.00 66.70 67.87 2b39 h VAL 1024Cb 0.39 0.00 -0.08 0.00 -1.52 0.00 0.00 31.29 30.08 2b39 h VAL 1024CO 0.01 0.00 0.92 0.45 0.02 0.00 0.00 177.57 178.97 2b39 h HIS 1025N -1.12 0.22 0.30 1.57 -0.00 -1.54 0.18 115.15 114.77 2b39 h HIS 1025Ca -0.10 0.01 -0.01 0.00 -0.00 0.00 0.00 60.37 60.26 2b39 h HIS 1025Cb 0.75 -0.06 0.00 0.00 -0.00 0.00 0.00 27.41 28.11 2b39 h HIS 1025CO 0.03 -0.02 -0.15 -0.92 -0.00 0.00 0.00 177.93 176.87 2b39 h TYR 1026N 0.09 -0.38 -0.91 2.45 3.20 -1.04 -0.45 116.97 119.93 2b39 h TYR 1026Ca 0.68 -0.01 0.12 0.00 3.14 0.00 0.00 58.73 62.67 2b39 h TYR 1026Cb 2.44 0.12 -0.07 0.00 1.54 0.00 0.00 36.73 40.76 2b39 h TYR 1026CO -0.00 -0.23 0.59 -0.07 -1.64 0.00 0.00 178.16 176.80 2b39 h LEU 1027N -0.71 0.76 0.24 2.82 3.38 -0.48 0.67 115.31 121.99 2b39 h LEU 1027Ca -0.04 0.04 -0.00 0.00 0.09 0.00 0.00 57.88 57.96 2b39 h LEU 1027Cb 0.31 -0.12 -0.03 0.00 0.09 0.00 0.00 40.66 40.92 2b39 h LEU 1027CO 0.07 0.41 -0.39 0.44 0.09 0.00 0.00 178.44 179.06 2b39 h ASP 1028N 0.81 -1.11 0.12 -0.43 5.19 -0.72 0.15 116.42 120.43 2b39 h ASP 1028Ca 0.45 0.10 0.00 0.00 -0.62 0.00 0.00 57.03 56.96 2b39 h ASP 1028Cb 0.57 0.39 0.00 0.00 0.18 0.00 0.00 39.33 40.47 2b39 h ASP 1028CO -0.21 -0.46 0.00 -0.24 -3.12 0.00 0.00 179.24 175.21 2b39 n SER 1029N -4.69 0.33 -0.00 6.45 2.88 -0.18 -2.14 113.62 116.27 2b39 n SER 1029Ca -0.08 0.64 0.00 0.00 -1.33 0.00 0.00 58.87 58.10 2b39 n SER 1029Cb 0.33 -0.69 0.00 0.00 -0.75 0.00 0.00 64.21 63.10 2b39 n SER 1029CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 175.04 174.16 2b39 n THR 1030N -1.93 0.97 -3.90 2.46 -2.24 0.06 -5.01 114.28 104.69 2b39 n THR 1030Ca -0.00 -0.98 -0.32 0.00 -2.27 0.00 0.00 64.05 60.47 2b39 n THR 1030Cb 0.05 0.51 0.01 0.00 -2.10 0.00 0.00 70.33 68.80 2b39 n THR 1030CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 2b39 n ASP 1031N -0.50 -4.58 -0.01 3.42 2.03 0.47 -4.89 116.55 112.49 2b39 n ASP 1031Ca 0.00 -1.09 0.01 0.00 0.52 0.00 0.00 54.79 54.23 2b39 n ASP 1031Cb 0.27 -1.62 0.01 0.00 -0.72 0.00 0.00 41.12 39.06 2b39 n ASP 1031CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2b39 n GLN 1032N -3.47 2.18 0.14 -0.67 6.02 -1.01 -4.73 117.38 115.84 2b39 n GLN 1032Ca -0.25 -1.34 0.12 0.00 -0.01 0.00 0.00 57.00 55.51 2b39 n GLN 1032Cb 0.65 -0.91 0.52 0.00 1.02 0.00 0.00 30.24 31.51 2b39 n GLN 1032CO 0.00 0.00 0.00 0.91 -1.01 0.00 0.00 177.06 176.96 2b39 n TRP 1033N -0.44 0.84 -0.33 1.08 8.01 -1.26 -2.39 117.44 122.94 2b39 n TRP 1033Ca 0.01 0.34 0.07 0.00 -1.31 0.00 0.00 57.50 56.62 2b39 n TRP 1033Cb 0.34 -1.06 0.24 0.00 -2.01 0.00 0.00 31.31 28.82 2b39 n TRP 1033CO 0.00 0.00 0.00 1.05 -1.01 0.00 0.00 177.69 177.73 2b39 h GLU 1034N 0.00 0.81 0.00 -0.99 4.11 -1.95 -0.44 114.58 116.11 2b39 h GLU 1034Ca 0.00 -0.05 -0.03 0.00 0.07 0.00 0.00 59.36 59.35 2b39 h GLU 1034Cb 0.32 -0.18 -0.00 0.00 0.50 0.00 0.00 28.75 29.38 2b39 h GLU 1034CO 0.00 0.53 -0.14 -0.22 0.07 0.00 0.00 179.01 179.25 2b39 h LYS 1035N 0.83 0.00 -5.89 1.06 3.11 -1.86 -3.43 116.57 110.39 2b39 h LYS 1035Ca 0.49 0.00 -0.64 0.00 -2.81 0.00 0.00 60.65 57.68 2b39 h LYS 1035Cb 0.58 0.00 -0.07 0.00 -1.00 0.00 0.00 32.23 31.74 2b39 h LYS 1035CO -0.31 0.14 -0.53 -0.06 -2.81 0.00 0.00 179.45 175.89 2b39 s PHE 1036N -4.65 3.44 0.33 1.91 0.40 -0.17 -5.05 117.98 114.19 2b39 s PHE 1036Ca -0.04 0.29 -0.19 0.00 -0.60 0.00 0.00 56.93 56.39 2b39 s PHE 1036Cb 0.16 -1.79 -0.14 0.00 0.51 0.00 0.00 43.02 41.76 2b39 s PHE 1036CO 0.67 0.61 0.12 0.41 0.70 0.00 0.00 175.22 177.74 2b39 n GLY 1037N 1.02 -2.28 0.36 4.36 0.00 -1.26 -4.74 105.19 102.65 2b39 n GLY 1037Ca -0.12 0.03 0.14 0.00 0.00 0.00 0.00 46.02 46.07 2b39 n GLY 1037CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2b39 h LEU 1038N 0.36 0.00 0.00 0.99 3.38 -1.91 -1.23 115.31 116.90 2b39 h LEU 1038Ca -0.31 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 57.55 2b39 h LEU 1038Cb 1.26 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.99 2b39 h LEU 1038CO 0.42 0.00 -2.04 -0.62 0.09 0.00 0.00 178.44 176.29 2b39 n GLU 1039N -2.99 0.71 -0.28 1.13 4.71 -1.26 -4.58 120.64 118.08 2b39 n GLU 1039Ca 0.02 -0.13 0.32 0.00 -0.01 0.00 0.00 57.16 57.35 2b39 n GLU 1039Cb 0.62 -1.48 0.50 0.00 -1.01 0.00 0.00 31.44 30.07 2b39 n GLU 1039CO 0.00 0.00 0.00 0.87 0.09 0.00 0.00 177.13 178.09 2b39 h LYS 1040N 0.00 0.00 0.00 3.49 1.79 -1.52 0.25 116.57 120.58 2b39 h LYS 1040Ca -0.16 0.00 -0.05 0.00 -2.18 0.00 0.00 60.65 58.26 2b39 h LYS 1040Cb 1.32 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 31.96 2b39 h LYS 1040CO 0.01 0.00 -0.30 -0.09 -1.08 0.00 0.00 179.45 177.98 2b39 h ARG 1041N 0.00 0.00 -0.21 3.15 2.43 -1.81 -2.90 114.38 115.04 2b39 h ARG 1041Ca 0.55 0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 59.70 2b39 h ARG 1041Cb 3.00 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 32.54 2b39 h ARG 1041CO -0.01 0.75 0.05 1.96 -1.51 0.00 0.00 179.97 181.22 2b39 h GLN 1042N -1.00 0.29 -0.75 0.20 1.08 -1.13 0.53 115.11 114.34 2b39 h GLN 1042Ca -0.07 -0.03 -0.03 0.00 -1.45 0.00 0.00 58.65 57.06 2b39 h GLN 1042Cb 0.85 -0.06 -0.03 0.00 -0.05 0.00 0.00 27.48 28.19 2b39 h GLN 1042CO -0.05 0.28 0.34 0.93 -0.95 0.00 0.00 178.83 179.39 2b39 h GLU 1043N 0.30 1.08 0.00 1.46 5.08 -0.75 -2.77 114.58 118.98 2b39 h GLU 1043Ca 0.07 -0.17 -0.19 0.00 -1.00 0.00 0.00 59.36 58.07 2b39 h GLU 1043Cb 0.12 -0.19 -0.02 0.00 0.50 0.00 0.00 28.75 29.15 2b39 h GLU 1043CO -0.00 0.86 -0.90 0.66 -1.00 0.00 0.00 179.01 178.62 2b39 h SER 1044N 1.05 0.03 -0.74 1.42 4.64 -1.04 -3.09 113.55 115.83 2b39 h SER 1044Ca 0.25 -0.03 0.09 0.00 -0.47 0.00 0.00 61.79 61.63 2b39 h SER 1044Cb 0.14 -0.01 -0.05 0.00 -0.31 0.00 0.00 62.40 62.17 2b39 h SER 1044CO -0.03 0.92 0.48 -0.07 -0.87 0.00 0.00 176.83 177.26 2b39 h LEU 1045N 0.01 0.61 -0.39 5.97 -0.00 -0.67 0.00 115.31 120.84 2b39 h LEU 1045Ca -0.02 0.01 -0.07 0.00 -0.00 0.00 0.00 57.88 57.81 2b39 h LEU 1045Cb 1.59 -0.12 -0.01 0.00 -0.00 0.00 0.00 40.66 42.12 2b39 h LEU 1045CO 0.12 0.37 -0.02 -0.33 -0.00 0.00 0.00 178.44 178.58 2b39 h GLU 1046N 0.68 0.71 -0.78 1.13 4.39 -1.43 -1.50 114.58 117.78 2b39 h GLU 1046Ca 0.33 -0.24 0.11 0.00 0.34 0.00 0.00 59.36 59.91 2b39 h GLU 1046Cb 0.41 -0.06 -0.08 0.00 -0.10 0.00 0.00 28.75 28.92 2b39 h GLU 1046CO -0.12 0.81 0.40 -0.07 -1.16 0.00 0.00 179.01 178.87 2b39 h LEU 1047N 0.53 0.51 -0.65 1.33 3.38 -0.95 0.17 115.31 119.63 2b39 h LEU 1047Ca 0.11 0.07 -0.14 0.00 0.09 0.00 0.00 57.88 58.01 2b39 h LEU 1047Cb 0.51 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 41.23 2b39 h LEU 1047CO 0.02 0.27 -0.48 0.40 0.09 0.00 0.00 178.44 178.74 2b39 h ILE 1048N 0.64 1.32 -0.52 1.22 2.04 -1.23 -0.66 117.51 120.31 2b39 h ILE 1048Ca 0.39 -1.70 -0.02 0.00 1.00 0.00 0.00 64.86 64.53 2b39 h ILE 1048Cb 0.46 1.71 -0.02 0.00 -0.74 0.00 0.00 36.82 38.23 2b39 h ILE 1048CO -0.30 0.53 0.24 0.03 0.00 0.00 0.00 178.15 178.65 2b39 h ARG 1049N 0.38 0.75 -0.31 2.37 3.08 0.06 0.08 114.38 120.79 2b39 h ARG 1049Ca 0.02 -0.11 -0.03 0.00 0.07 0.00 0.00 59.98 59.92 2b39 h ARG 1049Cb 0.99 -0.13 -0.01 0.00 0.08 0.00 0.00 29.97 30.89 2b39 h ARG 1049CO 0.09 0.63 0.08 -0.22 -1.07 0.00 0.00 179.97 179.47 2b39 h LYS 1050N 0.70 0.50 -0.98 0.04 3.64 -0.60 -1.82 116.57 118.03 2b39 h LYS 1050Ca 0.18 -0.12 0.08 0.00 -1.27 0.00 0.00 60.65 59.52 2b39 h LYS 1050Cb 0.13 -0.07 -0.07 0.00 -0.41 0.00 0.00 32.23 31.81 2b39 h LYS 1050CO -0.02 0.57 0.63 0.78 -2.27 0.00 0.00 179.45 179.14 2b39 h GLY 1051N 0.34 1.51 0.91 5.01 0.00 -0.76 -1.42 103.07 108.66 2b39 h GLY 1051Ca 0.10 -0.45 0.00 0.00 0.00 0.00 0.00 47.33 46.98 2b39 h GLY 1051CO 0.00 0.29 -0.09 -1.82 0.00 0.00 0.00 176.54 174.92 2b39 h TYR 1052N 1.10 -0.22 0.00 5.60 3.20 -0.56 -1.61 116.97 124.49 2b39 h TYR 1052Ca 0.44 0.00 0.03 0.00 3.14 0.00 0.00 58.73 62.34 2b39 h TYR 1052Cb 0.25 0.08 -0.06 0.00 1.54 0.00 0.00 36.73 38.55 2b39 h TYR 1052CO -0.00 -0.14 -0.46 1.15 -1.64 0.00 0.00 178.16 177.07 2b39 h THR 1053N -0.20 0.10 -0.63 1.81 2.02 -0.44 -1.65 112.91 113.91 2b39 h THR 1053Ca 0.00 0.00 0.09 0.00 0.77 0.00 0.00 66.41 67.27 2b39 h THR 1053Cb 0.19 0.10 -0.07 0.00 -1.74 0.00 0.00 68.15 66.63 2b39 h THR 1053CO -0.02 0.00 0.27 1.56 0.37 0.00 0.00 175.52 177.71 2b39 h GLN 1054N -0.61 0.47 -0.65 6.66 4.20 -1.33 -1.66 115.11 122.18 2b39 h GLN 1054Ca 0.04 -0.03 0.06 0.00 0.06 0.00 0.00 58.65 58.77 2b39 h GLN 1054Cb 0.68 -0.11 -0.04 0.00 0.30 0.00 0.00 27.48 28.32 2b39 h GLN 1054CO -0.33 0.31 0.43 0.37 -0.67 0.00 0.00 178.83 178.94 2b39 h GLN 1055N 0.48 0.66 -0.05 1.46 5.75 -0.74 0.13 115.11 122.80 2b39 h GLN 1055Ca 0.31 -0.04 0.02 0.00 -0.15 0.00 0.00 58.65 58.79 2b39 h GLN 1055Cb 0.35 -0.15 -0.00 0.00 1.07 0.00 0.00 27.48 28.75 2b39 h GLN 1055CO -0.28 0.44 0.06 -0.07 -2.65 0.00 0.00 178.83 176.33 2b39 h LEU 1056N 0.68 0.00 -1.84 -2.39 -0.00 -0.37 -2.12 115.31 109.28 2b39 h LEU 1056Ca 0.28 0.00 0.12 0.00 -0.00 0.00 0.00 57.88 58.28 2b39 h LEU 1056Cb 0.23 0.00 -0.03 0.00 -0.00 0.00 0.00 40.66 40.86 2b39 h LEU 1056CO -0.09 0.00 0.36 0.00 -0.00 0.00 0.00 178.44 178.72 2b39 h ALA 1057N 1.93 2.26 -0.01 1.53 0.00 -0.99 0.14 119.26 124.11 2b39 h ALA 1057Ca 0.02 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.92 2b39 h ALA 1057Cb 0.14 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.92 2b39 h ALA 1057CO -0.00 -0.39 -0.29 1.19 0.00 0.00 0.00 179.25 179.76 2b39 n PHE 1058N -4.44 0.00 -2.14 0.00 3.01 -0.80 -4.78 117.46 108.32 2b39 n PHE 1058Ca 0.09 0.00 -0.39 0.00 1.01 0.00 0.00 57.45 58.16 2b39 n PHE 1058Cb 0.47 -0.16 -0.03 0.00 -0.01 0.00 0.00 39.48 39.75 2b39 n PHE 1058CO 0.00 0.00 0.00 0.50 1.01 0.00 0.00 176.76 178.27 2b39 s ARG 1059N -2.60 2.81 1.23 -1.08 3.52 0.47 -3.03 118.95 120.26 2b39 s ARG 1059Ca 0.22 0.52 -0.19 0.00 -0.13 0.00 0.00 55.73 56.15 2b39 s ARG 1059Cb 0.19 -4.32 0.30 0.00 -1.56 0.00 0.00 34.95 29.55 2b39 s ARG 1059CO 0.55 -2.53 1.05 -0.65 -0.81 0.00 0.00 175.30 172.91 2b39 s GLN 1060N 6.64 -1.47 0.26 5.12 -0.21 -0.20 -4.88 119.66 124.93 2b39 s GLN 1060Ca 0.62 0.16 -0.01 0.00 0.02 0.00 0.00 55.36 56.15 2b39 s GLN 1060Cb -0.12 -1.55 0.54 0.00 1.00 0.00 0.00 33.01 32.88 2b39 s GLN 1060CO 0.21 -3.92 1.75 1.57 -2.12 0.00 0.00 175.29 172.78 2b39 h LYS 1061N -2.74 0.56 -0.87 2.91 -0.00 -1.93 -2.47 116.57 112.02 2b39 h LYS 1061Ca -0.48 -0.03 0.00 0.00 -0.00 0.00 0.00 60.65 60.14 2b39 h LYS 1061Cb 1.32 -0.13 0.00 0.00 -0.00 0.00 0.00 32.23 33.42 2b39 h LYS 1061CO 0.38 0.37 0.00 -1.13 -0.00 0.00 0.00 179.45 179.07 2b39 n SER 1062N -4.91 0.87 -0.13 7.07 3.41 -1.26 -4.78 113.62 113.89 2b39 n SER 1062Ca 0.17 -1.96 -0.02 0.00 -0.26 0.00 0.00 58.87 56.81 2b39 n SER 1062Cb 0.45 -0.44 -0.01 0.00 -0.26 0.00 0.00 64.21 63.96 2b39 n SER 1062CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 2b39 n SER 1063N -0.04 -5.04 -4.56 4.04 7.64 -0.93 -4.84 113.62 109.88 2b39 n SER 1063Ca 0.00 0.04 -0.25 0.00 1.01 0.00 0.00 58.87 59.67 2b39 n SER 1063Cb 0.22 -2.70 0.12 0.00 -1.01 0.00 0.00 64.21 60.84 2b39 n SER 1063CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2b39 s ALA 1064N -1.45 3.27 -0.01 -0.43 0.00 -1.25 -4.28 121.76 117.60 2b39 s ALA 1064Ca 0.00 -1.50 0.01 0.00 0.00 0.00 0.00 51.96 50.47 2b39 s ALA 1064Cb 0.00 -2.27 0.01 0.00 0.00 0.00 0.00 23.12 20.86 2b39 s ALA 1064CO 0.00 -1.69 -0.02 0.71 0.00 0.00 0.00 175.76 174.77 2b39 s TYR 1065N -3.34 0.30 0.16 0.00 1.51 -1.26 -1.04 117.35 113.69 2b39 s TYR 1065Ca 0.67 -0.03 0.10 0.00 -1.01 0.00 0.00 57.07 56.81 2b39 s TYR 1065Cb -0.06 -0.29 -0.04 0.00 -0.11 0.00 0.00 41.96 41.46 2b39 s TYR 1065CO 0.46 -0.06 -0.21 0.00 -1.11 0.00 0.00 175.55 174.63 2b39 s ALA 1066N 0.42 2.59 0.40 3.71 0.00 -1.17 -0.40 121.76 127.32 2b39 s ALA 1066Ca -0.04 -1.52 0.18 0.00 0.00 0.00 0.00 51.96 50.58 2b39 s ALA 1066Cb -0.07 -0.46 1.06 0.00 0.00 0.00 0.00 23.12 23.64 2b39 s ALA 1066CO -0.01 0.49 1.96 0.00 0.00 0.00 0.00 175.76 178.20 2b39 h ALA 1067N 3.40 1.44 -2.70 0.00 0.00 -1.91 -3.37 119.26 116.12 2b39 h ALA 1067Ca -0.48 -0.20 -0.33 0.00 0.00 0.00 0.00 54.91 53.89 2b39 h ALA 1067Cb 1.19 -0.04 -0.14 0.00 0.00 0.00 0.00 17.79 18.80 2b39 h ALA 1067CO 0.47 0.28 -0.57 -0.06 0.00 0.00 0.00 179.25 179.36 2b39 s PHE 1068N -4.32 1.40 0.12 0.00 0.40 -1.26 0.91 117.98 115.23 2b39 s PHE 1068Ca -0.03 -1.49 -0.25 0.00 -0.60 0.00 0.00 56.93 54.56 2b39 s PHE 1068Cb 0.14 -0.63 -0.07 0.00 0.51 0.00 0.00 43.02 42.97 2b39 s PHE 1068CO 0.67 -0.72 1.43 0.37 0.70 0.00 0.00 175.22 177.66 2b39 h GLN 1069N 2.43 -0.13 -3.11 0.44 4.15 -1.88 -3.31 115.11 113.70 2b39 h GLN 1069Ca -0.32 0.01 -0.62 0.00 0.77 0.00 0.00 58.65 58.49 2b39 h GLN 1069Cb 1.24 0.03 -0.41 0.00 0.21 0.00 0.00 27.48 28.55 2b39 h GLN 1069CO 0.47 -0.09 -0.61 0.71 -1.93 0.00 0.00 178.83 177.38 2b39 s TYR 1070N -5.02 3.28 0.17 3.99 1.51 -1.26 -5.05 117.35 114.97 2b39 s TYR 1070Ca -0.10 -3.21 -0.13 0.00 -1.01 0.00 0.00 57.07 52.62 2b39 s TYR 1070Cb 0.08 -2.60 0.01 0.00 -0.11 0.00 0.00 41.96 39.33 2b39 s TYR 1070CO 0.49 -0.61 0.38 1.03 -1.11 0.00 0.00 175.55 175.72 2b39 s ARG 1071N -1.04 1.23 0.55 -0.62 0.52 -1.25 -5.14 118.95 113.20 2b39 s ARG 1071Ca 0.23 -1.02 -0.19 0.00 -0.52 0.00 0.00 55.73 54.23 2b39 s ARG 1071Cb -0.10 0.44 -0.06 0.00 0.52 0.00 0.00 34.95 35.75 2b39 s ARG 1071CO -0.12 -0.48 1.11 -2.14 0.02 0.00 0.00 175.30 173.69 2b39 s PRO 1072N -3.92 3.36 0.50 3.54 0.02 -1.26 -4.85 135.00 132.39 2b39 s PRO 1072Ca 0.13 1.54 -0.22 0.00 0.02 0.00 0.00 61.00 62.46 2b39 s PRO 1072Cb 0.02 -2.01 -0.08 0.00 0.02 0.00 0.00 34.50 32.45 2b39 s PRO 1072CO -0.02 -0.83 1.09 -2.30 -0.33 0.00 0.00 177.00 174.61 2b39 n PRO 1073N -1.39 1.36 -3.71 5.54 -0.02 -1.26 -4.62 135.00 130.90 2b39 n PRO 1073Ca 0.11 0.50 -0.37 0.00 -2.02 0.00 0.00 63.50 61.71 2b39 n PRO 1073Cb 0.51 -2.23 -0.12 0.00 -0.02 0.00 0.00 33.50 31.64 2b39 n PRO 1073CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 2b39 s SER 1074N -0.89 5.30 0.41 2.55 0.15 0.47 -2.53 113.70 119.16 2b39 s SER 1074Ca 0.68 -0.45 0.07 0.00 0.70 0.00 0.00 55.95 56.95 2b39 s SER 1074Cb -0.48 -1.95 0.85 0.00 -1.71 0.00 0.00 66.02 62.73 2b39 s SER 1074CO 0.53 -0.14 2.05 0.74 1.20 0.00 0.00 173.24 177.62 2b39 h THR 1075N 5.67 1.11 0.46 6.45 2.02 -1.85 -0.40 112.91 126.36 2b39 h THR 1075Ca -0.34 -0.22 -0.02 0.00 0.77 0.00 0.00 66.41 66.60 2b39 h THR 1075Cb 1.15 0.52 0.00 0.00 -1.74 0.00 0.00 68.15 68.08 2b39 h THR 1075CO 0.60 0.11 -0.22 -0.25 0.37 0.00 0.00 175.52 176.13 2b39 h TRP 1076N 0.56 -0.57 -0.64 3.16 7.01 -1.93 -2.58 115.95 120.95 2b39 h TRP 1076Ca 0.15 -0.01 0.10 0.00 2.11 0.00 0.00 58.89 61.24 2b39 h TRP 1076Cb -0.05 0.19 -0.08 0.00 -2.10 0.00 0.00 29.16 27.13 2b39 h TRP 1076CO 0.00 -0.36 0.25 1.25 -2.79 0.00 0.00 178.44 176.79 2b39 h LEU 1077N -0.94 0.26 -0.57 0.65 5.85 -1.88 -0.72 115.31 117.96 2b39 h LEU 1077Ca -0.06 0.08 0.06 0.00 0.84 0.00 0.00 57.88 58.80 2b39 h LEU 1077Cb 0.47 0.05 -0.06 0.00 0.37 0.00 0.00 40.66 41.50 2b39 h LEU 1077CO 0.10 0.14 0.27 0.74 -0.34 0.00 0.00 178.44 179.36 2b39 h THR 1078N 0.43 0.90 -0.48 1.05 2.02 -1.15 0.19 112.91 115.87 2b39 h THR 1078Ca 0.33 -0.17 -0.01 0.00 0.77 0.00 0.00 66.41 67.32 2b39 h THR 1078Cb 0.41 0.35 -0.02 0.00 -1.74 0.00 0.00 68.15 67.15 2b39 h THR 1078CO -0.32 0.09 0.25 0.00 0.37 0.00 0.00 175.52 175.92 2b39 h ALA 1079N 1.34 0.62 -0.30 6.16 0.00 -0.90 -1.82 119.26 124.36 2b39 h ALA 1079Ca 0.27 -0.10 0.04 0.00 0.00 0.00 0.00 54.91 55.11 2b39 h ALA 1079Cb 0.23 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.79 2b39 h ALA 1079CO -0.21 0.15 0.08 -0.92 0.00 0.00 0.00 179.25 178.36 2b39 h TYR 1080N 0.63 0.15 -0.55 0.00 3.20 0.33 -1.43 116.97 119.30 2b39 h TYR 1080Ca 0.17 0.02 0.07 0.00 3.14 0.00 0.00 58.73 62.13 2b39 h TYR 1080Cb 0.07 -0.02 -0.03 0.00 1.54 0.00 0.00 36.73 38.29 2b39 h TYR 1080CO -0.01 0.06 0.37 0.28 -1.64 0.00 0.00 178.16 177.21 2b39 h VAL 1081N 0.20 0.96 -0.52 1.81 2.07 -0.38 -0.57 116.25 119.82 2b39 h VAL 1081Ca 0.13 -0.16 -0.10 0.00 0.82 0.00 0.00 66.70 67.40 2b39 h VAL 1081Cb 0.12 0.46 -0.02 0.00 -1.52 0.00 0.00 31.29 30.33 2b39 h VAL 1081CO -0.15 0.08 -0.07 0.58 0.02 0.00 0.00 177.57 178.03 2b39 h VAL 1082N 0.46 1.27 -0.05 2.57 2.07 -0.43 -2.54 116.25 119.60 2b39 h VAL 1082Ca 0.24 -1.20 -0.01 0.00 0.82 0.00 0.00 66.70 66.56 2b39 h VAL 1082Cb 0.37 0.99 -0.00 0.00 -1.52 0.00 0.00 31.29 31.13 2b39 h VAL 1082CO -0.07 0.42 0.01 0.50 0.02 0.00 0.00 177.57 178.46 2b39 h LYS 1083N 0.82 0.09 0.00 1.57 3.64 -0.45 -1.95 116.57 120.29 2b39 h LYS 1083Ca 0.14 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.50 2b39 h LYS 1083Cb 0.62 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.43 2b39 h LYS 1083CO 0.04 0.29 0.00 0.28 -2.27 0.00 0.00 179.45 177.79 2b39 h VAL 1084N -0.13 0.00 0.05 2.00 2.07 -1.47 -2.36 116.25 116.41 2b39 h VAL 1084Ca 0.02 -0.70 -0.00 0.00 0.82 0.00 0.00 66.70 66.83 2b39 h VAL 1084Cb 0.24 1.67 0.00 0.00 -1.52 0.00 0.00 31.29 31.69 2b39 h VAL 1084CO 0.00 0.00 -0.02 -0.26 0.02 0.00 0.00 177.57 177.31 2b39 h PHE 1085N 0.00 -0.06 -0.91 1.57 -1.00 -1.40 -2.56 116.94 112.58 2b39 h PHE 1085Ca 0.00 -0.00 0.11 0.00 2.81 0.00 0.00 57.97 60.89 2b39 h PHE 1085Cb 0.77 0.02 -0.08 0.00 3.61 0.00 0.00 35.95 40.27 2b39 h PHE 1085CO 0.00 0.55 0.54 0.00 -1.61 0.00 0.00 178.31 177.79 2b39 h ALA 1086N 0.07 1.35 -0.12 2.45 0.00 -1.33 0.33 119.26 122.01 2b39 h ALA 1086Ca -0.01 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 2b39 h ALA 1086Cb 0.64 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.27 2b39 h ALA 1086CO 0.01 0.13 0.03 -0.07 0.00 0.00 0.00 179.25 179.35 2b39 h LEU 1087N 0.86 0.18 -0.65 0.00 3.38 -1.48 -3.05 115.31 114.56 2b39 h LEU 1087Ca 0.45 -0.22 -0.02 0.00 0.09 0.00 0.00 57.88 58.18 2b39 h LEU 1087Cb 0.46 -0.05 -0.00 0.00 0.09 0.00 0.00 40.66 41.16 2b39 h LEU 1087CO -0.27 0.35 -0.07 0.00 0.09 0.00 0.00 178.44 178.54 2b39 h ALA 1088N 0.83 0.97 -0.00 1.53 0.00 -0.97 -3.18 119.26 118.43 2b39 h ALA 1088Ca 0.04 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.88 2b39 h ALA 1088Cb 0.24 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.02 2b39 h ALA 1088CO 0.00 0.09 0.34 0.00 0.00 0.00 0.00 179.25 179.68 2b39 h ALA 1089N 1.93 1.35 -0.09 0.00 0.00 -0.25 0.59 119.26 122.80 2b39 h ALA 1089Ca -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2b39 h ALA 1089Cb 0.83 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.62 2b39 h ALA 1089CO 0.01 -0.34 0.00 -1.71 0.00 0.00 0.00 179.25 177.20 2b39 n ASN 1090N -2.89 1.01 0.00 0.00 4.05 -1.20 -4.15 115.26 112.08 2b39 n ASN 1090Ca -0.02 -1.55 0.00 0.00 0.45 0.00 0.00 54.58 53.46 2b39 n ASN 1090Cb 0.39 -0.05 0.00 0.00 1.23 0.00 0.00 39.78 41.35 2b39 n ASN 1090CO 0.00 0.00 0.00 0.18 -3.05 0.00 0.00 177.26 174.39 2b39 n LEU 1091N -0.13 0.00 -4.54 1.20 4.77 0.18 -5.11 117.00 113.37 2b39 n LEU 1091Ca 0.16 0.00 -0.24 0.00 -0.03 0.00 0.00 56.01 55.91 2b39 n LEU 1091Cb 0.23 0.00 -0.09 0.00 -2.33 0.00 0.00 43.42 41.23 2b39 n LEU 1091CO 0.13 0.00 -0.42 -0.63 -1.33 0.00 0.00 177.39 175.14 2b39 s ILE 1092N -1.00 2.88 -0.87 -0.08 -1.09 0.26 -5.06 121.20 116.24 2b39 s ILE 1092Ca 0.00 -2.20 -0.23 0.00 -2.23 0.00 0.00 60.65 55.99 2b39 s ILE 1092Cb 0.00 -2.52 0.06 0.00 -1.58 0.00 0.00 42.46 38.42 2b39 s ILE 1092CO 0.00 -0.38 1.27 0.00 -1.23 0.00 0.00 174.94 174.59 2b39 s ALA 1093N -2.41 2.90 -0.23 9.38 0.00 -1.26 -4.43 121.76 125.70 2b39 s ALA 1093Ca 0.30 -2.05 -0.12 0.00 0.00 0.00 0.00 51.96 50.10 2b39 s ALA 1093Cb -0.06 -4.26 -0.05 0.00 0.00 0.00 0.00 23.12 18.75 2b39 s ALA 1093CO 0.17 -3.28 0.21 0.42 0.00 0.00 0.00 175.76 173.28 2b39 s ILE 1094N 4.62 5.33 -0.87 0.00 -1.09 -1.26 -4.96 121.20 122.97 2b39 s ILE 1094Ca 0.37 0.28 -0.25 0.00 -2.23 0.00 0.00 60.65 58.82 2b39 s ILE 1094Cb -0.06 -3.55 -0.18 0.00 -1.58 0.00 0.00 42.46 37.10 2b39 s ILE 1094CO 0.00 0.32 2.29 -0.67 -1.23 0.00 0.00 174.94 175.65 2b39 n ASP 1095N 4.36 1.43 -0.31 3.58 -0.08 -1.26 -4.76 116.55 119.51 2b39 n ASP 1095Ca -0.14 -1.74 0.07 0.00 -1.51 0.00 0.00 54.79 51.48 2b39 n ASP 1095Cb 0.52 -1.61 0.23 0.00 2.34 0.00 0.00 41.12 42.60 2b39 n ASP 1095CO 0.00 0.00 0.00 0.77 0.12 0.00 0.00 177.20 178.09 2b39 h SER 1096N 12.25 0.64 -0.56 1.67 4.64 -1.98 0.17 113.55 130.38 2b39 h SER 1096Ca 0.00 0.08 0.16 0.00 -0.47 0.00 0.00 61.79 61.56 2b39 h SER 1096Cb 1.01 -0.03 -0.02 0.00 -0.31 0.00 0.00 62.40 63.04 2b39 h SER 1096CO 1.03 0.29 0.53 0.50 -0.87 0.00 0.00 176.83 178.31 2b39 h LYS 1097N 0.72 0.00 0.05 4.77 1.63 -1.97 -1.48 116.57 120.28 2b39 h LYS 1097Ca 0.48 0.00 -0.37 0.00 -0.85 0.00 0.00 60.65 59.91 2b39 h LYS 1097Cb 0.63 0.00 -0.05 0.00 -0.60 0.00 0.00 32.23 32.21 2b39 h LYS 1097CO -0.34 0.00 -2.21 -3.47 -3.45 0.00 0.00 179.45 169.98 2b39 n ASP 1098N -3.85 1.69 0.14 4.20 4.64 0.48 -3.97 116.55 119.88 2b39 n ASP 1098Ca 0.11 0.06 -0.14 0.00 -1.38 0.00 0.00 54.79 53.44 2b39 n ASP 1098Cb 0.74 -0.38 -0.07 0.00 -1.04 0.00 0.00 41.12 40.38 2b39 n ASP 1098CO 0.00 0.00 0.00 0.25 -0.82 0.00 0.00 177.20 176.63 2b39 h LEU 1099N 0.03 -0.96 -2.19 -2.67 6.46 -0.26 -0.17 115.31 115.55 2b39 h LEU 1099Ca -0.49 0.10 0.00 0.00 -0.12 0.00 0.00 57.88 57.37 2b39 h LEU 1099Cb 2.00 0.35 0.00 0.00 -0.73 0.00 0.00 40.66 42.29 2b39 h LEU 1099CO 0.01 -0.44 0.00 0.00 -0.62 0.00 0.00 178.44 177.39 2b39 h GLU 1101N 0.00 0.62 -0.39 0.00 4.39 -1.17 -0.80 114.58 117.22 2b39 h GLU 1101Ca 0.00 -0.55 0.00 0.00 0.34 0.00 0.00 59.36 59.15 2b39 h GLU 1101Cb 0.00 0.13 -0.02 0.00 -0.10 0.00 0.00 28.75 28.76 2b39 h GLU 1101CO 0.00 1.17 0.26 1.15 -1.16 0.00 0.00 179.01 180.42 2b39 h THR 1102N 0.26 1.10 0.09 1.13 2.02 -0.39 -0.00 112.91 117.12 2b39 h THR 1102Ca -0.06 -0.20 0.02 0.00 0.77 0.00 0.00 66.41 66.94 2b39 h THR 1102Cb 1.34 0.53 -0.03 0.00 -1.74 0.00 0.00 68.15 68.25 2b39 h THR 1102CO 0.14 0.10 -0.22 0.58 0.37 0.00 0.00 175.52 176.49 2b39 h VAL 1103N 0.53 0.49 -0.87 3.16 2.07 -1.28 -1.33 116.25 119.01 2b39 h VAL 1103Ca 0.14 0.00 0.16 0.00 0.82 0.00 0.00 66.70 67.83 2b39 h VAL 1103Cb -0.05 0.49 -0.10 0.00 -1.52 0.00 0.00 31.29 30.11 2b39 h VAL 1103CO -0.03 0.00 0.45 0.50 0.02 0.00 0.00 177.57 178.51 2b39 h LYS 1104N -0.40 0.59 -0.31 1.57 3.64 -0.70 0.16 116.57 121.12 2b39 h LYS 1104Ca 0.04 -0.04 0.05 0.00 -1.27 0.00 0.00 60.65 59.43 2b39 h LYS 1104Cb 0.44 -0.13 -0.05 0.00 -0.41 0.00 0.00 32.23 32.08 2b39 h LYS 1104CO -0.14 0.39 0.02 2.35 -2.27 0.00 0.00 179.45 179.79 2b39 h TRP 1105N 0.60 0.02 0.50 1.91 7.01 0.05 -0.96 115.95 125.08 2b39 h TRP 1105Ca 0.49 0.02 -0.02 0.00 2.11 0.00 0.00 58.89 61.50 2b39 h TRP 1105Cb 0.75 0.04 -0.02 0.00 -2.10 0.00 0.00 29.16 27.83 2b39 h TRP 1105CO -0.09 -0.03 -0.44 -0.07 -2.79 0.00 0.00 178.44 175.02 2b39 h LEU 1106N 0.11 -1.20 -0.54 0.65 3.38 0.24 0.11 115.31 118.06 2b39 h LEU 1106Ca 0.15 0.09 0.11 0.00 0.09 0.00 0.00 57.88 58.32 2b39 h LEU 1106Cb 0.19 0.39 -0.09 0.00 0.09 0.00 0.00 40.66 41.23 2b39 h LEU 1106CO -0.23 -0.60 -0.01 0.40 0.09 0.00 0.00 178.44 178.08 2b39 h ILE 1107N -0.92 0.55 0.00 1.22 1.08 -1.12 0.07 117.51 118.40 2b39 h ILE 1107Ca -0.06 -0.04 -0.00 0.00 -0.39 0.00 0.00 64.86 64.37 2b39 h ILE 1107Cb 0.79 0.44 0.00 0.00 -3.07 0.00 0.00 36.82 34.98 2b39 h ILE 1107CO -0.02 0.02 -0.00 -0.07 -0.69 0.00 0.00 178.15 177.38 2b39 h LEU 1108N 0.10 -0.00 -1.60 1.44 -0.00 -1.08 -3.15 115.31 111.02 2b39 h LEU 1108Ca 0.28 0.00 -0.04 0.00 -0.00 0.00 0.00 57.88 58.12 2b39 h LEU 1108Cb 0.43 0.00 -0.01 0.00 -0.00 0.00 0.00 40.66 41.08 2b39 h LEU 1108CO -0.47 0.00 -0.14 -0.33 -0.00 0.00 0.00 178.44 177.51 2b39 h GLU 1109N -0.02 0.09 0.00 1.13 4.39 -0.88 -3.37 114.58 115.92 2b39 h GLU 1109Ca -0.00 -0.02 -0.13 0.00 0.34 0.00 0.00 59.36 59.56 2b39 h GLU 1109Cb 0.00 -0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 28.62 2b39 h GLU 1109CO 0.00 0.23 -1.63 1.63 -1.16 0.00 0.00 179.01 178.08 2b39 n LYS 1110N -4.33 1.73 -2.57 2.33 4.76 -0.04 -4.98 118.16 115.05 2b39 n LYS 1110Ca -0.02 -0.03 -0.42 0.00 -2.87 0.00 0.00 58.31 54.96 2b39 n LYS 1110Cb 0.23 -1.26 -0.03 0.00 -1.84 0.00 0.00 35.03 32.14 2b39 n LYS 1110CO 0.00 0.00 0.00 -1.14 -1.37 0.00 0.00 177.40 174.89 2b39 s GLN 1111N -2.40 4.39 1.02 1.97 0.74 -0.85 -1.25 119.66 123.28 2b39 s GLN 1111Ca -0.05 1.53 -0.16 0.00 0.05 0.00 0.00 55.36 56.74 2b39 s GLN 1111Cb 0.04 -3.55 0.21 0.00 1.10 0.00 0.00 33.01 30.81 2b39 s GLN 1111CO 0.42 -0.38 1.18 0.15 -0.55 0.00 0.00 175.29 176.12 2b39 s LYS 1112N 2.09 0.20 0.41 1.67 1.02 0.15 -4.87 119.74 120.41 2b39 s LYS 1112Ca 0.52 -0.04 0.16 0.00 0.02 0.00 0.00 55.97 56.63 2b39 s LYS 1112Cb -0.21 -1.76 0.89 0.00 -0.52 0.00 0.00 37.83 36.23 2b39 s LYS 1112CO 0.20 -2.77 1.90 -1.00 -0.92 0.00 0.00 175.35 172.76 2b39 h PRO 1113N -1.90 0.00 -0.67 -1.68 0.13 -1.96 -3.05 132.00 122.87 2b39 h PRO 1113Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 2b39 h PRO 1113Cb 1.29 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.42 2b39 h PRO 1113CO 0.46 0.29 0.00 -0.40 -0.23 0.00 0.00 178.00 178.12 2b39 n ASP 1114N -4.04 3.14 0.00 1.44 3.85 -1.26 -4.91 116.55 114.77 2b39 n ASP 1114Ca -0.02 -2.36 0.00 0.00 -0.71 0.00 0.00 54.79 51.71 2b39 n ASP 1114Cb 0.35 -0.50 0.00 0.00 -1.35 0.00 0.00 41.12 39.62 2b39 n ASP 1114CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 2b39 n GLY 1115N 0.56 3.09 3.73 6.12 0.00 -1.15 -4.69 105.19 112.85 2b39 n GLY 1115Ca 0.14 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.79 2b39 n GLY 1115CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2b39 n ILE 1116N -0.55 4.38 -4.17 -0.61 5.41 -1.26 -4.37 119.36 118.19 2b39 n ILE 1116Ca 0.00 -0.50 -0.34 0.00 1.00 0.00 0.00 62.75 62.91 2b39 n ILE 1116Cb 0.00 -1.54 -0.14 0.00 -0.71 0.00 0.00 39.64 37.26 2b39 n ILE 1116CO 0.00 0.00 0.00 -0.36 0.00 0.00 0.00 176.55 176.19 2b39 s PHE 1117N -1.35 2.95 0.26 1.39 0.40 -1.26 0.32 117.98 120.68 2b39 s PHE 1117Ca 0.77 -0.74 -0.09 0.00 -0.60 0.00 0.00 56.93 56.28 2b39 s PHE 1117Cb -0.40 -2.03 -0.07 0.00 0.51 0.00 0.00 43.02 41.03 2b39 s PHE 1117CO 0.45 -0.37 0.58 -1.14 0.70 0.00 0.00 175.22 175.43 2b39 s GLN 1118N 1.04 3.77 -0.27 0.44 0.74 -0.38 -4.68 119.66 120.32 2b39 s GLN 1118Ca 0.01 0.24 -0.05 0.00 0.05 0.00 0.00 55.36 55.61 2b39 s GLN 1118Cb -0.15 -2.62 0.01 0.00 1.10 0.00 0.00 33.01 31.36 2b39 s GLN 1118CO -0.00 0.26 0.03 -2.00 -0.55 0.00 0.00 175.29 173.02 2b39 s GLU 1119N -3.08 3.03 -0.10 1.67 2.56 -1.26 -4.76 118.70 116.77 2b39 s GLU 1119Ca 0.47 -0.88 0.19 0.00 0.00 0.00 0.00 54.97 54.75 2b39 s GLU 1119Cb -0.11 -3.22 -0.28 0.00 2.00 0.00 0.00 34.13 32.52 2b39 s GLU 1119CO 0.24 -0.41 0.27 -0.25 -0.56 0.00 0.00 175.26 174.55 2b39 n ASP 1120N 4.80 0.38 -4.93 -1.70 8.00 -1.26 -4.97 116.55 116.86 2b39 n ASP 1120Ca -0.15 0.00 -0.26 0.00 0.71 0.00 0.00 54.79 55.09 2b39 n ASP 1120Cb 0.48 1.49 0.07 0.00 -0.02 0.00 0.00 41.12 43.14 2b39 n ASP 1120CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 2b39 s GLY 1121N -4.77 1.69 0.33 0.44 0.00 -1.05 -4.99 107.32 98.97 2b39 s GLY 1121Ca -0.08 -0.93 -0.29 0.00 0.00 0.00 0.00 44.72 43.42 2b39 s GLY 1121CO 0.81 -0.52 1.45 2.56 0.00 0.00 0.00 173.10 177.39 2b39 s PRO 1122N -5.24 4.21 0.27 2.90 0.04 -1.26 -4.88 135.00 131.03 2b39 s PRO 1122Ca 0.60 2.43 -0.30 0.00 0.04 0.00 0.00 61.00 63.77 2b39 s PRO 1122Cb -0.11 -3.03 -0.11 0.00 0.04 0.00 0.00 34.50 31.29 2b39 s PRO 1122CO 0.45 -0.43 1.58 0.08 0.04 0.00 0.00 177.00 178.71 2b39 s VAL 1123N -0.77 2.21 -0.21 -0.36 1.01 -1.26 -4.93 120.40 116.10 2b39 s VAL 1123Ca 0.54 0.17 0.03 0.00 0.00 0.00 0.00 61.98 62.73 2b39 s VAL 1123Cb -0.44 -3.11 -0.21 0.00 0.00 0.00 0.00 36.38 32.62 2b39 s VAL 1123CO 0.55 0.03 -0.00 -0.38 0.00 0.00 0.00 175.10 175.29 2b39 n ILE 1124N 2.50 1.54 -4.46 2.22 5.41 -1.26 -4.35 119.36 120.97 2b39 n ILE 1124Ca 0.09 -0.65 -0.34 0.00 1.00 0.00 0.00 62.75 62.85 2b39 n ILE 1124Cb 0.38 -1.31 -0.11 0.00 -0.71 0.00 0.00 39.64 37.89 2b39 n ILE 1124CO 0.00 0.00 0.00 -2.28 0.00 0.00 0.00 176.55 174.27 2b39 s HIS 1125N -2.53 3.05 0.46 1.39 2.46 -1.26 -3.79 115.29 115.07 2b39 s HIS 1125Ca -0.27 0.01 0.18 0.00 0.47 0.00 0.00 55.06 55.45 2b39 s HIS 1125Cb 0.08 -1.81 1.15 0.00 -0.13 0.00 0.00 32.58 31.87 2b39 s HIS 1125CO 0.69 0.29 1.97 0.37 -2.47 0.00 0.00 174.74 175.58 2b39 h GLN 1126N 5.60 0.27 -1.03 2.88 4.15 -1.96 -2.86 115.11 122.17 2b39 h GLN 1126Ca -0.45 -0.02 -0.25 0.00 0.77 0.00 0.00 58.65 58.71 2b39 h GLN 1126Cb 1.18 -0.06 -0.15 0.00 0.21 0.00 0.00 27.48 28.67 2b39 h GLN 1126CO 0.56 0.18 0.32 0.39 -1.93 0.00 0.00 178.83 178.35 2b39 n GLU 1127N -4.45 1.60 -0.36 1.69 -0.58 -1.26 -3.40 120.64 113.88 2b39 n GLU 1127Ca 0.11 -1.43 0.07 0.00 -0.42 0.00 0.00 57.16 55.50 2b39 n GLU 1127Cb 0.49 -1.56 0.18 0.00 -0.57 0.00 0.00 31.44 29.98 2b39 n GLU 1127CO 0.00 0.00 0.00 -1.33 -0.48 0.00 0.00 177.13 175.32 2b39 n MET 1128N -0.25 1.55 -4.31 3.49 2.81 -1.08 -4.58 117.12 114.76 2b39 n MET 1128Ca 0.28 -2.93 -0.26 0.00 -1.81 0.00 0.00 57.70 52.98 2b39 n MET 1128Cb 1.03 -1.59 -0.17 0.00 -0.71 0.00 0.00 33.22 31.78 2b39 n MET 1128CO 0.00 0.00 0.00 0.42 1.51 0.00 0.00 175.97 177.90 2b39 s ILE 1129N -3.05 1.12 -0.21 2.02 1.01 -1.22 -4.94 121.20 115.94 2b39 s ILE 1129Ca 0.36 -0.42 -0.29 0.00 0.00 0.00 0.00 60.65 60.30 2b39 s ILE 1129Cb 0.33 -1.07 -0.04 0.00 0.01 0.00 0.00 42.46 41.69 2b39 s ILE 1129CO -0.01 0.37 1.95 -0.83 0.00 0.00 0.00 174.94 176.42 2b39 s GLY 1130N 1.09 0.87 0.42 6.18 0.00 -1.26 -4.89 107.32 109.73 2b39 s GLY 1130Ca -0.06 0.68 -0.23 0.00 0.00 0.00 0.00 44.72 45.10 2b39 s GLY 1130CO -0.01 3.46 0.83 0.61 0.00 0.00 0.00 173.10 177.98 2b39 n GLY 1131N 5.26 -0.72 0.14 0.20 0.00 -1.26 -4.28 105.19 104.52 2b39 n GLY 1131Ca 0.24 0.10 0.00 0.00 0.00 0.00 0.00 46.02 46.36 2b39 n GLY 1131CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 2b39 n PHE 1132N -0.67 0.00 -4.24 1.61 1.16 -1.26 0.25 117.46 114.31 2b39 n PHE 1132Ca 0.11 0.00 -0.37 0.00 -1.87 0.00 0.00 57.45 55.32 2b39 n PHE 1132Cb 0.39 0.00 -0.06 0.00 -1.61 0.00 0.00 39.48 38.20 2b39 n PHE 1132CO 0.00 0.00 0.00 -2.13 -1.87 0.00 0.00 176.76 172.76 2b39 n ARG 1133N 0.03 -1.33 -2.90 3.97 0.00 -1.26 -4.87 116.66 110.29 2b39 n ARG 1133Ca 0.00 0.16 -0.42 0.00 -0.00 0.00 0.00 57.85 57.59 2b39 n ARG 1133Cb 0.00 -4.75 -0.04 0.00 0.00 0.00 0.00 32.46 27.66 2b39 n ARG 1133CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.63 177.12 2b39 s ASP 1134N -3.09 6.79 -0.03 6.15 1.01 0.71 -4.85 116.67 123.35 2b39 s ASP 1134Ca 0.72 0.94 0.05 0.00 0.71 0.00 0.00 52.55 54.98 2b39 s ASP 1134Cb -0.42 -2.43 0.21 0.00 1.01 0.00 0.00 42.92 41.30 2b39 s ASP 1134CO 0.89 -0.54 1.01 0.35 0.21 0.00 0.00 175.17 177.08 2b39 n THR 1135N 5.33 0.55 -3.63 -1.27 -2.24 -1.26 -4.56 114.28 107.19 2b39 n THR 1135Ca 0.05 -0.35 -0.20 0.00 -2.27 0.00 0.00 64.05 61.29 2b39 n THR 1135Cb 0.48 -0.15 -0.01 0.00 -2.10 0.00 0.00 70.33 68.54 2b39 n THR 1135CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 2b39 s ARG 1136N -1.61 3.09 0.00 -0.78 0.52 -1.26 -4.39 118.95 114.52 2b39 s ARG 1136Ca 0.15 -1.02 0.00 0.00 -0.52 0.00 0.00 55.73 54.34 2b39 s ARG 1136Cb 0.10 -2.76 0.00 0.00 0.52 0.00 0.00 34.95 32.81 2b39 s ARG 1136CO 0.07 0.14 0.00 0.39 0.02 0.00 0.00 175.30 175.92 2b39 n GLU 1137N -1.54 -1.14 -2.15 3.54 1.02 -1.26 -4.66 120.64 114.45 2b39 n GLU 1137Ca -0.02 0.19 -0.42 0.00 -0.02 0.00 0.00 57.16 56.88 2b39 n GLU 1137Cb 0.58 -3.78 -0.03 0.00 -0.02 0.00 0.00 31.44 28.19 2b39 n GLU 1137CO 0.00 0.00 0.00 0.21 1.18 0.00 0.00 177.13 178.52 2b39 s LYS 1138N -1.03 4.26 -1.19 3.49 2.20 -1.26 -2.54 119.74 123.67 2b39 s LYS 1138Ca 0.00 2.06 0.00 0.00 -0.36 0.00 0.00 55.97 57.67 2b39 s LYS 1138Cb 0.00 -3.56 0.00 0.00 -1.51 0.00 0.00 37.83 32.76 2b39 s LYS 1138CO 0.00 -0.60 0.00 -0.25 -0.36 0.00 0.00 175.35 174.14 2b39 n ASP 1139N 5.33 -4.34 -0.09 1.43 8.00 -1.26 -4.91 116.55 120.70 2b39 n ASP 1139Ca 0.14 0.28 -0.14 0.00 0.71 0.00 0.00 54.79 55.77 2b39 n ASP 1139Cb 0.43 -2.84 -0.07 0.00 -0.02 0.00 0.00 41.12 38.62 2b39 n ASP 1139CO 0.00 0.00 0.00 0.52 -0.39 0.00 0.00 177.20 177.33 2b39 n VAL 1140N -2.68 1.48 -0.05 2.53 0.31 -1.05 -2.93 118.33 115.94 2b39 n VAL 1140Ca -0.11 0.08 -0.08 0.00 -0.01 0.00 0.00 64.34 64.22 2b39 n VAL 1140Cb 0.37 -2.20 -0.01 0.00 -0.91 0.00 0.00 33.84 31.08 2b39 n VAL 1140CO 0.00 0.00 0.00 0.28 -1.32 0.00 0.00 176.83 175.79 2b39 h SER 1141N -1.00 -0.58 -0.27 4.52 0.02 -1.83 -0.64 113.55 113.77 2b39 h SER 1141Ca -0.19 0.12 -0.14 0.00 -0.84 0.00 0.00 61.79 60.73 2b39 h SER 1141Cb 0.94 0.29 -0.01 0.00 0.14 0.00 0.00 62.40 63.76 2b39 h SER 1141CO -0.12 -0.22 -0.35 0.25 -1.14 0.00 0.00 176.83 175.26 2b39 h LEU 1142N -0.17 0.85 -1.24 5.07 5.85 -1.81 0.03 115.31 123.88 2b39 h LEU 1142Ca 0.14 -0.36 -0.06 0.00 0.84 0.00 0.00 57.88 58.43 2b39 h LEU 1142Cb 0.38 -0.24 -0.01 0.00 0.37 0.00 0.00 40.66 41.16 2b39 h LEU 1142CO -0.34 1.11 -0.09 0.74 -0.34 0.00 0.00 178.44 179.51 2b39 h THR 1143N 0.67 1.20 -0.01 1.05 2.02 -1.36 0.17 112.91 116.65 2b39 h THR 1143Ca 0.07 -0.87 -0.04 0.00 0.77 0.00 0.00 66.41 66.33 2b39 h THR 1143Cb 0.90 1.12 0.00 0.00 -1.74 0.00 0.00 68.15 68.43 2b39 h THR 1143CO 0.08 0.28 -0.16 0.00 0.37 0.00 0.00 175.52 176.10 2b39 h ALA 1144N 1.52 0.03 -0.42 6.16 0.00 -0.98 -0.52 119.26 125.06 2b39 h ALA 1144Ca 0.08 -0.42 0.09 0.00 0.00 0.00 0.00 54.91 54.65 2b39 h ALA 1144Cb 0.41 0.01 -0.09 0.00 0.00 0.00 0.00 17.79 18.11 2b39 h ALA 1144CO 0.02 0.01 -0.24 0.35 0.00 0.00 0.00 179.25 179.39 2b39 h PHE 1145N -0.56 -0.61 -0.51 0.00 3.57 -0.74 0.19 116.94 118.29 2b39 h PHE 1145Ca -0.02 0.05 -0.02 0.00 3.53 0.00 0.00 57.97 61.51 2b39 h PHE 1145Cb 0.89 0.33 -0.02 0.00 2.79 0.00 0.00 35.95 39.94 2b39 h PHE 1145CO 0.18 -0.31 0.24 0.28 -2.23 0.00 0.00 178.31 176.46 2b39 h VAL 1146N -0.16 1.20 -0.61 1.41 2.07 -1.01 -2.83 116.25 116.32 2b39 h VAL 1146Ca 0.20 -0.56 0.07 0.00 0.82 0.00 0.00 66.70 67.24 2b39 h VAL 1146Cb 0.47 0.63 -0.06 0.00 -1.52 0.00 0.00 31.29 30.81 2b39 h VAL 1146CO -0.52 0.22 0.28 0.25 0.02 0.00 0.00 177.57 177.82 2b39 h LEU 1147N 0.67 0.36 -0.31 2.57 5.85 0.71 -0.70 115.31 124.47 2b39 h LEU 1147Ca 0.17 0.05 0.04 0.00 0.84 0.00 0.00 57.88 58.98 2b39 h LEU 1147Cb 0.12 -0.01 -0.04 0.00 0.37 0.00 0.00 40.66 41.11 2b39 h LEU 1147CO -0.02 0.23 0.10 0.40 -0.34 0.00 0.00 178.44 178.80 2b39 h ILE 1148N 0.52 0.90 0.71 4.05 2.04 -0.53 -0.73 117.51 124.46 2b39 h ILE 1148Ca 0.29 -0.08 -0.03 0.00 1.00 0.00 0.00 64.86 66.04 2b39 h ILE 1148Cb 0.28 0.66 -0.01 0.00 -0.74 0.00 0.00 36.82 37.01 2b39 h ILE 1148CO -0.24 0.04 -0.46 0.00 0.00 0.00 0.00 178.15 177.49 2b39 h ALA 1149N 1.20 -1.24 -0.23 1.87 0.00 -1.11 -1.32 119.26 118.44 2b39 h ALA 1149Ca 0.14 -0.23 0.07 0.00 0.00 0.00 0.00 54.91 54.89 2b39 h ALA 1149Cb 0.12 0.59 -0.01 0.00 0.00 0.00 0.00 17.79 18.49 2b39 h ALA 1149CO -0.15 -1.20 0.48 -0.07 0.00 0.00 0.00 179.25 178.31 2b39 h LEU 1150N -1.10 0.00 0.00 0.00 3.38 -1.00 0.51 115.31 117.10 2b39 h LEU 1150Ca -0.09 0.00 -0.17 0.00 0.09 0.00 0.00 57.88 57.71 2b39 h LEU 1150Cb 0.89 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.62 2b39 h LEU 1150CO 0.08 0.00 -0.93 -0.74 0.09 0.00 0.00 178.44 176.94 2b39 h HIS 1151N 0.00 0.00 0.12 1.13 2.76 -0.05 -2.79 115.15 116.32 2b39 h HIS 1151Ca 0.11 0.00 -0.27 0.00 -2.20 0.00 0.00 60.37 58.00 2b39 h HIS 1151Cb 1.07 0.00 0.01 0.00 1.55 0.00 0.00 27.41 30.04 2b39 h HIS 1151CO 0.00 0.71 -1.22 1.49 -1.30 0.00 0.00 177.93 177.62 2b39 h GLU 1152N 0.00 0.33 -0.83 5.26 4.57 0.86 -3.04 114.58 121.73 2b39 h GLU 1152Ca -0.06 -0.52 -0.12 0.00 -1.18 0.00 0.00 59.36 57.48 2b39 h GLU 1152Cb 1.60 0.19 -0.07 0.00 -0.16 0.00 0.00 28.75 30.30 2b39 h GLU 1152CO 0.08 1.23 0.16 0.00 -1.18 0.00 0.00 179.01 179.30 2b39 n ALA 1153N -2.56 3.80 0.44 2.92 0.00 -0.72 -4.49 120.51 119.91 2b39 n ALA 1153Ca -0.09 -1.46 -0.17 0.00 0.00 0.00 0.00 53.44 51.72 2b39 n ALA 1153Cb 1.00 -1.16 -0.08 0.00 0.00 0.00 0.00 19.45 19.21 2b39 n ALA 1153CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 2b39 h LYS 1154N 1.83 -1.09 -0.53 0.00 3.64 -1.37 -2.98 116.57 116.07 2b39 h LYS 1154Ca 0.15 0.07 -0.00 0.00 -1.27 0.00 0.00 60.65 59.60 2b39 h LYS 1154Cb 1.73 0.25 -0.03 0.00 -0.41 0.00 0.00 32.23 33.77 2b39 h LYS 1154CO 0.46 -0.73 0.31 -0.44 -2.27 0.00 0.00 179.45 176.79 2b39 h ASP 1155N -1.30 0.64 -0.55 4.20 3.32 -1.84 -2.16 116.42 118.72 2b39 h ASP 1155Ca -0.12 -0.06 0.07 0.00 0.02 0.00 0.00 57.03 56.94 2b39 h ASP 1155Cb 0.87 -0.16 -0.03 0.00 0.22 0.00 0.00 39.33 40.22 2b39 h ASP 1155CO 0.19 0.52 0.37 0.40 -1.72 0.00 0.00 179.24 178.99 2b39 h ILE 1156N 0.71 0.95 -0.27 0.35 5.03 -1.86 -2.29 117.51 120.13 2b39 h ILE 1156Ca 0.19 -0.15 -0.13 0.00 -0.12 0.00 0.00 64.86 64.64 2b39 h ILE 1156Cb -0.00 0.46 -0.08 0.00 -3.03 0.00 0.00 36.82 34.17 2b39 h ILE 1156CO -0.03 0.08 -0.17 0.00 -0.68 0.00 0.00 178.15 177.35 2b39 n GLU 1158N -1.11 0.00 0.08 0.00 4.07 -0.83 -2.33 120.64 120.52 2b39 n GLU 1158Ca 0.29 0.60 -0.08 0.00 -0.06 0.00 0.00 57.16 57.91 2b39 n GLU 1158Cb 0.95 -1.50 0.02 0.00 -0.06 0.00 0.00 31.44 30.85 2b39 n GLU 1158CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 2b39 h ALA 1159N -1.79 0.59 -0.69 4.31 0.00 -1.88 -3.31 119.26 116.49 2b39 h ALA 1159Ca 0.00 -0.67 0.14 0.00 0.00 0.00 0.00 54.91 54.38 2b39 h ALA 1159Cb 0.00 -0.07 -0.13 0.00 0.00 0.00 0.00 17.79 17.59 2b39 h ALA 1159CO 0.00 0.85 -0.10 1.96 0.00 0.00 0.00 179.25 181.96 2b39 h GLN 1160N 0.15 0.04 -6.23 0.00 1.08 -1.85 -3.40 115.11 104.89 2b39 h GLN 1160Ca -0.04 -0.00 -0.66 0.00 -1.45 0.00 0.00 58.65 56.50 2b39 h GLN 1160Cb 1.40 -0.01 -0.30 0.00 -0.05 0.00 0.00 27.48 28.52 2b39 h GLN 1160CO 0.13 0.02 -0.88 0.08 -0.95 0.00 0.00 178.83 177.23 2b39 s VAL 1161N -6.19 1.89 -2.02 -0.54 1.01 -0.98 -5.01 120.40 108.55 2b39 s VAL 1161Ca -0.14 -1.01 0.20 0.00 0.00 0.00 0.00 61.98 61.02 2b39 s VAL 1161Cb 0.21 -1.58 0.55 0.00 0.00 0.00 0.00 36.38 35.56 2b39 s VAL 1161CO 0.74 0.53 1.46 0.59 0.00 0.00 0.00 175.10 178.43 2b39 n ASN 1162N 2.63 3.36 -0.03 3.32 3.02 -1.26 -4.07 115.26 122.23 2b39 n ASN 1162Ca -0.16 -2.00 0.01 0.00 -0.03 0.00 0.00 54.58 52.40 2b39 n ASN 1162Cb 0.52 -0.41 -0.10 0.00 -0.61 0.00 0.00 39.78 39.18 2b39 n ASN 1162CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 2b39 n SER 1163N 1.34 1.93 -0.26 6.41 7.64 -1.26 -4.55 113.62 124.87 2b39 n SER 1163Ca 0.21 0.00 0.06 0.00 1.01 0.00 0.00 58.87 60.15 2b39 n SER 1163Cb 0.53 1.24 0.19 0.00 -1.01 0.00 0.00 64.21 65.16 2b39 n SER 1163CO 0.00 0.00 0.00 0.25 -3.01 0.00 0.00 175.04 172.28 2b39 h LEU 1164N 0.00 0.22 -0.17 -3.43 6.46 -1.89 0.58 115.31 117.09 2b39 h LEU 1164Ca -0.16 0.12 0.04 0.00 -0.12 0.00 0.00 57.88 57.76 2b39 h LEU 1164Cb 1.15 0.11 -0.04 0.00 -0.73 0.00 0.00 40.66 41.16 2b39 h LEU 1164CO 0.01 0.06 -0.07 1.23 -0.62 0.00 0.00 178.44 179.05 2b39 h GLY 1165N 0.40 0.08 1.21 3.75 0.00 -1.83 -2.60 103.07 104.08 2b39 h GLY 1165Ca 0.42 0.09 -0.30 0.00 0.00 0.00 0.00 47.33 47.55 2b39 h GLY 1165CO -0.43 -0.09 -1.25 3.21 0.00 0.00 0.00 176.54 177.97 2b39 h ARG 1166N -0.05 0.61 -0.63 4.80 2.47 -1.51 -3.26 114.38 116.82 2b39 h ARG 1166Ca 0.09 -0.84 0.09 0.00 -1.26 0.00 0.00 59.98 58.07 2b39 h ARG 1166Cb 0.19 0.28 -0.07 0.00 -1.65 0.00 0.00 29.97 28.72 2b39 h ARG 1166CO -0.20 1.38 0.25 1.03 0.56 0.00 0.00 179.97 183.00 2b39 h SER 1167N 0.25 0.28 0.48 7.04 0.87 0.16 -1.44 113.55 121.19 2b39 h SER 1167Ca -0.19 0.07 -0.02 0.00 -1.23 0.00 0.00 61.79 60.42 2b39 h SER 1167Cb 1.93 0.04 -0.00 0.00 -0.44 0.00 0.00 62.40 63.93 2b39 h SER 1167CO 0.24 0.16 -0.26 0.40 -0.53 0.00 0.00 176.83 176.84 2b39 h ILE 1168N 0.45 0.46 -0.64 2.23 2.04 -1.58 -2.64 117.51 117.82 2b39 h ILE 1168Ca 0.32 0.00 0.13 0.00 1.00 0.00 0.00 64.86 66.31 2b39 h ILE 1168Cb 0.38 0.46 -0.12 0.00 -0.74 0.00 0.00 36.82 36.80 2b39 h ILE 1168CO -0.30 0.00 -0.10 0.00 0.00 0.00 0.00 178.15 177.75 2b39 h ALA 1169N -0.19 0.50 -0.56 1.87 0.00 -1.46 -0.12 119.26 119.30 2b39 h ALA 1169Ca -0.06 0.23 0.07 0.00 0.00 0.00 0.00 54.91 55.16 2b39 h ALA 1169Cb 0.55 0.44 -0.06 0.00 0.00 0.00 0.00 17.79 18.72 2b39 h ALA 1169CO 0.08 -0.42 0.23 0.87 0.00 0.00 0.00 179.25 180.01 2b39 h LYS 1170N 0.04 0.42 0.11 0.00 1.57 -1.13 0.19 116.57 117.76 2b39 h LYS 1170Ca 0.32 -0.03 -0.01 0.00 -1.87 0.00 0.00 60.65 59.07 2b39 h LYS 1170Cb 0.51 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 32.72 2b39 h LYS 1170CO -0.62 0.28 -0.05 0.00 -0.57 0.00 0.00 179.45 178.48 2b39 h ALA 1171N 1.36 -0.15 -1.00 3.86 0.00 -0.90 -1.03 119.26 121.40 2b39 h ALA 1171Ca 0.27 -0.13 0.21 0.00 0.00 0.00 0.00 54.91 55.26 2b39 h ALA 1171Cb 0.28 0.06 -0.10 0.00 0.00 0.00 0.00 17.79 18.02 2b39 h ALA 1171CO -0.25 -0.47 0.62 0.78 0.00 0.00 0.00 179.25 179.93 2b39 h GLY 1172N -0.38 1.57 0.61 0.00 0.00 -0.50 -1.11 103.07 103.26 2b39 h GLY 1172Ca -0.02 -0.30 -0.01 0.00 0.00 0.00 0.00 47.33 47.00 2b39 h GLY 1172CO 0.03 -0.10 -0.12 -0.55 0.00 0.00 0.00 176.54 175.80 2b39 h ASP 1173N 0.62 -0.29 -1.01 0.19 3.32 -0.35 -2.20 116.42 116.71 2b39 h ASP 1173Ca 0.58 -0.22 0.24 0.00 0.02 0.00 0.00 57.03 57.65 2b39 h ASP 1173Cb 1.10 0.07 -0.10 0.00 0.22 0.00 0.00 39.33 40.63 2b39 h ASP 1173CO -0.35 0.11 0.64 0.15 -1.72 0.00 0.00 179.24 178.06 2b39 h PHE 1174N -0.74 0.77 -0.18 4.55 3.57 -0.27 0.17 116.94 124.82 2b39 h PHE 1174Ca -0.03 0.03 -0.21 0.00 3.53 0.00 0.00 57.97 61.28 2b39 h PHE 1174Cb 0.49 -0.23 0.01 0.00 2.79 0.00 0.00 35.95 39.01 2b39 h PHE 1174CO 0.04 0.10 -0.71 -0.07 -2.23 0.00 0.00 178.31 175.44 2b39 h LEU 1175N 0.49 0.90 -0.48 0.59 3.38 -1.23 -2.13 115.31 116.83 2b39 h LEU 1175Ca 0.58 -0.56 -0.03 0.00 0.09 0.00 0.00 57.88 57.96 2b39 h LEU 1175Cb 1.31 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 41.77 2b39 h LEU 1175CO -0.32 1.35 0.17 -0.08 0.09 0.00 0.00 178.44 179.64 2b39 h GLU 1176N 0.55 0.74 0.00 1.13 4.81 -0.10 -1.08 114.58 120.62 2b39 h GLU 1176Ca -0.03 -0.15 -0.21 0.00 -0.13 0.00 0.00 59.36 58.84 2b39 h GLU 1176Cb 1.32 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 30.59 2b39 h GLU 1176CO 0.15 0.69 -0.90 -0.91 -0.73 0.00 0.00 179.01 177.30 2b39 h ASN 1177N 0.64 0.36 -0.17 1.04 2.35 -0.98 -3.20 115.58 115.61 2b39 h ASN 1177Ca 0.16 -0.29 0.00 0.00 -0.55 0.00 0.00 56.30 55.62 2b39 h ASN 1177Cb 0.24 -0.11 0.00 0.00 0.05 0.00 0.00 38.32 38.50 2b39 h ASN 1177CO -0.01 1.09 0.00 1.41 -1.65 0.00 0.00 177.43 178.27 2b39 n HIS 1178N -3.69 0.22 -0.21 1.19 8.25 -0.80 -4.35 115.22 115.82 2b39 n HIS 1178Ca -0.05 -0.11 -0.09 0.00 -0.26 0.00 0.00 57.72 57.21 2b39 n HIS 1178Cb 0.82 0.00 0.03 0.00 1.12 0.00 0.00 29.99 31.95 2b39 n HIS 1178CO 0.00 0.00 0.00 -0.92 0.64 0.00 0.00 176.34 176.06 2b39 h TYR 1179N 2.42 1.18 -0.03 4.41 3.20 -1.19 -2.81 116.97 124.15 2b39 h TYR 1179Ca 0.00 -0.21 0.01 0.00 3.14 0.00 0.00 58.73 61.67 2b39 h TYR 1179Cb 0.53 -0.31 -0.00 0.00 1.54 0.00 0.00 36.73 38.49 2b39 h TYR 1179CO 0.11 1.04 0.20 0.07 -1.64 0.00 0.00 178.16 177.94 2b39 h ARG 1180N 0.98 0.00 0.00 1.82 0.11 -1.81 -1.94 114.38 113.55 2b39 h ARG 1180Ca 0.17 0.00 -0.19 0.00 0.10 0.00 0.00 59.98 60.06 2b39 h ARG 1180Cb 0.58 0.00 -0.03 0.00 1.11 0.00 0.00 29.97 31.63 2b39 h ARG 1180CO 0.03 0.00 -1.28 0.93 0.10 0.00 0.00 179.97 179.75 2b39 h GLU 1181N 0.00 0.00 -6.58 0.08 5.08 -1.81 -3.48 114.58 107.87 2b39 h GLU 1181Ca 0.02 0.00 -0.58 0.00 -1.00 0.00 0.00 59.36 57.79 2b39 h GLU 1181Cb 0.41 0.00 0.15 0.00 0.50 0.00 0.00 28.75 29.82 2b39 h GLU 1181CO -0.00 0.44 -0.12 1.28 -1.00 0.00 0.00 179.01 179.60 2b39 n LEU 1182N -3.02 1.77 0.00 1.33 4.77 -0.73 -4.86 117.00 116.25 2b39 n LEU 1182Ca -0.08 0.87 0.00 0.00 -0.03 0.00 0.00 56.01 56.77 2b39 n LEU 1182Cb 0.88 -1.26 0.00 0.00 -2.33 0.00 0.00 43.42 40.71 2b39 n LEU 1182CO 0.43 -2.31 -0.09 0.54 -1.33 0.00 0.00 177.39 174.64 2b39 n ARG 1183N -0.07 0.37 -2.72 3.23 1.74 -1.26 -5.02 116.66 112.93 2b39 n ARG 1183Ca 0.11 0.00 -0.41 0.00 -0.77 0.00 0.00 57.85 56.79 2b39 n ARG 1183Cb 0.43 -0.59 -0.05 0.00 -1.02 0.00 0.00 32.46 31.24 2b39 n ARG 1183CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 2b39 s ARG 1184N -1.18 4.73 0.12 5.56 0.52 -1.26 -4.95 118.95 122.49 2b39 s ARG 1184Ca 0.00 1.48 -0.30 0.00 -0.52 0.00 0.00 55.73 56.40 2b39 s ARG 1184Cb 0.00 -3.34 -0.10 0.00 0.52 0.00 0.00 34.95 32.03 2b39 s ARG 1184CO 0.00 0.29 1.49 -1.35 0.02 0.00 0.00 175.30 175.75 2b39 h PRO 1185N 5.15 -0.31 -0.63 3.54 0.11 -1.92 -0.57 132.00 137.37 2b39 h PRO 1185Ca -0.44 0.02 0.11 0.00 0.11 0.00 0.00 66.00 65.81 2b39 h PRO 1185Cb 1.21 0.07 -0.12 0.00 0.11 0.00 0.00 31.00 32.27 2b39 h PRO 1185CO 0.71 -0.21 -0.32 -0.92 -0.21 0.00 0.00 178.00 177.05 2b39 h TYR 1186N -0.32 -0.87 -0.44 0.65 3.20 -1.92 0.11 116.97 117.38 2b39 h TYR 1186Ca 0.07 0.07 -0.03 0.00 3.14 0.00 0.00 58.73 61.99 2b39 h TYR 1186Cb 0.52 0.48 -0.02 0.00 1.54 0.00 0.00 36.73 39.25 2b39 h TYR 1186CO -0.75 -0.37 0.17 1.15 -1.64 0.00 0.00 178.16 176.71 2b39 h THR 1187N -0.13 1.21 -0.49 1.81 2.02 -1.87 -1.11 112.91 114.34 2b39 h THR 1187Ca 0.25 -0.65 0.08 0.00 0.77 0.00 0.00 66.41 66.86 2b39 h THR 1187Cb 0.55 0.81 -0.06 0.00 -1.74 0.00 0.00 68.15 67.71 2b39 h THR 1187CO -0.71 0.24 0.14 0.58 0.37 0.00 0.00 175.52 176.14 2b39 h VAL 1188N 0.56 0.78 0.46 3.16 2.07 0.45 -2.00 116.25 121.73 2b39 h VAL 1188Ca 0.14 -0.10 -0.02 0.00 0.82 0.00 0.00 66.70 67.54 2b39 h VAL 1188Cb 0.21 0.46 0.00 0.00 -1.52 0.00 0.00 31.29 30.44 2b39 h VAL 1188CO -0.01 0.05 -0.22 0.00 0.02 0.00 0.00 177.57 177.41 2b39 h ALA 1189N 1.36 -0.62 -0.88 1.67 0.00 -0.60 -2.01 119.26 118.18 2b39 h ALA 1189Ca 0.24 -0.18 0.19 0.00 0.00 0.00 0.00 54.91 55.16 2b39 h ALA 1189Cb 0.29 0.24 -0.11 0.00 0.00 0.00 0.00 17.79 18.21 2b39 h ALA 1189CO -0.28 -0.62 0.43 0.97 0.00 0.00 0.00 179.25 179.75 2b39 h ILE 1190N -1.07 0.61 -0.02 0.00 -0.00 -1.22 0.49 117.51 116.30 2b39 h ILE 1190Ca -0.06 -0.18 -0.11 0.00 -0.00 0.00 0.00 64.86 64.50 2b39 h ILE 1190Cb 0.55 0.03 -0.02 0.00 -0.00 0.00 0.00 36.82 37.39 2b39 h ILE 1190CO 0.10 0.10 -0.53 0.00 -0.00 0.00 0.00 178.15 177.82 2b39 h ALA 1191N 1.64 1.10 -0.60 0.18 0.00 -1.42 -2.84 119.26 117.32 2b39 h ALA 1191Ca 0.52 -0.48 -0.08 0.00 0.00 0.00 0.00 54.91 54.87 2b39 h ALA 1191Cb 0.87 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.55 2b39 h ALA 1191CO -0.44 0.66 0.08 0.00 0.00 0.00 0.00 179.25 179.55 2b39 h ALA 1192N 1.44 0.80 -0.44 0.00 0.00 0.72 -1.67 119.26 120.11 2b39 h ALA 1192Ca -0.00 -0.27 -0.07 0.00 0.00 0.00 0.00 54.91 54.57 2b39 h ALA 1192Cb 0.94 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.49 2b39 h ALA 1192CO 0.07 0.57 -0.01 -0.92 0.00 0.00 0.00 179.25 178.97 2b39 h TYR 1193N 0.91 0.86 -0.11 0.00 3.20 -1.13 0.43 116.97 121.13 2b39 h TYR 1193Ca 0.18 -0.15 0.02 0.00 3.14 0.00 0.00 58.73 61.92 2b39 h TYR 1193Cb 0.45 -0.22 -0.02 0.00 1.54 0.00 0.00 36.73 38.48 2b39 h TYR 1193CO 0.03 0.84 -0.01 0.00 -1.64 0.00 0.00 178.16 177.39 2b39 h ALA 1194N 0.90 0.09 -0.36 1.82 0.00 -1.34 -1.13 119.26 119.24 2b39 h ALA 1194Ca 0.13 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.05 2b39 h ALA 1194Cb 0.50 0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.33 2b39 h ALA 1194CO 0.02 -0.47 0.17 -0.07 0.00 0.00 0.00 179.25 178.90 2b39 h LEU 1195N 0.03 0.48 -0.50 0.00 3.38 -1.10 -2.94 115.31 114.66 2b39 h LEU 1195Ca 0.05 -0.13 0.10 0.00 0.09 0.00 0.00 57.88 57.99 2b39 h LEU 1195Cb 0.06 -0.12 -0.10 0.00 0.09 0.00 0.00 40.66 40.59 2b39 h LEU 1195CO -0.09 0.48 -0.14 0.00 0.09 0.00 0.00 178.44 178.78 2b39 h ALA 1196N 1.02 0.30 -0.41 1.53 0.00 0.26 0.35 119.26 122.31 2b39 h ALA 1196Ca 0.12 0.19 0.12 0.00 0.00 0.00 0.00 54.91 55.34 2b39 h ALA 1196Cb 0.13 0.41 -0.02 0.00 0.00 0.00 0.00 17.79 18.31 2b39 h ALA 1196CO -0.01 -0.46 0.39 -0.07 0.00 0.00 0.00 179.25 179.10 2b39 h LEU 1197N -0.02 0.00 -2.08 0.00 3.38 -1.04 0.69 115.31 116.24 2b39 h LEU 1197Ca 0.24 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.21 2b39 h LEU 1197Cb 0.38 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.13 2b39 h LEU 1197CO -0.52 0.00 0.00 0.18 0.09 0.00 0.00 178.44 178.19 2b39 n LEU 1198N -3.90 3.18 0.00 1.67 4.77 0.98 -4.94 117.00 118.76 2b39 n LEU 1198Ca 0.07 -1.20 0.00 0.00 -0.03 0.00 0.00 56.01 54.85 2b39 n LEU 1198Cb 0.57 -0.11 0.00 0.00 -2.33 0.00 0.00 43.42 41.56 2b39 n LEU 1198CO 0.30 0.60 0.00 0.61 -1.33 0.00 0.00 177.39 177.57 2b39 n GLY 1199N 1.42 0.80 1.44 -0.72 0.00 0.24 -4.90 105.19 103.47 2b39 n GLY 1199Ca 0.16 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.10 2b39 n GLY 1199CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2b39 n LYS 1200N -2.00 1.42 -2.88 1.61 5.02 -0.48 -4.46 118.16 116.38 2b39 n LYS 1200Ca 0.00 -0.97 -0.35 0.00 -2.02 0.00 0.00 58.31 54.97 2b39 n LYS 1200Cb 0.00 -1.38 -0.01 0.00 -0.02 0.00 0.00 35.03 33.62 2b39 n LYS 1200CO 0.00 0.00 0.00 -0.11 -0.52 0.00 0.00 177.40 176.77 2b39 n LEU 1201N 0.07 5.83 -4.29 -0.35 7.94 -1.26 -4.76 117.00 120.17 2b39 n LEU 1201Ca 0.19 -5.48 -0.16 0.00 -1.11 0.00 0.00 56.01 49.45 2b39 n LEU 1201Cb 0.84 -0.91 -0.10 0.00 0.53 0.00 0.00 43.42 43.78 2b39 n LEU 1201CO 0.20 2.12 -0.40 -1.61 -1.11 0.00 0.00 177.39 176.60 2b39 s GLU 1202N -3.64 1.19 3.23 1.96 0.41 -1.26 -4.36 118.70 116.22 2b39 s GLU 1202Ca 0.42 -1.54 0.00 0.00 -0.41 0.00 0.00 54.97 53.44 2b39 s GLU 1202Cb 0.20 -0.74 0.00 0.00 -1.78 0.00 0.00 34.13 31.81 2b39 s GLU 1202CO -0.09 0.06 0.00 0.41 -0.49 0.00 0.00 175.26 175.15 2b39 n GLY 1203N -0.30 0.21 0.55 -1.39 0.00 -1.26 -3.39 105.19 99.61 2b39 n GLY 1203Ca -0.08 -0.90 0.39 0.00 0.00 0.00 0.00 46.02 45.42 2b39 n GLY 1203CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2b39 h ASP 1204N 5.79 0.12 0.23 1.61 5.19 -1.98 0.94 116.42 128.31 2b39 h ASP 1204Ca 0.00 0.04 -0.01 0.00 -0.62 0.00 0.00 57.03 56.44 2b39 h ASP 1204Cb 0.00 0.03 0.00 0.00 0.18 0.00 0.00 39.33 39.54 2b39 h ASP 1204CO 0.00 -0.03 -0.11 0.03 -3.12 0.00 0.00 179.24 176.01 2b39 h ARG 1205N 0.07 -0.30 -0.90 3.56 -0.00 -1.92 -1.84 114.38 113.05 2b39 h ARG 1205Ca 0.73 0.02 0.07 0.00 -0.50 0.00 0.00 59.98 60.30 2b39 h ARG 1205Cb 2.65 0.07 -0.06 0.00 0.00 0.00 0.00 29.97 32.63 2b39 h ARG 1205CO -0.14 0.02 0.57 1.25 0.00 0.00 0.00 179.97 181.66 2b39 h LEU 1206N -0.63 0.89 -0.68 3.04 7.12 -0.95 0.89 115.31 124.99 2b39 h LEU 1206Ca -0.03 0.02 -0.01 0.00 0.13 0.00 0.00 57.88 57.99 2b39 h LEU 1206Cb 0.45 -0.17 -0.00 0.00 -0.53 0.00 0.00 40.66 40.41 2b39 h LEU 1206CO 0.05 0.56 -0.03 0.00 -0.13 0.00 0.00 178.44 178.89 2b39 h THR 1207N 1.02 0.06 0.04 1.05 1.03 -1.33 -1.96 112.91 112.81 2b39 h THR 1207Ca 0.40 -0.84 -0.08 0.00 -0.01 0.00 0.00 66.41 65.88 2b39 h THR 1207Cb 0.19 1.79 0.01 0.00 -1.07 0.00 0.00 68.15 69.08 2b39 h THR 1207CO -0.18 0.03 -0.34 0.50 -0.01 0.00 0.00 175.52 175.52 2b39 h LYS 1208N 0.00 0.16 -0.28 0.00 3.64 -0.37 -1.96 116.57 117.75 2b39 h LYS 1208Ca -0.00 -0.22 0.07 0.00 -1.27 0.00 0.00 60.65 59.22 2b39 h LYS 1208Cb 0.79 0.08 -0.08 0.00 -0.41 0.00 0.00 32.23 32.61 2b39 h LYS 1208CO 0.00 1.05 -0.29 0.35 -2.27 0.00 0.00 179.45 178.29 2b39 h PHE 1209N -0.62 -0.78 -0.73 1.91 3.57 -0.79 -1.53 116.94 117.97 2b39 h PHE 1209Ca -0.05 0.05 -0.01 0.00 3.53 0.00 0.00 57.97 61.49 2b39 h PHE 1209Cb 1.20 0.38 -0.03 0.00 2.79 0.00 0.00 35.95 40.29 2b39 h PHE 1209CO 0.22 -0.36 0.43 -0.07 -2.23 0.00 0.00 178.31 176.30 2b39 h LEU 1210N -0.28 0.88 0.00 0.59 3.38 -1.41 -2.47 115.31 116.00 2b39 h LEU 1210Ca 0.14 -0.07 0.00 0.00 0.09 0.00 0.00 57.88 58.04 2b39 h LEU 1210Cb 0.51 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 41.03 2b39 h LEU 1210CO -0.44 0.69 0.00 0.59 0.09 0.00 0.00 178.44 179.37 2b39 n ASN 1211N -4.51 0.00 0.09 -0.43 3.02 -0.66 -2.42 115.26 110.35 2b39 n ASN 1211Ca 0.06 0.37 0.12 0.00 -0.03 0.00 0.00 54.58 55.10 2b39 n ASN 1211Cb 0.06 -0.44 0.20 0.00 -0.61 0.00 0.00 39.78 39.00 2b39 n ASN 1211CO 0.00 0.00 0.00 0.74 -2.62 0.00 0.00 177.26 175.38 2b39 h THR 1212N 0.00 0.00 -3.22 3.41 2.02 -0.85 -3.46 112.91 110.82 2b39 h THR 1212Ca 0.00 -0.60 -0.56 0.00 0.77 0.00 0.00 66.41 66.02 2b39 h THR 1212Cb 0.25 1.30 -0.05 0.00 -1.74 0.00 0.00 68.15 67.91 2b39 h THR 1212CO 0.00 0.00 1.07 0.00 0.37 0.00 0.00 175.52 176.96 2b39 s ALA 1213N -3.18 3.00 -0.05 6.16 0.00 -1.02 -4.77 121.76 121.90 2b39 s ALA 1213Ca 0.06 -0.29 -0.30 0.00 0.00 0.00 0.00 51.96 51.44 2b39 s ALA 1213Cb 0.12 -3.97 -0.05 0.00 0.00 0.00 0.00 23.12 19.21 2b39 s ALA 1213CO 0.70 -2.51 1.59 0.15 0.00 0.00 0.00 175.76 175.69 2b39 s LYS 1214N 5.04 4.20 -0.58 0.00 -0.14 -0.13 -2.65 119.74 125.48 2b39 s LYS 1214Ca 0.59 2.13 0.00 0.00 -1.36 0.00 0.00 55.97 57.33 2b39 s LYS 1214Cb -0.12 -3.89 0.00 0.00 -1.68 0.00 0.00 37.83 32.14 2b39 s LYS 1214CO 0.31 -0.79 0.00 0.39 -0.76 0.00 0.00 175.35 174.50 2b39 n GLU 1215N 6.76 -0.52 -0.67 1.68 -0.58 -1.26 -3.10 120.64 122.94 2b39 n GLU 1215Ca 0.16 0.62 0.00 0.00 -0.42 0.00 0.00 57.16 57.53 2b39 n GLU 1215Cb 0.43 -4.35 0.00 0.00 -0.57 0.00 0.00 31.44 26.95 2b39 n GLU 1215CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 2b39 n LYS 1216N -2.57 -0.17 0.00 3.49 5.02 -1.09 -4.72 118.16 118.12 2b39 n LYS 1216Ca -0.05 0.04 0.00 0.00 -2.02 0.00 0.00 58.31 56.28 2b39 n LYS 1216Cb 0.21 -4.03 0.00 0.00 -0.02 0.00 0.00 35.03 31.20 2b39 n LYS 1216CO 0.00 0.00 0.00 0.27 -0.52 0.00 0.00 177.40 177.15 2b39 n ASN 1217N -0.08 0.25 -3.67 4.39 2.04 -1.23 -4.67 115.26 112.29 2b39 n ASN 1217Ca 0.00 -0.61 -0.08 0.00 -0.44 0.00 0.00 54.58 53.45 2b39 n ASN 1217Cb 0.04 0.67 -0.02 0.00 -2.53 0.00 0.00 39.78 37.94 2b39 n ASN 1217CO 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 177.26 176.82 2b39 s ARG 1218N -0.67 1.84 -0.43 -3.83 3.03 -1.18 -3.80 118.95 113.92 2b39 s ARG 1218Ca 0.00 -1.16 0.02 0.00 2.03 0.00 0.00 55.73 56.62 2b39 s ARG 1218Cb 0.00 0.58 0.12 0.00 -1.03 0.00 0.00 34.95 34.63 2b39 s ARG 1218CO 0.00 -0.83 0.20 -1.58 -1.13 0.00 0.00 175.30 171.96 2b39 s TRP 1219N -3.58 2.47 0.17 5.89 0.51 -1.26 -0.95 118.94 122.19 2b39 s TRP 1219Ca 0.15 -2.60 0.07 0.00 -2.12 0.00 0.00 56.10 51.60 2b39 s TRP 1219Cb -0.05 -2.24 -0.04 0.00 -0.81 0.00 0.00 33.47 30.33 2b39 s TRP 1219CO 0.09 -0.81 -0.13 -1.83 -0.51 0.00 0.00 176.95 173.76 2b39 s GLU 1220N 0.43 1.19 -0.04 4.98 -1.05 -1.26 -3.99 118.70 118.96 2b39 s GLU 1220Ca 0.16 -1.47 0.03 0.00 -0.15 0.00 0.00 54.97 53.53 2b39 s GLU 1220Cb -0.23 -0.95 0.00 0.00 -0.44 0.00 0.00 34.13 32.51 2b39 s GLU 1220CO -0.04 0.16 -0.11 -2.00 0.95 0.00 0.00 175.26 174.22 2b39 s GLU 1221N -3.42 1.24 0.06 -4.83 2.12 -1.26 -4.84 118.70 107.77 2b39 s GLU 1221Ca 0.18 -0.38 -0.36 0.00 0.36 0.00 0.00 54.97 54.76 2b39 s GLU 1221Cb -0.01 -1.11 -0.19 0.00 0.26 0.00 0.00 34.13 33.08 2b39 s GLU 1221CO 0.04 0.12 0.97 -2.30 -0.54 0.00 0.00 175.26 173.55 2b39 n PRO 1222N 3.36 0.16 -3.40 4.30 -0.02 -1.26 -3.45 135.00 134.69 2b39 n PRO 1222Ca -0.19 0.06 -0.33 0.00 -2.02 0.00 0.00 63.50 61.01 2b39 n PRO 1222Cb 0.53 -1.45 0.03 0.00 -0.02 0.00 0.00 33.50 32.60 2b39 n PRO 1222CO 0.00 0.00 0.00 -1.71 1.98 0.00 0.00 175.50 175.77 2b39 n ASN 1223N 1.71 -5.92 -0.68 2.55 4.05 -1.26 -4.90 115.26 110.81 2b39 n ASN 1223Ca 0.19 -0.06 -0.03 0.00 0.45 0.00 0.00 54.58 55.13 2b39 n ASN 1223Cb 0.14 -2.32 -0.03 0.00 1.23 0.00 0.00 39.78 38.79 2b39 n ASN 1223CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 2b39 n GLN 1224N -0.28 0.00 0.00 1.20 1.13 -1.22 -5.09 117.38 113.11 2b39 n GLN 1224Ca -0.06 -0.46 0.00 0.00 -1.94 0.00 0.00 57.00 54.54 2b39 n GLN 1224Cb 0.65 0.31 0.00 0.00 0.11 0.00 0.00 30.24 31.30 2b39 n GLN 1224CO 0.00 0.00 0.00 1.63 -1.44 0.00 0.00 177.06 177.25 2b39 n LYS 1225N 0.00 0.00 0.02 -1.09 5.02 -1.26 -0.02 118.16 120.83 2b39 n LYS 1225Ca -0.13 0.00 0.22 0.00 -2.02 0.00 0.00 58.31 56.38 2b39 n LYS 1225Cb 0.50 0.00 0.73 0.00 -0.02 0.00 0.00 35.03 36.24 2b39 n LYS 1225CO 0.00 0.00 0.00 -0.07 -0.52 0.00 0.00 177.40 176.81 2b39 h LEU 1226N 0.00 0.00 -0.82 -0.35 3.38 -1.95 0.14 115.31 115.71 2b39 h LEU 1226Ca 0.00 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 57.84 2b39 h LEU 1226Cb 0.00 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 2b39 h LEU 1226CO 0.00 0.00 -0.55 1.88 0.09 0.00 0.00 178.44 179.86 2b39 h TYR 1227N 0.00 0.15 -0.18 1.13 0.05 -0.68 -2.37 116.97 115.06 2b39 h TYR 1227Ca 0.26 -0.05 -0.18 0.00 0.05 0.00 0.00 58.73 58.80 2b39 h TYR 1227Cb 1.22 -0.03 -0.00 0.00 1.01 0.00 0.00 36.73 38.93 2b39 h TYR 1227CO 0.00 0.64 -0.63 -0.91 -1.05 0.00 0.00 178.16 176.22 2b39 h ASN 1228N 0.09 0.71 -0.78 3.88 2.35 -0.23 -2.08 115.58 119.52 2b39 h ASN 1228Ca -0.00 -0.41 0.01 0.00 -0.55 0.00 0.00 56.30 55.35 2b39 h ASN 1228Cb 1.00 -0.21 -0.04 0.00 0.05 0.00 0.00 38.32 39.13 2b39 h ASN 1228CO 0.08 1.16 0.51 0.58 -1.65 0.00 0.00 177.43 178.11 2b39 h VAL 1229N 0.46 1.20 0.23 2.81 2.07 -1.08 0.35 116.25 122.29 2b39 h VAL 1229Ca -0.01 -0.37 -0.01 0.00 0.82 0.00 0.00 66.70 67.13 2b39 h VAL 1229Cb 1.20 0.06 0.00 0.00 -1.52 0.00 0.00 31.29 31.03 2b39 h VAL 1229CO 0.12 0.20 -0.11 -0.33 0.02 0.00 0.00 177.57 177.46 2b39 h GLU 1230N 1.06 -0.30 0.05 1.57 5.08 -1.32 -0.76 114.58 119.96 2b39 h GLU 1230Ca 0.29 0.02 0.02 0.00 -1.00 0.00 0.00 59.36 58.68 2b39 h GLU 1230Cb -0.12 0.07 -0.05 0.00 0.50 0.00 0.00 28.75 29.15 2b39 h GLU 1230CO -0.06 -0.04 -0.52 0.00 -1.00 0.00 0.00 179.01 177.39 2b39 h ALA 1231N 0.16 -0.95 -0.74 3.43 0.00 -0.88 0.13 119.26 120.42 2b39 h ALA 1231Ca -0.03 -0.09 0.11 0.00 0.00 0.00 0.00 54.91 54.90 2b39 h ALA 1231Cb 0.40 0.91 -0.08 0.00 0.00 0.00 0.00 17.79 19.03 2b39 h ALA 1231CO 0.05 -1.11 0.35 1.15 0.00 0.00 0.00 179.25 179.69 2b39 h THR 1232N -0.70 0.79 -0.41 0.00 2.02 -0.34 -0.12 112.91 114.15 2b39 h THR 1232Ca 0.01 -0.19 0.05 0.00 0.77 0.00 0.00 66.41 67.05 2b39 h THR 1232Cb 0.74 0.17 -0.05 0.00 -1.74 0.00 0.00 68.15 67.27 2b39 h THR 1232CO -0.33 0.10 0.13 0.28 0.37 0.00 0.00 175.52 176.08 2b39 h SER 1233N 0.57 0.12 -0.79 4.18 0.02 -0.02 0.31 113.55 117.93 2b39 h SER 1233Ca 0.38 0.05 0.04 0.00 -0.84 0.00 0.00 61.79 61.42 2b39 h SER 1233Cb 0.46 0.05 -0.05 0.00 0.14 0.00 0.00 62.40 63.01 2b39 h SER 1233CO -0.31 0.10 0.52 1.88 -1.14 0.00 0.00 176.83 177.88 2b39 h TYR 1234N 0.28 0.93 -0.12 3.45 -1.99 0.90 -1.50 116.97 118.92 2b39 h TYR 1234Ca 0.19 0.02 -0.00 0.00 2.00 0.00 0.00 58.73 60.94 2b39 h TYR 1234Cb 0.19 -0.31 -0.01 0.00 2.00 0.00 0.00 36.73 38.61 2b39 h TYR 1234CO -0.16 0.53 0.06 0.00 -0.00 0.00 0.00 178.16 178.59 2b39 h ALA 1235N 1.54 0.16 -0.15 3.88 0.00 0.60 -0.53 119.26 124.76 2b39 h ALA 1235Ca 0.32 -0.07 0.02 0.00 0.00 0.00 0.00 54.91 55.18 2b39 h ALA 1235Cb 0.07 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 2b39 h ALA 1235CO -0.10 -0.29 0.10 1.25 0.00 0.00 0.00 179.25 180.21 2b39 h LEU 1236N 0.08 0.10 -0.19 0.00 5.85 -0.36 0.24 115.31 121.03 2b39 h LEU 1236Ca 0.04 -0.00 -0.22 0.00 0.84 0.00 0.00 57.88 58.54 2b39 h LEU 1236Cb 0.10 -0.02 0.01 0.00 0.37 0.00 0.00 40.66 41.11 2b39 h LEU 1236CO -0.01 0.07 -0.77 -0.07 -0.34 0.00 0.00 178.44 177.33 2b39 h LEU 1237N 0.12 0.91 -0.29 2.25 3.38 -0.82 -2.24 115.31 118.61 2b39 h LEU 1237Ca 0.06 -0.59 -0.03 0.00 0.09 0.00 0.00 57.88 57.41 2b39 h LEU 1237Cb 0.10 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.57 2b39 h LEU 1237CO -0.01 1.39 0.07 0.00 0.09 0.00 0.00 178.44 179.98 2b39 h ALA 1238N 0.60 0.39 -0.04 1.53 0.00 0.58 0.30 119.26 122.62 2b39 h ALA 1238Ca -0.05 -0.17 -0.00 0.00 0.00 0.00 0.00 54.91 54.69 2b39 h ALA 1238Cb 1.39 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 19.07 2b39 h ALA 1238CO 0.16 0.05 0.02 -0.07 0.00 0.00 0.00 179.25 179.41 2b39 h LEU 1239N 0.31 0.05 -0.88 0.00 3.38 -0.65 -2.25 115.31 115.27 2b39 h LEU 1239Ca 0.09 -0.06 -0.01 0.00 0.09 0.00 0.00 57.88 57.99 2b39 h LEU 1239Cb 0.29 -0.01 -0.04 0.00 0.09 0.00 0.00 40.66 40.98 2b39 h LEU 1239CO 0.00 0.10 0.52 -0.07 0.09 0.00 0.00 178.44 179.08 2b39 h LEU 1240N -0.00 1.06 -2.26 1.67 3.38 -1.29 0.35 115.31 118.22 2b39 h LEU 1240Ca 0.01 -0.08 0.04 0.00 0.09 0.00 0.00 57.88 57.95 2b39 h LEU 1240Cb 0.06 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.53 2b39 h LEU 1240CO -0.00 0.83 0.23 0.00 0.09 0.00 0.00 178.44 179.58 2b39 h ALA 1241N 1.28 1.62 -0.57 1.53 0.00 0.06 0.46 119.26 123.64 2b39 h ALA 1241Ca 0.31 -0.00 -0.05 0.00 0.00 0.00 0.00 54.91 55.16 2b39 h ALA 1241Cb -0.03 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.74 2b39 h ALA 1241CO -0.06 -0.30 0.06 0.54 0.00 0.00 0.00 179.25 179.50 2b39 n ARG 1242N -3.49 4.37 -4.25 0.00 1.74 0.12 -4.91 116.66 110.23 2b39 n ARG 1242Ca 0.01 -3.12 -0.36 0.00 -0.77 0.00 0.00 57.85 53.61 2b39 n ARG 1242Cb 0.33 -2.21 -0.03 0.00 -1.02 0.00 0.00 32.46 29.53 2b39 n ARG 1242CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 2b39 n LYS 1243N 0.28 -2.85 -1.73 5.56 4.76 0.16 -4.80 118.16 119.54 2b39 n LYS 1243Ca 0.30 0.34 -0.37 0.00 -2.87 0.00 0.00 58.31 55.71 2b39 n LYS 1243Cb 1.21 -4.98 0.04 0.00 -1.84 0.00 0.00 35.03 29.46 2b39 n LYS 1243CO 0.00 0.00 0.00 -3.47 -1.37 0.00 0.00 177.40 172.56 2b39 n ASP 1244N -2.66 7.45 -0.37 4.39 -0.08 -0.67 -4.79 116.55 119.82 2b39 n ASP 1244Ca 0.05 -3.75 0.31 0.00 -1.51 0.00 0.00 54.79 49.88 2b39 n ASP 1244Cb 0.50 -1.07 0.62 0.00 2.34 0.00 0.00 41.12 43.52 2b39 n ASP 1244CO 0.00 0.00 0.00 1.88 0.12 0.00 0.00 177.20 179.20 2b39 h TYR 1245N 2.75 0.42 -0.17 -0.67 0.05 -1.87 -1.04 116.97 116.44 2b39 h TYR 1245Ca 0.56 0.02 -0.14 0.00 0.05 0.00 0.00 58.73 59.21 2b39 h TYR 1245Cb 0.27 -0.12 -0.01 0.00 1.01 0.00 0.00 36.73 37.89 2b39 h TYR 1245CO 1.25 -0.02 -0.49 -0.44 -1.05 0.00 0.00 178.16 177.41 2b39 h ASP 1246N 0.20 0.50 0.49 3.88 5.19 -1.99 -3.17 116.42 121.51 2b39 h ASP 1246Ca 0.65 -0.24 0.00 0.00 -0.62 0.00 0.00 57.03 56.82 2b39 h ASP 1246Cb 2.05 -0.14 0.00 0.00 0.18 0.00 0.00 39.33 41.42 2b39 h ASP 1246CO -0.23 0.90 0.00 0.41 -3.12 0.00 0.00 179.24 177.20 2b39 n THR 1247N -3.98 0.08 -0.05 0.35 -1.04 -0.39 -4.32 114.28 104.92 2b39 n THR 1247Ca -0.02 0.02 0.01 0.00 -2.04 0.00 0.00 64.05 62.02 2b39 n THR 1247Cb 0.56 -0.56 -0.15 0.00 -1.82 0.00 0.00 70.33 68.36 2b39 n THR 1247CO 0.00 0.00 0.00 0.35 -0.64 0.00 0.00 175.07 174.78 2b39 n THR 1248N -1.26 0.58 -0.33 12.58 -2.24 -1.20 -4.66 114.28 117.74 2b39 n THR 1248Ca 0.14 -0.60 0.15 0.00 -2.27 0.00 0.00 64.05 61.47 2b39 n THR 1248Cb 0.21 -0.21 0.31 0.00 -2.10 0.00 0.00 70.33 68.54 2b39 n THR 1248CO 0.00 0.00 0.00 -0.65 -0.57 0.00 0.00 175.07 173.85 2b39 h PRO 1249N 0.00 0.03 -0.49 -0.78 0.11 -1.75 -0.42 132.00 128.70 2b39 h PRO 1249Ca -0.23 -0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.87 2b39 h PRO 1249Cb 1.47 -0.01 -0.02 0.00 0.11 0.00 0.00 31.00 32.55 2b39 h PRO 1249CO 0.01 0.02 0.27 -1.35 -0.21 0.00 0.00 178.00 176.74 2b39 h PRO 1250N 0.03 0.68 -0.55 1.05 0.11 -1.90 -1.75 132.00 129.66 2b39 h PRO 1250Ca 0.61 -0.08 0.04 0.00 0.11 0.00 0.00 66.00 66.68 2b39 h PRO 1250Cb 1.28 -0.13 -0.04 0.00 0.11 0.00 0.00 31.00 32.21 2b39 h PRO 1250CO -0.88 0.52 0.31 0.28 -0.21 0.00 0.00 178.00 178.02 2b39 h VAL 1251N 0.65 1.00 -0.12 3.15 2.07 -1.20 -0.82 116.25 120.97 2b39 h VAL 1251Ca 0.17 -0.20 0.02 0.00 0.82 0.00 0.00 66.70 67.51 2b39 h VAL 1251Cb 0.04 0.35 -0.02 0.00 -1.52 0.00 0.00 31.29 30.14 2b39 h VAL 1251CO -0.03 0.11 0.00 0.58 0.02 0.00 0.00 177.57 178.25 2b39 h VAL 1252N 0.59 0.92 -0.09 2.57 2.07 -0.98 -0.72 116.25 120.60 2b39 h VAL 1252Ca 0.24 -0.02 0.01 0.00 0.82 0.00 0.00 66.70 67.75 2b39 h VAL 1252Cb 0.10 0.87 -0.01 0.00 -1.52 0.00 0.00 31.29 30.73 2b39 h VAL 1252CO -0.14 0.01 0.01 0.03 0.02 0.00 0.00 177.57 177.50 2b39 h ARG 1253N 0.05 0.05 0.20 1.57 3.08 -0.90 0.41 114.38 118.83 2b39 h ARG 1253Ca 0.06 -0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.10 2b39 h ARG 1253Cb 0.07 -0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.10 2b39 h ARG 1253CO -0.10 0.03 -0.16 2.35 -1.07 0.00 0.00 179.97 181.02 2b39 h TRP 1254N 0.05 -0.45 -0.83 3.04 7.01 -1.01 -2.10 115.95 121.66 2b39 h TRP 1254Ca 0.04 0.00 0.19 0.00 2.11 0.00 0.00 58.89 61.24 2b39 h TRP 1254Cb 0.04 0.17 -0.16 0.00 -2.10 0.00 0.00 29.16 27.11 2b39 h TRP 1254CO -0.11 -0.23 -0.11 1.28 -2.79 0.00 0.00 178.44 176.48 2b39 n LEU 1255N -3.30 -0.21 0.30 0.65 4.77 -0.29 0.13 117.00 119.05 2b39 n LEU 1255Ca -0.04 1.42 0.18 0.00 -0.03 0.00 0.00 56.01 57.54 2b39 n LEU 1255Cb 0.16 -0.47 0.92 0.00 -2.33 0.00 0.00 43.42 41.70 2b39 n LEU 1255CO 0.09 -1.40 1.15 -1.13 -1.33 0.00 0.00 177.39 174.78 2b39 h ASN 1256N 0.00 0.00 -0.24 -1.43 -0.73 -0.22 -2.75 115.58 110.22 2b39 h ASN 1256Ca 0.45 0.00 0.00 0.00 1.87 0.00 0.00 56.30 58.62 2b39 h ASN 1256Cb 0.80 0.00 0.00 0.00 0.27 0.00 0.00 38.32 39.39 2b39 h ASN 1256CO -0.82 0.00 0.00 -1.84 -0.37 0.00 0.00 177.43 174.40 2b39 n GLU 1257N -3.13 2.91 -1.75 6.67 0.28 0.34 -4.69 120.64 121.28 2b39 n GLU 1257Ca -0.01 -1.89 -0.36 0.00 -0.16 0.00 0.00 57.16 54.75 2b39 n GLU 1257Cb 0.31 -1.19 0.01 0.00 1.43 0.00 0.00 31.44 32.00 2b39 n GLU 1257CO 0.00 0.00 0.00 1.04 -0.16 0.00 0.00 177.13 178.01 2b39 n GLN 1258N 0.20 2.63 -3.00 3.44 1.13 -1.04 -4.71 117.38 116.03 2b39 n GLN 1258Ca 0.08 -3.13 -0.43 0.00 -1.94 0.00 0.00 57.00 51.57 2b39 n GLN 1258Cb 0.37 -2.22 0.01 0.00 0.11 0.00 0.00 30.24 28.51 2b39 n GLN 1258CO 0.00 0.00 0.00 0.54 -1.44 0.00 0.00 177.06 176.16 2b39 n ARG 1259N -0.13 4.11 0.00 -1.09 1.74 -1.26 -4.71 116.66 115.31 2b39 n ARG 1259Ca 0.53 -4.37 0.14 0.00 -0.77 0.00 0.00 57.85 53.37 2b39 n ARG 1259Cb 0.35 -2.60 0.54 0.00 -1.02 0.00 0.00 32.46 29.74 2b39 n ARG 1259CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 2b39 n TYR 1260N 2.16 0.00 -3.74 -1.55 4.02 -1.10 -3.78 117.16 113.17 2b39 n TYR 1260Ca 0.28 0.00 -0.36 0.00 -0.01 0.00 0.00 57.90 57.81 2b39 n TYR 1260Cb 0.35 -0.10 -0.10 0.00 -0.02 0.00 0.00 39.34 39.47 2b39 n TYR 1260CO 0.00 0.00 0.00 0.71 -1.01 0.00 0.00 176.86 176.56 2b39 s TYR 1261N -2.32 3.41 -0.81 -0.72 1.51 0.04 -4.62 117.35 113.83 2b39 s TYR 1261Ca 0.31 -2.73 0.00 0.00 -1.01 0.00 0.00 57.07 53.64 2b39 s TYR 1261Cb 0.20 -3.18 0.00 0.00 -0.11 0.00 0.00 41.96 38.87 2b39 s TYR 1261CO 0.44 -0.84 0.00 0.41 -1.11 0.00 0.00 175.55 174.45 2b39 n GLY 1262N 3.52 0.92 0.44 0.71 0.00 -1.26 -1.32 105.19 108.20 2b39 n GLY 1262Ca 0.07 -0.33 0.00 0.00 0.00 0.00 0.00 46.02 45.77 2b39 n GLY 1262CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2b39 n GLY 1263N -1.30 0.76 2.56 -0.02 0.00 -1.25 -4.91 105.19 101.03 2b39 n GLY 1263Ca -0.08 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.74 2b39 n GLY 1263CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2b39 n GLY 1264N -2.09 3.54 0.18 -0.02 0.00 -0.44 -4.82 105.19 101.54 2b39 n GLY 1264Ca 0.00 -2.15 0.01 0.00 0.00 0.00 0.00 46.02 43.88 2b39 n GLY 1264CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2b39 n TYR 1265N -0.76 0.10 0.00 1.61 4.02 -1.26 -0.78 117.16 120.08 2b39 n TYR 1265Ca -0.08 -0.05 0.00 0.00 -0.01 0.00 0.00 57.90 57.76 2b39 n TYR 1265Cb 0.46 -0.01 0.00 0.00 -0.02 0.00 0.00 39.34 39.77 2b39 n TYR 1265CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2b39 n GLY 1266N 0.56 0.00 3.88 2.72 0.00 -1.26 -4.48 105.19 106.61 2b39 n GLY 1266Ca 0.02 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.78 2b39 n GLY 1266CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2b39 s SER 1267N 0.00 4.62 0.00 1.61 0.15 -1.26 -0.21 113.70 118.61 2b39 s SER 1267Ca 0.00 -1.22 0.00 0.00 0.70 0.00 0.00 55.95 55.43 2b39 s SER 1267Cb 0.00 0.27 0.00 0.00 -1.71 0.00 0.00 66.02 64.58 2b39 s SER 1267CO 0.00 -1.01 0.47 0.35 1.20 0.00 0.00 173.24 174.25 2b39 n THR 1268N -1.68 0.00 -0.31 6.45 -2.24 -1.26 -2.60 114.28 112.65 2b39 n THR 1268Ca -0.02 0.94 0.11 0.00 -2.27 0.00 0.00 64.05 62.81 2b39 n THR 1268Cb 0.64 -1.90 0.28 0.00 -2.10 0.00 0.00 70.33 67.25 2b39 n THR 1268CO 0.00 0.00 0.00 1.56 -0.57 0.00 0.00 175.07 176.06 2b39 h GLN 1269N 0.00 0.50 0.70 -0.78 1.08 -1.97 0.16 115.11 114.80 2b39 h GLN 1269Ca 0.00 -0.03 -0.03 0.00 -1.45 0.00 0.00 58.65 57.14 2b39 h GLN 1269Cb 0.00 -0.11 -0.00 0.00 -0.05 0.00 0.00 27.48 27.31 2b39 h GLN 1269CO 0.00 0.33 -0.43 0.00 -0.95 0.00 0.00 178.83 177.77 2b39 h ALA 1270N 1.65 -1.23 -0.89 3.87 0.00 -1.87 -0.22 119.26 120.57 2b39 h ALA 1270Ca 0.53 -0.22 0.11 0.00 0.00 0.00 0.00 54.91 55.33 2b39 h ALA 1270Cb 0.91 0.55 -0.07 0.00 0.00 0.00 0.00 17.79 19.18 2b39 h ALA 1270CO -0.46 -1.19 0.57 1.15 0.00 0.00 0.00 179.25 179.32 2b39 h THR 1271N -1.06 0.92 -0.23 0.00 2.02 -1.11 0.64 112.91 114.09 2b39 h THR 1271Ca -0.09 -0.28 -0.18 0.00 0.77 0.00 0.00 66.41 66.63 2b39 h THR 1271Cb 0.85 0.03 -0.00 0.00 -1.74 0.00 0.00 68.15 67.29 2b39 h THR 1271CO 0.09 0.15 -0.57 -0.26 0.37 0.00 0.00 175.52 175.30 2b39 h PHE 1272N 0.82 0.91 0.22 3.16 0.04 -0.56 -3.00 116.94 118.53 2b39 h PHE 1272Ca 0.42 -0.33 -0.01 0.00 2.80 0.00 0.00 57.97 60.85 2b39 h PHE 1272Cb 0.51 -0.17 0.00 0.00 2.20 0.00 0.00 35.95 38.49 2b39 h PHE 1272CO -0.00 1.12 -0.11 0.52 -0.60 0.00 0.00 178.31 179.24 2b39 h MET 1273N 0.55 -0.29 -0.89 1.51 2.86 0.25 -2.44 114.93 116.48 2b39 h MET 1273Ca 0.01 0.02 0.20 0.00 -2.06 0.00 0.00 59.70 57.86 2b39 h MET 1273Cb 1.15 0.07 -0.11 0.00 0.06 0.00 0.00 31.60 32.76 2b39 h MET 1273CO 0.12 -0.19 0.42 -0.24 1.06 0.00 0.00 176.91 178.07 2b39 h VAL 1274N -0.47 0.56 0.05 -2.22 3.04 -1.08 -0.23 116.25 115.90 2b39 h VAL 1274Ca -0.03 -0.17 -0.00 0.00 -1.01 0.00 0.00 66.70 65.49 2b39 h VAL 1274Cb 0.23 0.03 0.00 0.00 -2.01 0.00 0.00 31.29 29.54 2b39 h VAL 1274CO 0.05 0.09 -0.02 0.15 -1.01 0.00 0.00 177.57 176.83 2b39 h PHE 1275N 0.49 -0.06 0.64 3.17 -0.00 -1.62 0.38 116.94 119.94 2b39 h PHE 1275Ca 0.53 -0.00 -0.02 0.00 -0.00 0.00 0.00 57.97 58.48 2b39 h PHE 1275Cb 0.94 0.02 -0.01 0.00 -0.00 0.00 0.00 35.95 36.90 2b39 h PHE 1275CO -0.11 0.01 -0.46 0.37 -0.00 0.00 0.00 178.31 178.12 2b39 h GLN 1276N -0.12 -1.02 -0.57 1.11 4.15 -0.58 0.91 115.11 118.99 2b39 h GLN 1276Ca -0.01 0.07 0.11 0.00 0.77 0.00 0.00 58.65 59.60 2b39 h GLN 1276Cb 0.10 0.23 -0.11 0.00 0.21 0.00 0.00 27.48 27.91 2b39 h GLN 1276CO 0.01 -0.68 -0.16 0.00 -1.93 0.00 0.00 178.83 176.07 2b39 h ALA 1277N -0.88 0.34 -0.37 3.38 0.00 -1.10 0.21 119.26 120.85 2b39 h ALA 1277Ca -0.08 0.22 0.06 0.00 0.00 0.00 0.00 54.91 55.11 2b39 h ALA 1277Cb 0.87 0.46 -0.05 0.00 0.00 0.00 0.00 17.79 19.07 2b39 h ALA 1277CO 0.04 -0.45 0.04 -0.07 0.00 0.00 0.00 179.25 178.81 2b39 h LEU 1278N -0.02 -0.06 -0.69 0.00 3.38 0.06 -2.05 115.31 115.93 2b39 h LEU 1278Ca 0.27 0.07 0.01 0.00 0.09 0.00 0.00 57.88 58.32 2b39 h LEU 1278Cb 0.43 0.11 -0.04 0.00 0.09 0.00 0.00 40.66 41.26 2b39 h LEU 1278CO -0.59 0.00 0.45 0.00 0.09 0.00 0.00 178.44 178.39 2b39 h ALA 1279N 1.30 0.87 0.00 1.53 0.00 0.10 -1.97 119.26 121.10 2b39 h ALA 1279Ca 0.18 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.04 2b39 h ALA 1279Cb 0.23 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 17.75 2b39 h ALA 1279CO -0.26 0.28 0.00 1.04 0.00 0.00 0.00 179.25 180.31 2b39 n GLN 1280N -4.62 0.63 -0.09 0.00 6.02 0.55 0.31 117.38 120.18 2b39 n GLN 1280Ca 0.06 0.00 -0.17 0.00 -0.01 0.00 0.00 57.00 56.88 2b39 n GLN 1280Cb 0.03 -1.46 -0.09 0.00 1.02 0.00 0.00 30.24 29.74 2b39 n GLN 1280CO 0.00 0.00 0.00 -0.92 -1.01 0.00 0.00 177.06 175.13 2b39 h TYR 1281N 0.00 0.00 -0.18 1.08 3.20 -1.09 -3.19 116.97 116.79 2b39 h TYR 1281Ca 0.00 0.00 -0.11 0.00 3.14 0.00 0.00 58.73 61.76 2b39 h TYR 1281Cb 0.00 0.00 -0.01 0.00 1.54 0.00 0.00 36.73 38.26 2b39 h TYR 1281CO 0.00 1.08 -0.35 1.96 -1.64 0.00 0.00 178.16 179.20 2b39 h GLN 1282N -1.00 0.38 -0.47 1.82 7.50 -1.41 0.24 115.11 122.16 2b39 h GLN 1282Ca -0.23 -0.17 0.10 0.00 0.50 0.00 0.00 58.65 58.85 2b39 h GLN 1282Cb 1.06 -0.01 -0.09 0.00 0.05 0.00 0.00 27.48 28.49 2b39 h GLN 1282CO -0.14 0.68 -0.18 -0.22 -1.50 0.00 0.00 178.83 177.48 2b39 h LYS 1283N 0.32 -0.07 -0.08 1.46 3.64 -0.28 -3.08 116.57 118.48 2b39 h LYS 1283Ca 0.04 0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.40 2b39 h LYS 1283Cb 0.77 0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 32.60 2b39 h LYS 1283CO 0.06 -0.05 -0.12 -0.40 -2.27 0.00 0.00 179.45 176.68 2b39 n ASP 1284N -5.38 2.47 -2.88 4.20 5.68 -1.03 -4.63 116.55 114.97 2b39 n ASP 1284Ca 0.04 -3.33 -0.12 0.00 -0.50 0.00 0.00 54.79 50.88 2b39 n ASP 1284Cb 0.29 -0.49 0.02 0.00 -1.14 0.00 0.00 41.12 39.80 2b39 n ASP 1284CO 0.00 0.00 0.00 0.52 -1.33 0.00 0.00 177.20 176.39 2b39 n VAL 1285N -1.19 0.31 -1.66 2.12 0.31 0.80 -5.04 118.33 113.99 2b39 n VAL 1285Ca 0.19 -3.32 -0.45 0.00 -0.01 0.00 0.00 64.34 60.75 2b39 n VAL 1285Cb 0.73 0.43 -0.03 0.00 -0.91 0.00 0.00 33.84 34.06 2b39 n VAL 1285CO 0.00 0.00 0.00 -2.65 -1.32 0.00 0.00 176.83 172.86 2b39 n PRO 1286N 0.06 1.89 -1.02 5.55 -0.02 -1.21 -4.65 135.00 135.61 2b39 n PRO 1286Ca 0.14 0.67 -0.00 0.00 -2.02 0.00 0.00 63.50 62.28 2b39 n PRO 1286Cb 0.75 -2.28 -0.01 0.00 -0.02 0.00 0.00 33.50 31.93 2b39 n PRO 1286CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 2b39 n ASP 1287N 1.94 0.09 0.31 2.55 8.00 -1.26 -4.94 116.55 123.24 2b39 n ASP 1287Ca 0.11 -1.85 -0.15 0.00 0.71 0.00 0.00 54.79 53.61 2b39 n ASP 1287Cb 0.31 -0.07 -0.07 0.00 -0.02 0.00 0.00 41.12 41.27 2b39 n ASP 1287CO 0.00 0.00 0.00 0.45 -0.39 0.00 0.00 177.20 177.26 2b39 h HIS 1288N 0.37 -0.74 -0.34 1.24 3.86 -1.96 -3.11 115.15 114.48 2b39 h HIS 1288Ca -0.25 -0.02 0.07 0.00 -1.16 0.00 0.00 60.37 59.02 2b39 h HIS 1288Cb 1.53 0.25 -0.08 0.00 1.06 0.00 0.00 27.41 30.16 2b39 h HIS 1288CO -0.01 -0.41 -0.32 1.57 0.86 0.00 0.00 177.93 179.62 2b39 h LYS 1289N -1.09 -0.27 0.00 2.45 -0.00 -1.95 0.12 116.57 115.83 2b39 h LYS 1289Ca -0.08 0.02 0.00 0.00 -0.00 0.00 0.00 60.65 60.59 2b39 h LYS 1289Cb 0.67 0.06 0.00 0.00 -0.00 0.00 0.00 32.23 32.96 2b39 h LYS 1289CO 0.13 -0.18 0.02 -0.85 -0.00 0.00 0.00 179.45 178.57 2b39 n GLU 1290N -5.41 0.09 -1.68 0.07 0.00 -1.24 -4.44 120.64 108.03 2b39 n GLU 1290Ca 0.00 0.59 -0.45 0.00 0.00 0.00 0.00 57.16 57.30 2b39 n GLU 1290Cb 0.33 -1.83 -0.04 0.00 0.00 0.00 0.00 31.44 29.90 2b39 n GLU 1290CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.13 177.02 2b39 n LEU 1291N -2.01 3.70 -3.03 -1.84 7.94 0.43 -4.48 117.00 117.71 2b39 n LEU 1291Ca -0.01 1.00 0.02 0.00 -1.11 0.00 0.00 56.01 55.91 2b39 n LEU 1291Cb 0.04 -1.47 -0.00 0.00 0.53 0.00 0.00 43.42 42.52 2b39 n LEU 1291CO 0.06 0.02 0.27 0.21 -1.11 0.00 0.00 177.39 176.85 2b39 s ASN 1292N 2.83 -0.99 -0.07 1.96 2.47 0.16 -2.05 114.94 119.25 2b39 s ASN 1292Ca 0.85 -0.40 -0.01 0.00 0.42 0.00 0.00 52.86 53.71 2b39 s ASN 1292Cb -0.57 1.32 -0.03 0.00 -1.45 0.00 0.00 41.25 40.51 2b39 s ASN 1292CO 0.42 -0.12 0.01 -0.76 -3.72 0.00 0.00 177.10 172.93 2b39 s LEU 1293N 2.05 3.62 -0.44 3.21 1.43 0.22 -2.33 118.68 126.44 2b39 s LEU 1293Ca 0.16 0.13 0.04 0.00 -1.03 0.00 0.00 54.13 53.43 2b39 s LEU 1293Cb -0.02 -1.88 0.12 0.00 0.03 0.00 0.00 46.19 44.44 2b39 s LEU 1293CO -0.13 0.36 0.17 -0.62 0.23 0.00 0.00 176.35 176.36 2b39 s ASP 1294N -1.04 4.44 0.20 2.29 -1.08 0.80 -1.25 116.67 121.03 2b39 s ASP 1294Ca 0.15 -2.62 -0.10 0.00 -0.52 0.00 0.00 52.55 49.46 2b39 s ASP 1294Cb -0.11 -1.57 -0.07 0.00 -1.46 0.00 0.00 42.92 39.71 2b39 s ASP 1294CO 0.04 -0.30 0.52 -0.69 0.52 0.00 0.00 175.17 175.27 2b39 s VAL 1295N 0.27 4.95 -0.25 1.11 1.01 -0.99 -1.84 120.40 124.67 2b39 s VAL 1295Ca 0.14 0.49 -0.02 0.00 0.00 0.00 0.00 61.98 62.59 2b39 s VAL 1295Cb -0.23 -3.64 0.11 0.00 0.00 0.00 0.00 36.38 32.63 2b39 s VAL 1295CO -0.04 0.01 0.25 -0.55 0.00 0.00 0.00 175.10 174.77 2b39 s SER 1296N -2.23 1.65 0.03 3.32 0.15 0.33 -2.21 113.70 114.74 2b39 s SER 1296Ca 0.44 -0.52 -0.25 0.00 0.70 0.00 0.00 55.95 56.32 2b39 s SER 1296Cb -0.12 0.40 -0.05 0.00 -1.71 0.00 0.00 66.02 64.54 2b39 s SER 1296CO 0.21 -0.36 0.77 -0.63 1.20 0.00 0.00 173.24 174.43 2b39 s ILE 1297N 2.33 4.78 -0.48 6.45 1.01 -0.33 -1.94 121.20 133.03 2b39 s ILE 1297Ca 0.08 1.63 0.03 0.00 0.00 0.00 0.00 60.65 62.40 2b39 s ILE 1297Cb -0.15 -4.12 0.14 0.00 0.01 0.00 0.00 42.46 38.34 2b39 s ILE 1297CO -0.23 0.33 0.28 -1.58 0.00 0.00 0.00 174.94 173.74 2b39 s GLN 1298N 0.14 1.52 0.08 2.79 -0.44 -0.76 -1.50 119.66 121.49 2b39 s GLN 1298Ca 0.39 -2.29 -0.30 0.00 -2.50 0.00 0.00 55.36 50.67 2b39 s GLN 1298Cb -0.20 -2.57 -0.05 0.00 -1.64 0.00 0.00 33.01 28.55 2b39 s GLN 1298CO 0.23 -1.19 1.04 -0.51 0.50 0.00 0.00 175.29 175.36 2b39 s LEU 1299N -0.01 4.43 0.54 3.68 1.02 -1.26 -3.47 118.68 123.62 2b39 s LEU 1299Ca 0.20 1.86 0.33 0.00 0.02 0.00 0.00 54.13 56.53 2b39 s LEU 1299Cb -0.20 -3.58 1.41 0.00 0.02 0.00 0.00 46.19 43.83 2b39 s LEU 1299CO -0.03 -0.24 2.00 1.55 0.02 0.00 0.00 176.35 179.65 2b39 h PRO 1300N 6.12 0.00 0.10 1.29 0.13 -1.89 -2.89 132.00 134.85 2b39 h PRO 1300Ca -0.42 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.70 2b39 h PRO 1300Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.35 2b39 h PRO 1300CO 0.75 0.05 -0.05 0.66 -0.23 0.00 0.00 178.00 179.18 2b39 h SER 1301N 0.00 -0.11 -3.92 1.44 4.64 -1.92 -3.42 113.55 110.25 2b39 h SER 1301Ca -0.00 -0.10 -0.46 0.00 -0.47 0.00 0.00 61.79 60.76 2b39 h SER 1301Cb 0.49 0.03 -0.02 0.00 -0.31 0.00 0.00 62.40 62.58 2b39 h SER 1301CO 0.01 0.03 0.25 -0.13 -0.87 0.00 0.00 176.83 176.11 2b39 s ARG 1302N -5.71 4.16 -0.05 4.77 0.52 -1.09 -5.03 118.95 116.52 2b39 s ARG 1302Ca -0.14 0.96 -0.10 0.00 -0.52 0.00 0.00 55.73 55.92 2b39 s ARG 1302Cb 0.05 -2.30 -0.06 0.00 0.52 0.00 0.00 34.95 33.16 2b39 s ARG 1302CO 0.65 0.05 0.43 -2.95 0.02 0.00 0.00 175.30 173.50 2b39 h ASN 1303N 2.10 -0.31 -3.88 0.23 7.08 -1.83 -3.44 115.58 115.53 2b39 h ASN 1303Ca -0.48 0.01 -0.49 0.00 -3.08 0.00 0.00 56.30 52.25 2b39 h ASN 1303Cb 1.18 0.08 0.03 0.00 -2.08 0.00 0.00 38.32 37.53 2b39 h ASN 1303CO 0.63 0.13 0.22 -0.94 -2.08 0.00 0.00 177.43 175.39 2b39 s SER 1304N -5.06 6.38 0.30 6.14 1.04 -1.26 -5.04 113.70 116.20 2b39 s SER 1304Ca -0.05 1.19 -0.15 0.00 0.48 0.00 0.00 55.95 57.42 2b39 s SER 1304Cb 0.01 -2.36 -0.09 0.00 0.10 0.00 0.00 66.02 63.68 2b39 s SER 1304CO 0.16 -0.60 0.72 0.00 0.98 0.00 0.00 173.24 174.51 2b39 s ALA 1305N -2.72 3.35 -0.12 5.32 0.00 -1.26 -4.82 121.76 121.50 2b39 s ALA 1305Ca 0.52 0.03 -0.10 0.00 0.00 0.00 0.00 51.96 52.41 2b39 s ALA 1305Cb -0.10 -2.75 -0.05 0.00 0.00 0.00 0.00 23.12 20.22 2b39 s ALA 1305CO 0.41 0.35 0.21 0.54 0.00 0.00 0.00 175.76 177.26 2b39 s VAL 1306N -1.92 5.38 -0.03 0.00 0.11 -0.56 -5.00 120.40 118.38 2b39 s VAL 1306Ca 0.52 0.36 0.01 0.00 -2.93 0.00 0.00 61.98 59.94 2b39 s VAL 1306Cb -0.11 -3.50 0.02 0.00 -1.53 0.00 0.00 36.38 31.26 2b39 s VAL 1306CO 0.18 0.54 -0.02 -0.60 -3.33 0.00 0.00 175.10 171.87 2b39 s ARG 1307N -0.50 0.43 0.37 1.54 3.52 -1.26 -1.18 118.95 121.86 2b39 s ARG 1307Ca 0.15 -0.03 0.08 0.00 -0.13 0.00 0.00 55.73 55.81 2b39 s ARG 1307Cb -0.13 -0.52 -0.07 0.00 -1.56 0.00 0.00 34.95 32.68 2b39 s ARG 1307CO 0.04 -0.06 -0.04 -1.01 -0.81 0.00 0.00 175.30 173.43 2b39 s HIS 1308N 0.69 2.47 -0.08 5.12 3.76 -0.94 -5.03 115.29 121.28 2b39 s HIS 1308Ca -0.07 -0.56 -0.04 0.00 -0.15 0.00 0.00 55.06 54.24 2b39 s HIS 1308Cb -0.11 -1.57 0.04 0.00 1.11 0.00 0.00 32.58 32.06 2b39 s HIS 1308CO -0.01 0.51 0.18 0.50 -0.85 0.00 0.00 174.74 175.07 2b39 s ARG 1309N -3.67 0.10 -0.11 1.40 3.52 -1.26 -2.34 118.95 116.60 2b39 s ARG 1309Ca 0.34 0.47 0.01 0.00 -0.13 0.00 0.00 55.73 56.42 2b39 s ARG 1309Cb 0.05 -0.18 0.02 0.00 -1.56 0.00 0.00 34.95 33.28 2b39 s ARG 1309CO 0.18 -0.21 -0.12 0.42 -0.81 0.00 0.00 175.30 174.76 2b39 s ILE 1310N 1.54 1.29 0.14 4.11 1.01 -0.38 -4.96 121.20 123.95 2b39 s ILE 1310Ca -0.06 -0.49 0.03 0.00 0.00 0.00 0.00 60.65 60.13 2b39 s ILE 1310Cb -0.11 -1.22 -0.04 0.00 0.01 0.00 0.00 42.46 41.09 2b39 s ILE 1310CO -0.07 0.40 -0.05 -1.48 0.00 0.00 0.00 174.94 173.75 2b39 s LEU 1311N 1.25 2.37 0.34 2.97 2.34 -1.26 0.69 118.68 127.38 2b39 s LEU 1311Ca -0.02 -1.07 0.14 0.00 0.06 0.00 0.00 54.13 53.24 2b39 s LEU 1311Cb -0.14 -0.16 1.13 0.00 -0.56 0.00 0.00 46.19 46.46 2b39 s LEU 1311CO -0.04 -0.46 1.54 1.87 -1.06 0.00 0.00 176.35 178.20 2b39 n TRP 1312N -0.18 0.97 0.34 3.48 -0.00 -0.87 -1.13 117.44 120.05 2b39 n TRP 1312Ca -0.09 1.16 -0.14 0.00 -0.00 0.00 0.00 57.50 58.43 2b39 n TRP 1312Cb 0.62 -1.45 -0.06 0.00 -0.00 0.00 0.00 31.31 30.41 2b39 n TRP 1312CO 0.00 0.00 0.00 1.49 -0.00 0.00 0.00 177.69 179.18 2b39 h GLU 1313N 0.00 -0.86 -3.15 5.87 4.81 -1.90 -3.48 114.58 115.88 2b39 h GLU 1313Ca 0.75 0.06 -0.32 0.00 -0.13 0.00 0.00 59.36 59.72 2b39 h GLU 1313Cb 1.88 0.19 0.08 0.00 0.63 0.00 0.00 28.75 31.54 2b39 h GLU 1313CO -0.81 -0.57 -0.51 -1.13 -0.73 0.00 0.00 179.01 175.26 2b39 n SER 1314N -5.01 -1.56 0.00 1.04 3.41 -0.29 -4.87 113.62 106.34 2b39 n SER 1314Ca -0.11 0.42 0.00 0.00 -0.26 0.00 0.00 58.87 58.91 2b39 n SER 1314Cb 0.35 -0.46 0.00 0.00 -0.26 0.00 0.00 64.21 63.84 2b39 n SER 1314CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2b39 n ALA 1315N -0.57 0.00 -2.52 7.33 0.00 -1.26 -4.71 120.51 118.78 2b39 n ALA 1315Ca 0.06 0.00 -0.25 0.00 0.00 0.00 0.00 53.44 53.24 2b39 n ALA 1315Cb 0.21 0.38 -0.10 0.00 0.00 0.00 0.00 19.45 19.94 2b39 n ALA 1315CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2b39 s SER 1316N -2.95 3.63 -0.05 0.00 0.15 -1.26 -4.99 113.70 108.22 2b39 s SER 1316Ca 0.00 -1.17 0.18 0.00 0.70 0.00 0.00 55.95 55.66 2b39 s SER 1316Cb 0.00 -0.33 0.60 0.00 -1.71 0.00 0.00 66.02 64.58 2b39 s SER 1316CO 0.00 -0.17 1.51 0.18 1.20 0.00 0.00 173.24 175.96 2b39 n LEU 1317N -0.75 4.04 -4.41 3.45 4.77 -1.26 -4.88 117.00 117.96 2b39 n LEU 1317Ca -0.05 -2.23 -0.25 0.00 -0.03 0.00 0.00 56.01 53.44 2b39 n LEU 1317Cb 0.63 -0.47 -0.11 0.00 -2.33 0.00 0.00 43.42 41.13 2b39 n LEU 1317CO 0.42 0.85 -0.52 -0.76 -1.33 0.00 0.00 177.39 176.06 2b39 s LEU 1318N -1.44 2.45 -0.29 2.23 1.43 -1.26 -1.44 118.68 120.35 2b39 s LEU 1318Ca 0.44 -0.88 0.00 0.00 -1.03 0.00 0.00 54.13 52.66 2b39 s LEU 1318Cb 0.26 -1.09 0.19 0.00 0.03 0.00 0.00 46.19 45.59 2b39 s LEU 1318CO 0.25 0.08 0.71 -0.13 0.23 0.00 0.00 176.35 177.49 2b39 s ARG 1319N -2.77 0.46 0.03 1.70 1.81 -1.18 -5.01 118.95 113.99 2b39 s ARG 1319Ca 0.20 0.53 0.01 0.00 -1.72 0.00 0.00 55.73 54.75 2b39 s ARG 1319Cb -0.07 0.26 0.01 0.00 -0.45 0.00 0.00 34.95 34.70 2b39 s ARG 1319CO 0.10 -0.77 0.04 -1.13 -0.68 0.00 0.00 175.30 172.85 2b39 n SER 1320N 5.37 0.29 -3.41 0.23 3.41 -1.26 -2.58 113.62 115.66 2b39 n SER 1320Ca 0.04 -1.09 0.01 0.00 -0.26 0.00 0.00 58.87 57.57 2b39 n SER 1320Cb 0.54 -0.02 -0.05 0.00 -0.26 0.00 0.00 64.21 64.43 2b39 n SER 1320CO 0.00 0.00 0.00 -0.70 -0.16 0.00 0.00 175.04 174.18 2b39 s GLU 1321N -2.15 0.23 0.26 4.33 2.56 -0.16 -4.97 118.70 118.80 2b39 s GLU 1321Ca 0.03 0.52 0.07 0.00 0.00 0.00 0.00 54.97 55.59 2b39 s GLU 1321Cb -0.00 0.26 -0.03 0.00 2.00 0.00 0.00 34.13 36.35 2b39 s GLU 1321CO 0.02 -0.07 0.24 -1.21 -0.56 0.00 0.00 175.26 173.68 2b39 s GLU 1322N 2.06 3.00 -0.18 4.30 8.01 -1.26 -0.46 118.70 134.17 2b39 s GLU 1322Ca -0.03 -1.02 -0.19 0.00 0.01 0.00 0.00 54.97 53.73 2b39 s GLU 1322Cb -0.04 -2.62 0.05 0.00 -4.31 0.00 0.00 34.13 27.21 2b39 s GLU 1322CO -0.16 0.37 0.54 -0.08 0.01 0.00 0.00 175.26 175.94 2b39 s THR 1323N -2.12 0.00 -0.33 3.63 -1.32 -0.96 -4.99 115.64 109.56 2b39 s THR 1323Ca 0.34 -0.03 0.09 0.00 -1.21 0.00 0.00 61.69 60.87 2b39 s THR 1323Cb -0.08 -0.76 0.59 0.00 -1.51 0.00 0.00 72.50 70.74 2b39 s THR 1323CO 0.26 -0.02 1.64 0.29 -2.21 0.00 0.00 174.62 174.58 2b39 n LYS 1324N 2.55 2.36 -0.05 7.08 5.02 -1.26 -0.16 118.16 133.69 2b39 n LYS 1324Ca -0.14 -3.08 -0.21 0.00 -2.02 0.00 0.00 58.31 52.85 2b39 n LYS 1324Cb 0.56 -1.98 -0.13 0.00 -0.02 0.00 0.00 35.03 33.46 2b39 n LYS 1324CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 2b39 n GLU 1325N -0.92 0.71 -3.11 1.97 -0.58 -1.26 -4.73 120.64 112.71 2b39 n GLU 1325Ca 0.40 0.24 -0.04 0.00 -0.42 0.00 0.00 57.16 57.34 2b39 n GLU 1325Cb 1.25 -1.64 0.02 0.00 -0.57 0.00 0.00 31.44 30.50 2b39 n GLU 1325CO 0.00 0.00 0.00 -1.71 -0.48 0.00 0.00 177.13 174.94 2b39 n ASN 1326N -3.49 -7.50 -3.81 1.62 5.15 -1.26 -5.04 115.26 100.93 2b39 n ASN 1326Ca -0.38 -0.24 -0.16 0.00 -0.60 0.00 0.00 54.58 53.20 2b39 n ASN 1326Cb 1.00 -5.28 -0.16 0.00 -0.53 0.00 0.00 39.78 34.81 2b39 n ASN 1326CO 0.00 0.00 0.00 -1.61 1.40 0.00 0.00 177.26 177.05 2b39 s GLU 1327N -3.37 0.21 0.38 1.20 2.02 -1.26 -4.82 118.70 113.06 2b39 s GLU 1327Ca 0.12 0.09 -0.26 0.00 0.02 0.00 0.00 54.97 54.94 2b39 s GLU 1327Cb -0.02 -0.41 -0.11 0.00 0.10 0.00 0.00 34.13 33.70 2b39 s GLU 1327CO 0.75 -0.13 1.16 2.89 0.02 0.00 0.00 175.26 179.95 2b39 n ARG 1328N 4.08 1.73 -1.69 1.61 -4.01 -1.26 -4.75 116.66 112.36 2b39 n ARG 1328Ca -0.26 0.61 0.00 0.00 -1.04 0.00 0.00 57.85 57.16 2b39 n ARG 1328Cb 0.51 -2.19 0.00 0.00 -3.04 0.00 0.00 32.46 27.73 2b39 n ARG 1328CO 0.00 0.00 0.00 1.97 -3.04 0.00 0.00 177.63 176.56 2b39 n PHE 1329N -0.09 0.00 -4.04 2.89 1.16 0.05 -4.48 117.46 112.96 2b39 n PHE 1329Ca 0.07 0.00 -0.09 0.00 -1.87 0.00 0.00 57.45 55.57 2b39 n PHE 1329Cb 0.37 0.00 -0.09 0.00 -1.61 0.00 0.00 39.48 38.16 2b39 n PHE 1329CO 0.00 0.00 0.00 0.95 -1.87 0.00 0.00 176.76 175.84 2b39 s THR 1330N -1.72 0.14 -0.03 1.97 -4.23 -1.23 -1.68 115.64 108.87 2b39 s THR 1330Ca 0.00 -1.64 -0.01 0.00 -1.18 0.00 0.00 61.69 58.87 2b39 s THR 1330Cb 0.00 -1.71 0.03 0.00 1.34 0.00 0.00 72.50 72.16 2b39 s THR 1330CO 0.00 -0.63 0.04 -0.69 -0.54 0.00 0.00 174.62 172.80 2b39 s VAL 1331N -3.96 -0.07 -0.04 2.29 1.01 0.13 -1.83 120.40 117.94 2b39 s VAL 1331Ca 0.14 0.27 0.02 0.00 0.00 0.00 0.00 61.98 62.41 2b39 s VAL 1331Cb 0.06 -0.10 -0.03 0.00 0.00 0.00 0.00 36.38 36.31 2b39 s VAL 1331CO -0.05 0.11 -0.08 -0.54 0.00 0.00 0.00 175.10 174.54 2b39 s LYS 1332N 1.33 2.62 -0.01 2.72 1.02 -0.82 0.04 119.74 126.64 2b39 s LYS 1332Ca -0.06 -0.65 0.01 0.00 0.02 0.00 0.00 55.97 55.29 2b39 s LYS 1332Cb -0.13 -2.51 0.01 0.00 -0.52 0.00 0.00 37.83 34.68 2b39 s LYS 1332CO -0.03 0.63 -0.02 0.00 -0.92 0.00 0.00 175.35 175.01 2b39 s ALA 1333N -0.86 0.27 0.13 5.17 0.00 -0.80 -0.51 121.76 125.15 2b39 s ALA 1333Ca 0.14 -0.01 0.03 0.00 0.00 0.00 0.00 51.96 52.12 2b39 s ALA 1333Cb -0.11 -0.16 -0.04 0.00 0.00 0.00 0.00 23.12 22.81 2b39 s ALA 1333CO 0.03 0.01 -0.08 -1.21 0.00 0.00 0.00 175.76 174.52 2b39 s GLU 1334N 0.34 0.96 0.00 0.00 2.02 -0.77 -1.59 118.70 119.66 2b39 s GLU 1334Ca -0.03 -1.40 0.00 0.00 0.02 0.00 0.00 54.97 53.56 2b39 s GLU 1334Cb -0.06 -0.42 0.00 0.00 0.10 0.00 0.00 34.13 33.75 2b39 s GLU 1334CO -0.01 0.02 0.00 0.41 0.02 0.00 0.00 175.26 175.71 2b39 n GLY 1335N -0.13 1.10 3.84 -1.39 0.00 -1.26 -0.14 105.19 107.21 2b39 n GLY 1335Ca -0.11 -2.05 -0.32 0.00 0.00 0.00 0.00 46.02 43.54 2b39 n GLY 1335CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2b39 s LYS 1336N -1.69 4.06 0.00 1.61 1.02 -0.98 -4.25 119.74 119.50 2b39 s LYS 1336Ca 0.00 0.82 0.00 0.00 0.02 0.00 0.00 55.97 56.81 2b39 s LYS 1336Cb 0.00 -2.33 0.00 0.00 -0.52 0.00 0.00 37.83 34.98 2b39 s LYS 1336CO 0.00 0.05 0.00 0.41 -0.92 0.00 0.00 175.35 174.89 2b39 n GLY 1337N -0.61 2.01 3.05 -3.33 0.00 -1.26 -0.67 105.19 104.38 2b39 n GLY 1337Ca 0.05 -1.97 -0.10 0.00 0.00 0.00 0.00 46.02 44.00 2b39 n GLY 1337CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2b39 s GLN 1338N -1.51 0.29 0.00 1.61 0.74 -1.23 -4.24 119.66 115.32 2b39 s GLN 1338Ca 0.00 0.74 0.00 0.00 0.05 0.00 0.00 55.36 56.15 2b39 s GLN 1338Cb 0.00 -0.14 0.00 0.00 1.10 0.00 0.00 33.01 33.97 2b39 s GLN 1338CO 0.00 -0.43 0.00 0.41 -0.55 0.00 0.00 175.29 174.72 2b39 n GLY 1339N 5.37 5.44 3.13 2.59 0.00 0.35 -4.03 105.19 118.04 2b39 n GLY 1339Ca -0.06 -1.21 -0.12 0.00 0.00 0.00 0.00 46.02 44.63 2b39 n GLY 1339CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2b39 s THR 1340N 1.62 0.06 -0.05 2.61 2.01 -0.74 -1.17 115.64 119.99 2b39 s THR 1340Ca 0.00 -0.52 0.02 0.00 0.31 0.00 0.00 61.69 61.50 2b39 s THR 1340Cb 0.00 -0.45 0.01 0.00 0.01 0.00 0.00 72.50 72.07 2b39 s THR 1340CO 0.00 -0.28 -0.10 -0.22 -0.69 0.00 0.00 174.62 173.33 2b39 s LEU 1341N -1.10 1.62 0.08 4.42 2.96 -0.25 -0.93 118.68 125.48 2b39 s LEU 1341Ca -0.12 -0.23 0.01 0.00 -0.22 0.00 0.00 54.13 53.57 2b39 s LEU 1341Cb -0.06 -0.68 -0.04 0.00 0.50 0.00 0.00 46.19 45.91 2b39 s LEU 1341CO 0.02 0.03 -0.06 -0.94 -1.32 0.00 0.00 176.35 174.07 2b39 s SER 1342N 0.58 1.02 -0.23 3.68 1.04 -1.04 -0.77 113.70 117.97 2b39 s SER 1342Ca -0.11 -0.94 -0.04 0.00 0.48 0.00 0.00 55.95 55.35 2b39 s SER 1342Cb -0.14 0.10 0.09 0.00 0.10 0.00 0.00 66.02 66.18 2b39 s SER 1342CO 0.02 -0.44 0.17 -0.69 0.98 0.00 0.00 173.24 173.28 2b39 s VAL 1343N -3.34 -0.21 -0.20 5.02 1.01 0.17 -2.49 120.40 120.37 2b39 s VAL 1343Ca 0.08 -0.36 -0.00 0.00 0.00 0.00 0.00 61.98 61.70 2b39 s VAL 1343Cb 0.03 -0.78 0.02 0.00 0.00 0.00 0.00 36.38 35.65 2b39 s VAL 1343CO -0.05 -0.41 -0.14 -0.69 0.00 0.00 0.00 175.10 173.81 2b39 s VAL 1344N 2.22 2.45 -0.12 2.92 1.01 -0.91 0.23 120.40 128.20 2b39 s VAL 1344Ca 0.07 -0.90 -0.04 0.00 0.00 0.00 0.00 61.98 61.11 2b39 s VAL 1344Cb -0.16 -2.10 -0.03 0.00 0.00 0.00 0.00 36.38 34.09 2b39 s VAL 1344CO -0.21 0.44 0.02 0.42 0.00 0.00 0.00 175.10 175.77 2b39 s THR 1345N 1.32 4.48 -0.09 3.92 -4.23 -0.59 -1.57 115.64 118.87 2b39 s THR 1345Ca 0.04 -0.17 0.00 0.00 -1.18 0.00 0.00 61.69 60.38 2b39 s THR 1345Cb -0.14 -2.93 -0.03 0.00 1.34 0.00 0.00 72.50 70.75 2b39 s THR 1345CO -0.09 0.57 -0.08 0.54 -0.54 0.00 0.00 174.62 175.01 2b39 s VAL 1346N -0.52 3.56 0.03 2.29 0.11 0.57 -2.19 120.40 124.25 2b39 s VAL 1346Ca 0.09 -0.51 -0.00 0.00 -2.93 0.00 0.00 61.98 58.63 2b39 s VAL 1346Cb -0.12 -2.48 0.00 0.00 -1.53 0.00 0.00 36.38 32.25 2b39 s VAL 1346CO 0.02 0.56 0.04 0.00 -3.33 0.00 0.00 175.10 172.40 2b39 n TYR 1347N 2.72 -0.71 -4.05 1.54 0.18 0.19 -1.61 117.16 115.41 2b39 n TYR 1347Ca -0.18 -0.17 -0.32 0.00 1.88 0.00 0.00 57.90 59.12 2b39 n TYR 1347Cb 0.53 0.05 -0.16 0.00 -0.38 0.00 0.00 39.34 39.38 2b39 n TYR 1347CO 0.00 0.00 0.00 -1.01 -2.08 0.00 0.00 176.86 173.77 2b39 s HIS 1348N -6.06 2.77 0.56 -3.48 3.76 -1.26 -1.46 115.29 110.12 2b39 s HIS 1348Ca 0.02 -1.82 0.07 0.00 -0.15 0.00 0.00 55.06 53.18 2b39 s HIS 1348Cb -0.00 -1.81 0.07 0.00 1.11 0.00 0.00 32.58 31.96 2b39 s HIS 1348CO 0.01 -0.80 0.61 0.00 -0.85 0.00 0.00 174.74 173.71 2b39 n ALA 1349N 4.59 1.05 -2.69 -1.40 0.00 -0.25 0.14 120.51 121.95 2b39 n ALA 1349Ca -0.16 -2.15 0.00 0.00 0.00 0.00 0.00 53.44 51.13 2b39 n ALA 1349Cb 0.46 0.73 0.00 0.00 0.00 0.00 0.00 19.45 20.65 2b39 n ALA 1349CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2b39 n LYS 1350N -2.03 0.00 -4.15 0.00 5.02 -0.65 -1.38 118.16 114.97 2b39 n LYS 1350Ca 0.08 0.00 -0.16 0.00 -2.02 0.00 0.00 58.31 56.20 2b39 n LYS 1350Cb 0.61 0.00 -0.12 0.00 -0.02 0.00 0.00 35.03 35.50 2b39 n LYS 1350CO 0.00 0.00 0.00 -0.48 -0.52 0.00 0.00 177.40 176.40 2b39 s LEU 1351N 0.00 2.25 -0.24 -0.35 2.34 -1.26 -4.66 118.68 116.76 2b39 s LEU 1351Ca 0.00 -0.56 0.14 0.00 0.06 0.00 0.00 54.13 53.77 2b39 s LEU 1351Cb 0.00 -0.38 0.65 0.00 -0.56 0.00 0.00 46.19 45.90 2b39 s LEU 1351CO 0.00 -0.11 1.60 0.29 -1.06 0.00 0.00 176.35 177.07 2b39 n LYS 1352N 1.47 3.50 0.00 1.48 5.02 -1.26 -5.03 118.16 123.34 2b39 n LYS 1352Ca -0.21 -3.02 0.00 0.00 -2.02 0.00 0.00 58.31 53.06 2b39 n LYS 1352Cb 0.54 -2.04 0.00 0.00 -0.02 0.00 0.00 35.03 33.52 2b39 n LYS 1352CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2b39 n GLY 1353N -0.21 1.81 0.00 0.72 0.00 -1.26 -3.54 105.19 102.71 2b39 n GLY 1353Ca 0.29 -0.25 0.00 0.00 0.00 0.00 0.00 46.02 46.05 2b39 n GLY 1353CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2b39 n LYS 1354N 0.00 0.41 -2.42 1.61 5.02 -1.26 -5.02 118.16 116.50 2b39 n LYS 1354Ca 0.00 -0.03 -0.33 0.00 -2.02 0.00 0.00 58.31 55.93 2b39 n LYS 1354Cb 0.00 -0.32 -0.03 0.00 -0.02 0.00 0.00 35.03 34.66 2b39 n LYS 1354CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 2b39 s VAL 1355N -0.07 4.10 -0.94 -0.18 1.01 -1.23 -4.00 120.40 119.10 2b39 s VAL 1355Ca 0.00 1.14 -0.03 0.00 0.00 0.00 0.00 61.98 63.10 2b39 s VAL 1355Cb 0.00 -3.53 -0.03 0.00 0.00 0.00 0.00 36.38 32.82 2b39 s VAL 1355CO 0.00 -0.45 0.80 -1.20 0.00 0.00 0.00 175.10 174.26 2b39 n SER 1356N -1.35 -4.06 -3.04 3.32 7.64 -1.26 -4.78 113.62 110.08 2b39 n SER 1356Ca 0.08 -0.56 -0.10 0.00 1.01 0.00 0.00 58.87 59.30 2b39 n SER 1356Cb 0.53 -4.42 -0.03 0.00 -1.01 0.00 0.00 64.21 59.28 2b39 n SER 1356CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2b39 s LYS 1358N 0.94 2.43 -0.05 0.00 -2.85 -0.64 -4.70 119.74 114.87 2b39 s LYS 1358Ca 0.27 -0.79 0.00 0.00 -1.00 0.00 0.00 55.97 54.44 2b39 s LYS 1358Cb -0.02 -2.26 0.00 0.00 -2.06 0.00 0.00 37.83 33.49 2b39 s LYS 1358CO -0.08 0.55 0.00 1.63 0.10 0.00 0.00 175.35 177.55 2b39 n LYS 1359N 2.50 -0.24 -3.61 1.78 4.76 -1.26 -1.62 118.16 120.46 2b39 n LYS 1359Ca -0.17 0.16 -0.11 0.00 -2.87 0.00 0.00 58.31 55.32 2b39 n LYS 1359Cb 0.52 -3.42 -0.04 0.00 -1.84 0.00 0.00 35.03 30.24 2b39 n LYS 1359CO 0.00 0.00 0.00 -0.06 -1.37 0.00 0.00 177.40 175.97 2b39 s PHE 1360N -1.92 -0.23 -0.02 2.13 0.08 -1.26 -3.08 117.98 113.68 2b39 s PHE 1360Ca 0.00 -0.07 0.06 0.00 0.12 0.00 0.00 56.93 57.04 2b39 s PHE 1360Cb 0.00 0.29 -0.02 0.00 -0.57 0.00 0.00 43.02 42.72 2b39 s PHE 1360CO 0.00 -0.72 -0.21 -0.51 -0.10 0.00 0.00 175.22 173.69 2b39 s ASP 1361N -2.80 2.43 -0.24 1.36 1.01 0.19 -4.88 116.67 113.75 2b39 s ASP 1361Ca 0.03 -0.37 -0.08 0.00 0.71 0.00 0.00 52.55 52.83 2b39 s ASP 1361Cb 0.02 -0.29 0.10 0.00 1.01 0.00 0.00 42.92 43.76 2b39 s ASP 1361CO -0.12 0.25 0.51 -0.22 0.21 0.00 0.00 175.17 175.80 2b39 s LEU 1362N -0.47 -0.82 -0.03 1.23 1.98 -1.26 -1.72 118.68 117.59 2b39 s LEU 1362Ca 0.07 1.22 0.07 0.00 -2.89 0.00 0.00 54.13 52.60 2b39 s LEU 1362Cb -0.08 1.73 -0.02 0.00 0.66 0.00 0.00 46.19 48.49 2b39 s LEU 1362CO -0.01 -0.23 -0.24 -0.60 -1.89 0.00 0.00 176.35 173.39 2b39 s ARG 1363N 2.65 2.13 -0.09 1.98 3.52 -0.18 -4.83 118.95 124.13 2b39 s ARG 1363Ca -0.04 -0.87 -0.04 0.00 -0.13 0.00 0.00 55.73 54.66 2b39 s ARG 1363Cb -0.12 -1.96 0.05 0.00 -1.56 0.00 0.00 34.95 31.36 2b39 s ARG 1363CO -0.15 0.47 0.19 0.08 -0.81 0.00 0.00 175.30 175.08 2b39 s VAL 1364N -0.43 -0.25 0.08 7.11 1.01 -1.26 -1.87 120.40 124.80 2b39 s VAL 1364Ca 0.05 0.29 0.06 0.00 0.00 0.00 0.00 61.98 62.38 2b39 s VAL 1364Cb -0.11 -0.33 -0.03 0.00 0.00 0.00 0.00 36.38 35.91 2b39 s VAL 1364CO 0.00 0.12 -0.16 -0.44 0.00 0.00 0.00 175.10 174.62 2b39 s SER 1365N 2.05 1.96 -0.02 3.32 0.01 -0.94 -4.77 113.70 115.32 2b39 s SER 1365Ca -0.00 -0.65 -0.04 0.00 1.31 0.00 0.00 55.95 56.57 2b39 s SER 1365Cb -0.12 -0.08 0.00 0.00 0.21 0.00 0.00 66.02 66.04 2b39 s SER 1365CO -0.07 -0.04 0.09 -0.51 0.41 0.00 0.00 173.24 173.13 2b39 s ILE 1366N -1.29 0.04 0.01 1.44 2.07 -1.26 -1.51 121.20 120.69 2b39 s ILE 1366Ca 0.01 -0.30 -0.25 0.00 -1.41 0.00 0.00 60.65 58.71 2b39 s ILE 1366Cb -0.10 -0.23 0.06 0.00 0.13 0.00 0.00 42.46 42.32 2b39 s ILE 1366CO 0.03 -0.16 0.56 0.00 -1.91 0.00 0.00 174.94 173.46 2b39 s ARG 1367N -0.51 1.01 0.34 3.50 1.70 -1.05 -4.73 118.95 119.21 2b39 s ARG 1367Ca -0.06 -0.04 -0.29 0.00 -0.47 0.00 0.00 55.73 54.87 2b39 s ARG 1367Cb -0.04 0.47 -0.12 0.00 -0.57 0.00 0.00 34.95 34.69 2b39 s ARG 1367CO 0.00 -0.34 1.41 -0.35 -1.08 0.00 0.00 175.30 174.94 2b39 n PRO 1368N 0.68 2.38 -1.14 3.89 -0.04 -1.26 -1.04 135.00 138.47 2b39 n PRO 1368Ca -0.19 0.84 -0.29 0.00 -0.04 0.00 0.00 63.50 63.81 2b39 n PRO 1368Cb 0.59 -2.50 0.15 0.00 -0.04 0.00 0.00 33.50 31.70 2b39 n PRO 1368CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2b39 s ALA 1369N -0.85 1.31 0.83 0.55 0.00 -0.65 -4.69 121.76 118.26 2b39 s ALA 1369Ca 0.57 -0.10 -0.11 0.00 0.00 0.00 0.00 51.96 52.31 2b39 s ALA 1369Cb -0.54 -3.19 0.10 0.00 0.00 0.00 0.00 23.12 19.49 2b39 s ALA 1369CO 0.60 -2.55 1.14 -1.25 0.00 0.00 0.00 175.76 173.70 2b39 s PRO 1370N -4.90 1.60 0.18 0.00 0.04 -1.26 -4.93 135.00 125.74 2b39 s PRO 1370Ca 0.64 1.49 -0.09 0.00 0.04 0.00 0.00 61.00 63.08 2b39 s PRO 1370Cb -0.19 -1.80 0.08 0.00 0.04 0.00 0.00 34.50 32.63 2b39 s PRO 1370CO 0.58 -2.19 1.67 0.93 0.04 0.00 0.00 177.00 178.03 2b39 h GLU 1371N -1.32 1.06 -1.18 4.56 5.08 -1.98 -3.15 114.58 117.65 2b39 h GLU 1371Ca -0.44 -0.30 0.00 0.00 -1.00 0.00 0.00 59.36 57.62 2b39 h GLU 1371Cb 1.26 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 30.40 2b39 h GLU 1371CO 0.46 1.00 0.00 0.25 -1.00 0.00 0.00 179.01 179.72 2b39 n THR 1372N -4.24 0.35 -3.74 1.13 -2.24 -1.26 -4.85 114.28 99.43 2b39 n THR 1372Ca 0.04 0.00 -0.28 0.00 -2.27 0.00 0.00 64.05 61.53 2b39 n THR 1372Cb 0.30 -0.59 -0.03 0.00 -2.10 0.00 0.00 70.33 67.90 2b39 n THR 1372CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 2b39 s VAL 1373N 0.02 5.23 -1.01 2.28 0.11 -1.19 -5.03 120.40 120.81 2b39 s VAL 1373Ca 0.00 -0.35 -0.23 0.00 -2.93 0.00 0.00 61.98 58.47 2b39 s VAL 1373Cb 0.00 -3.71 0.03 0.00 -1.53 0.00 0.00 36.38 31.17 2b39 s VAL 1373CO 0.00 -0.10 1.55 -1.59 -3.33 0.00 0.00 175.10 171.62 2b39 s LYS 1374N -3.14 3.43 -0.19 1.54 -2.85 -1.26 -4.99 119.74 112.28 2b39 s LYS 1374Ca 0.38 -1.02 -0.09 0.00 -1.00 0.00 0.00 55.97 54.23 2b39 s LYS 1374Cb -0.11 -5.32 -0.05 0.00 -2.06 0.00 0.00 37.83 30.29 2b39 s LYS 1374CO 0.28 -2.42 0.13 0.21 0.10 0.00 0.00 175.35 173.65 2b39 s LYS 1375N 5.29 4.05 -0.10 1.78 2.36 -1.23 -4.96 119.74 126.94 2b39 s LYS 1375Ca 0.50 -0.21 -0.37 0.00 -2.55 0.00 0.00 55.97 53.35 2b39 s LYS 1375Cb -0.01 -3.37 -0.15 0.00 -1.05 0.00 0.00 37.83 33.25 2b39 s LYS 1375CO -0.08 0.39 1.68 -2.30 1.55 0.00 0.00 175.35 176.59 2b39 n PRO 1376N 3.24 1.56 -0.49 4.03 -0.02 -1.25 -4.47 135.00 137.60 2b39 n PRO 1376Ca -0.17 0.57 0.40 0.00 -2.02 0.00 0.00 63.50 62.28 2b39 n PRO 1376Cb 0.53 -2.30 0.69 0.00 -0.02 0.00 0.00 33.50 32.39 2b39 n PRO 1376CO 0.00 0.00 0.00 -0.56 1.98 0.00 0.00 175.50 176.92 2b39 h GLN 1377N 7.04 0.05 0.00 -0.52 -0.00 -1.79 0.41 115.11 120.30 2b39 h GLN 1377Ca -0.47 -0.00 -0.05 0.00 -0.00 0.00 0.00 58.65 58.12 2b39 h GLN 1377Cb 1.30 -0.01 -0.01 0.00 -0.00 0.00 0.00 27.48 28.76 2b39 h GLN 1377CO 0.91 0.03 -0.25 0.22 -0.00 0.00 0.00 178.83 179.74 2b39 h ASP 1378N 0.05 0.00 -3.73 0.06 1.82 -1.93 -3.46 116.42 109.22 2b39 h ASP 1378Ca 0.85 0.00 -0.50 0.00 -0.39 0.00 0.00 57.03 56.99 2b39 h ASP 1378Cb 2.82 0.00 -0.01 0.00 0.68 0.00 0.00 39.33 42.82 2b39 h ASP 1378CO -0.36 0.25 0.38 0.00 -1.61 0.00 0.00 179.24 177.90 2b39 s ALA 1379N -3.12 3.35 -0.67 -0.78 0.00 0.14 -4.89 121.76 115.79 2b39 s ALA 1379Ca 0.05 0.68 0.02 0.00 0.00 0.00 0.00 51.96 52.71 2b39 s ALA 1379Cb 0.07 -3.25 0.11 0.00 0.00 0.00 0.00 23.12 20.05 2b39 s ALA 1379CO 0.70 0.09 0.81 1.63 0.00 0.00 0.00 175.76 178.99 2b39 n LYS 1380N 1.61 1.47 0.00 0.00 5.02 0.12 -4.84 118.16 121.54 2b39 n LYS 1380Ca -0.01 -0.46 0.00 0.00 -2.02 0.00 0.00 58.31 55.82 2b39 n LYS 1380Cb 0.47 -1.49 0.00 0.00 -0.02 0.00 0.00 35.03 33.98 2b39 n LYS 1380CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2b39 n GLY 1381N 0.14 4.04 3.14 0.72 0.00 -1.21 -4.94 105.19 107.07 2b39 n GLY 1381Ca 0.05 -1.64 -0.09 0.00 0.00 0.00 0.00 46.02 44.34 2b39 n GLY 1381CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2b39 s SER 1382N 0.00 0.34 0.12 1.61 1.04 -1.26 -0.61 113.70 114.93 2b39 s SER 1382Ca 0.00 -1.16 0.00 0.00 0.48 0.00 0.00 55.95 55.27 2b39 s SER 1382Cb 0.00 0.28 -0.04 0.00 0.10 0.00 0.00 66.02 66.36 2b39 s SER 1382CO 0.00 -0.70 0.00 -0.04 0.98 0.00 0.00 173.24 173.48 2b39 s MET 1383N -4.02 0.87 -0.23 4.02 -1.94 -0.93 -1.64 119.30 115.44 2b39 s MET 1383Ca 0.20 -1.39 -0.06 0.00 -1.71 0.00 0.00 55.69 52.73 2b39 s MET 1383Cb 0.08 0.05 -0.03 0.00 2.01 0.00 0.00 34.83 36.94 2b39 s MET 1383CO -0.01 -0.16 0.04 0.42 -0.01 0.00 0.00 175.02 175.31 2b39 s ILE 1384N -3.87 4.19 -0.23 2.53 1.01 -0.20 -0.68 121.20 123.96 2b39 s ILE 1384Ca 0.18 -0.22 -0.07 0.00 0.00 0.00 0.00 60.65 60.54 2b39 s ILE 1384Cb 0.07 -2.94 -0.03 0.00 0.01 0.00 0.00 42.46 39.58 2b39 s ILE 1384CO -0.02 0.38 0.05 -0.22 0.00 0.00 0.00 174.94 175.13 2b39 s LEU 1385N 1.35 3.41 -0.21 2.97 2.96 0.18 -2.52 118.68 126.82 2b39 s LEU 1385Ca 0.05 -0.19 -0.03 0.00 -0.22 0.00 0.00 54.13 53.74 2b39 s LEU 1385Cb -0.15 -1.90 -0.01 0.00 0.50 0.00 0.00 46.19 44.64 2b39 s LEU 1385CO 0.02 0.01 -0.06 -1.81 -1.32 0.00 0.00 176.35 173.19 2b39 s ASP 1386N 1.36 4.25 0.07 3.68 1.01 -0.57 -1.85 116.67 124.62 2b39 s ASP 1386Ca 0.05 -0.38 0.07 0.00 0.71 0.00 0.00 52.55 53.00 2b39 s ASP 1386Cb -0.15 -1.72 -0.04 0.00 1.01 0.00 0.00 42.92 42.03 2b39 s ASP 1386CO 0.03 0.01 -0.16 -0.63 0.21 0.00 0.00 175.17 174.63 2b39 s ILE 1387N 1.30 2.96 -0.23 0.77 1.01 0.14 -2.22 121.20 124.93 2b39 s ILE 1387Ca 0.04 -1.27 -0.15 0.00 0.00 0.00 0.00 60.65 59.27 2b39 s ILE 1387Cb -0.14 -2.31 0.07 0.00 0.01 0.00 0.00 42.46 40.09 2b39 s ILE 1387CO -0.02 0.23 0.58 0.00 0.00 0.00 0.00 174.94 175.72 2b39 s THR 1389N 1.25 0.07 0.03 0.00 -1.32 0.49 -1.01 115.64 115.16 2b39 s THR 1389Ca -0.07 -0.60 0.03 0.00 -1.21 0.00 0.00 61.69 59.84 2b39 s THR 1389Cb -0.06 -0.63 -0.02 0.00 -1.51 0.00 0.00 72.50 70.28 2b39 s THR 1389CO -0.13 -0.33 -0.10 -0.75 -2.21 0.00 0.00 174.62 171.11 2b39 s LYS 1390N -1.60 0.66 0.33 7.08 2.20 -0.70 0.29 119.74 128.00 2b39 s LYS 1390Ca -0.12 -0.64 -0.05 0.00 -0.36 0.00 0.00 55.97 54.79 2b39 s LYS 1390Cb -0.05 -0.57 -0.05 0.00 -1.51 0.00 0.00 37.83 35.65 2b39 s LYS 1390CO 0.02 0.13 0.61 -0.47 -0.36 0.00 0.00 175.35 175.28 2b39 s TYR 1391N -0.92 3.49 -0.29 4.03 6.04 0.43 -0.63 117.35 129.49 2b39 s TYR 1391Ca -0.03 0.68 0.07 0.00 0.04 0.00 0.00 57.07 57.83 2b39 s TYR 1391Cb -0.08 -2.14 0.46 0.00 -1.04 0.00 0.00 41.96 39.16 2b39 s TYR 1391CO 0.01 0.08 1.19 1.28 -1.54 0.00 0.00 175.55 176.56 2b39 n LEU 1392N -1.23 4.82 -4.53 6.97 4.77 -1.18 -4.42 117.00 122.20 2b39 n LEU 1392Ca -0.01 -4.71 -0.25 0.00 -0.03 0.00 0.00 56.01 51.00 2b39 n LEU 1392Cb 0.54 -0.32 -0.10 0.00 -2.33 0.00 0.00 43.42 41.21 2b39 n LEU 1392CO 0.49 2.08 -0.41 -0.83 -1.33 0.00 0.00 177.39 177.39 2b39 s GLY 1393N -3.60 2.10 0.00 -0.72 0.00 -1.26 -4.97 107.32 98.86 2b39 s GLY 1393Ca 0.50 -2.02 0.00 0.00 0.00 0.00 0.00 44.72 43.20 2b39 s GLY 1393CO 0.03 -2.01 0.70 1.22 0.00 0.00 0.00 173.10 173.04 2b39 n ASP 1394N -0.75 0.00 -4.13 1.64 8.00 -1.26 -4.58 116.55 115.47 2b39 n ASP 1394Ca -0.05 0.20 -0.09 0.00 0.71 0.00 0.00 54.79 55.56 2b39 n ASP 1394Cb 0.62 -0.20 -0.10 0.00 -0.02 0.00 0.00 41.12 41.42 2b39 n ASP 1394CO 0.00 0.00 0.00 -1.10 -0.39 0.00 0.00 177.20 175.71 2b39 s GLN 1395N -2.39 0.80 0.23 -1.24 -0.21 -1.26 -4.96 119.66 110.63 2b39 s GLN 1395Ca 0.00 -1.35 -0.30 0.00 0.02 0.00 0.00 55.36 53.72 2b39 s GLN 1395Cb 0.00 0.21 -0.10 0.00 1.00 0.00 0.00 33.01 34.12 2b39 s GLN 1395CO 0.00 -0.19 1.51 -0.51 -2.12 0.00 0.00 175.29 173.97 2b39 s ASP 1396N -3.00 6.58 0.70 5.90 1.11 -1.26 -4.67 116.67 122.04 2b39 s ASP 1396Ca 0.17 2.70 -0.16 0.00 0.18 0.00 0.00 52.55 55.44 2b39 s ASP 1396Cb 0.08 -2.62 0.02 0.00 1.07 0.00 0.00 42.92 41.47 2b39 s ASP 1396CO -0.03 -0.78 1.21 0.00 1.18 0.00 0.00 175.17 176.76 2b39 n ALA 1397N 2.83 0.60 -2.11 5.23 0.00 -0.35 -4.86 120.51 121.84 2b39 n ALA 1397Ca 0.09 -0.12 0.00 0.00 0.00 0.00 0.00 53.44 53.41 2b39 n ALA 1397Cb 0.39 -2.27 0.00 0.00 0.00 0.00 0.00 19.45 17.57 2b39 n ALA 1397CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.50 175.13 2b39 n THR 1398N -2.39 0.00 -1.70 0.00 5.66 -1.26 -2.62 114.28 111.97 2b39 n THR 1398Ca 0.15 0.00 -0.62 0.00 -3.05 0.00 0.00 64.05 60.53 2b39 n THR 1398Cb 0.49 -1.39 -0.08 0.00 -1.55 0.00 0.00 70.33 67.80 2b39 n THR 1398CO 0.00 0.00 0.00 0.80 -3.05 0.00 0.00 175.07 172.82 2b39 n MET 1399N -0.81 0.56 -4.58 1.09 1.56 -0.39 -4.32 117.12 110.22 2b39 n MET 1399Ca 0.00 0.20 -0.28 0.00 -0.27 0.00 0.00 57.70 57.36 2b39 n MET 1399Cb 0.00 -1.79 -0.08 0.00 2.15 0.00 0.00 33.22 33.50 2b39 n MET 1399CO 0.00 0.00 0.00 -1.12 -0.73 0.00 0.00 175.97 174.12 2b39 s SER 1400N 2.71 3.17 0.00 6.12 0.01 -0.74 -2.33 113.70 122.64 2b39 s SER 1400Ca 0.99 -1.69 0.00 0.00 1.31 0.00 0.00 55.95 56.57 2b39 s SER 1400Cb -1.26 0.54 -0.00 0.00 0.21 0.00 0.00 66.02 65.51 2b39 s SER 1400CO 0.70 -0.93 -0.01 -0.63 0.41 0.00 0.00 173.24 172.79 2b39 s ILE 1401N -3.11 0.03 -0.35 1.44 1.01 0.79 -1.65 121.20 119.36 2b39 s ILE 1401Ca 0.18 -0.15 -0.06 0.00 0.00 0.00 0.00 60.65 60.63 2b39 s ILE 1401Cb 0.02 -0.06 0.05 0.00 0.01 0.00 0.00 42.46 42.48 2b39 s ILE 1401CO 0.12 -0.08 0.11 -0.76 0.00 0.00 0.00 174.94 174.33 2b39 s LEU 1402N -0.24 4.40 -0.82 2.97 1.43 -0.03 -1.98 118.68 124.41 2b39 s LEU 1402Ca -0.02 -1.26 -0.16 0.00 -1.03 0.00 0.00 54.13 51.65 2b39 s LEU 1402Cb -0.02 -1.85 0.18 0.00 0.03 0.00 0.00 46.19 44.53 2b39 s LEU 1402CO -0.00 -0.35 0.86 -0.62 0.23 0.00 0.00 176.35 176.46 2b39 s ASP 1403N 1.48 6.63 -0.44 2.29 -1.08 0.05 -1.23 116.67 124.37 2b39 s ASP 1403Ca -0.01 -2.32 -0.16 0.00 -0.52 0.00 0.00 52.55 49.54 2b39 s ASP 1403Cb -0.20 -2.28 0.04 0.00 -1.46 0.00 0.00 42.92 39.02 2b39 s ASP 1403CO 0.02 -0.80 0.41 -0.63 0.52 0.00 0.00 175.17 174.69 2b39 s ILE 1404N 1.27 5.15 0.15 4.11 1.01 0.18 -1.78 121.20 131.29 2b39 s ILE 1404Ca 0.21 -0.65 -0.18 0.00 0.00 0.00 0.00 60.65 60.03 2b39 s ILE 1404Cb -0.11 -4.06 -0.07 0.00 0.01 0.00 0.00 42.46 38.22 2b39 s ILE 1404CO -0.07 -0.48 0.62 -0.94 0.00 0.00 0.00 174.94 174.07 2b39 s SER 1405N 2.09 7.01 0.40 3.58 1.04 -0.36 0.14 113.70 127.59 2b39 s SER 1405Ca 0.08 1.27 -0.11 0.00 0.48 0.00 0.00 55.95 57.68 2b39 s SER 1405Cb -0.20 -2.36 -0.07 0.00 0.10 0.00 0.00 66.02 63.49 2b39 s SER 1405CO 0.10 0.14 0.77 -0.04 0.98 0.00 0.00 173.24 175.19 2b39 s MET 1406N -1.64 3.80 0.14 4.02 1.00 0.23 -3.42 119.30 123.43 2b39 s MET 1406Ca 0.36 0.49 -0.27 0.00 0.00 0.00 0.00 55.69 56.28 2b39 s MET 1406Cb -0.17 -2.40 -0.07 0.00 0.00 0.00 0.00 34.83 32.19 2b39 s MET 1406CO 0.20 -0.01 0.83 -1.64 0.00 0.00 0.00 175.02 174.40 2b39 s MET 1407N -3.75 4.62 -0.39 2.03 -1.94 -1.26 -4.59 119.30 114.01 2b39 s MET 1407Ca 0.52 1.24 -0.43 0.00 -1.71 0.00 0.00 55.69 55.30 2b39 s MET 1407Cb -0.10 -3.31 -0.17 0.00 2.01 0.00 0.00 34.83 33.25 2b39 s MET 1407CO 0.30 0.43 1.75 0.25 -0.01 0.00 0.00 175.02 177.73 2b39 n THR 1408N 2.09 0.15 0.00 2.05 -2.24 -1.26 0.39 114.28 115.47 2b39 n THR 1408Ca -0.03 -0.04 0.00 0.00 -2.27 0.00 0.00 64.05 61.71 2b39 n THR 1408Cb 0.49 -0.89 0.00 0.00 -2.10 0.00 0.00 70.33 67.83 2b39 n THR 1408CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2b39 n GLY 1409N 4.56 1.96 3.84 3.38 0.00 -1.26 -4.91 105.19 112.75 2b39 n GLY 1409Ca 0.32 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 46.01 2b39 n GLY 1409CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2b39 s PHE 1410N -2.17 3.39 -0.25 1.61 0.08 0.16 -2.01 117.98 118.79 2b39 s PHE 1410Ca 0.00 1.49 -0.15 0.00 0.12 0.00 0.00 56.93 58.39 2b39 s PHE 1410Cb 0.00 -2.82 0.07 0.00 -0.57 0.00 0.00 43.02 39.70 2b39 s PHE 1410CO 0.00 -0.39 0.62 0.45 -0.10 0.00 0.00 175.22 175.80 2b39 s SER 1411N -2.90 -0.83 0.64 1.36 0.15 -0.11 -4.69 113.70 107.32 2b39 s SER 1411Ca 0.60 1.36 -0.18 0.00 0.70 0.00 0.00 55.95 58.43 2b39 s SER 1411Cb -0.10 1.24 -0.02 0.00 -1.71 0.00 0.00 66.02 65.43 2b39 s SER 1411CO 0.29 -0.23 1.11 -0.81 1.20 0.00 0.00 173.24 174.80 2b39 n PRO 1412N 4.21 0.93 -2.36 5.44 -0.04 -1.26 -1.48 135.00 140.44 2b39 n PRO 1412Ca -0.20 0.37 -0.41 0.00 -0.04 0.00 0.00 63.50 63.21 2b39 n PRO 1412Cb 0.58 -2.34 -0.03 0.00 -0.04 0.00 0.00 33.50 31.67 2b39 n PRO 1412CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 2b39 s ASP 1413N -1.36 6.04 0.54 3.54 -1.08 0.76 -4.79 116.67 120.32 2b39 s ASP 1413Ca 0.79 0.24 0.25 0.00 -0.52 0.00 0.00 52.55 53.31 2b39 s ASP 1413Cb -0.39 -2.55 1.44 0.00 -1.46 0.00 0.00 42.92 39.96 2b39 s ASP 1413CO 0.44 -1.79 2.03 0.58 0.52 0.00 0.00 175.17 176.95 2b39 h VAL 1414N 6.40 0.70 -0.27 1.11 2.07 -1.91 -2.31 116.25 122.04 2b39 h VAL 1414Ca -0.27 0.00 -0.12 0.00 0.82 0.00 0.00 66.70 67.13 2b39 h VAL 1414Cb 1.10 0.79 -0.00 0.00 -1.52 0.00 0.00 31.29 31.65 2b39 h VAL 1414CO 1.19 0.00 -0.31 -0.33 0.02 0.00 0.00 177.57 178.13 2b39 h GLU 1415N 0.00 0.69 0.56 1.57 3.07 -1.98 -2.56 114.58 115.93 2b39 h GLU 1415Ca 0.18 -0.38 -0.03 0.00 -0.50 0.00 0.00 59.36 58.63 2b39 h GLU 1415Cb 0.77 0.02 0.01 0.00 -0.84 0.00 0.00 28.75 28.70 2b39 h GLU 1415CO -0.00 1.00 -0.27 -0.44 -1.40 0.00 0.00 179.01 177.90 2b39 h ASP 1416N 0.42 -0.63 -0.86 1.42 3.32 -1.80 -2.04 116.42 116.24 2b39 h ASP 1416Ca 0.04 0.02 0.22 0.00 0.02 0.00 0.00 57.03 57.33 2b39 h ASP 1416Cb 0.89 0.16 -0.15 0.00 0.22 0.00 0.00 39.33 40.46 2b39 h ASP 1416CO 0.08 -0.44 0.14 -0.07 -1.72 0.00 0.00 179.24 177.23 2b39 h LEU 1417N -0.78 -0.18 -0.26 1.55 3.38 -1.64 0.31 115.31 117.69 2b39 h LEU 1417Ca -0.08 0.21 0.06 0.00 0.09 0.00 0.00 57.88 58.17 2b39 h LEU 1417Cb 0.57 0.33 -0.08 0.00 0.09 0.00 0.00 40.66 41.57 2b39 h LEU 1417CO 0.13 -0.20 -0.30 0.50 0.09 0.00 0.00 178.44 178.65 2b39 h LYS 1418N 0.14 -0.29 0.00 1.13 3.64 -1.28 0.95 116.57 120.86 2b39 h LYS 1418Ca 0.52 0.02 -0.04 0.00 -1.27 0.00 0.00 60.65 59.89 2b39 h LYS 1418Cb 1.03 0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 32.92 2b39 h LYS 1418CO -0.70 -0.20 -0.17 1.79 -2.27 0.00 0.00 179.45 177.90 2b39 h THR 1419N -0.30 1.09 0.00 1.00 1.35 0.28 -0.90 112.91 115.42 2b39 h THR 1419Ca 0.14 -0.59 0.00 0.00 -0.55 0.00 0.00 66.41 65.40 2b39 h THR 1419Cb 0.52 1.32 0.00 0.00 -1.73 0.00 0.00 68.15 68.26 2b39 h THR 1419CO -0.43 0.17 0.00 0.18 -0.25 0.00 0.00 175.52 175.19 2b39 n LEU 1420N -4.28 0.61 -0.12 3.87 4.77 0.15 -3.70 117.00 118.30 2b39 n LEU 1420Ca -0.02 0.60 0.01 0.00 -0.03 0.00 0.00 56.01 56.57 2b39 n LEU 1420Cb 0.24 -0.46 0.02 0.00 -2.33 0.00 0.00 43.42 40.89 2b39 n LEU 1420CO 0.36 -0.33 0.39 -1.20 -1.33 0.00 0.00 177.39 175.28 2b39 n SER 1421N -2.12 1.64 -0.00 -1.43 7.64 -0.18 -1.84 113.62 117.33 2b39 n SER 1421Ca 0.04 -1.49 -0.00 0.00 1.01 0.00 0.00 58.87 58.43 2b39 n SER 1421Cb 0.32 -0.02 -0.00 0.00 -1.01 0.00 0.00 64.21 63.49 2b39 n SER 1421CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 2b39 n THR 1422N -0.03 0.01 -0.62 0.44 -1.04 -0.89 -4.86 114.28 107.30 2b39 n THR 1422Ca 0.02 -0.01 -0.31 0.00 -2.04 0.00 0.00 64.05 61.72 2b39 n THR 1422Cb 0.16 -0.94 0.20 0.00 -1.82 0.00 0.00 70.33 67.92 2b39 n THR 1422CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2b39 n GLY 1423N 2.97 -1.66 0.35 3.41 0.00 -1.25 -4.88 105.19 104.12 2b39 n GLY 1423Ca -0.00 -0.91 -0.01 0.00 0.00 0.00 0.00 46.02 45.09 2b39 n GLY 1423CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2b39 h VAL 1424N -2.19 1.22 -2.13 1.61 2.07 -1.91 -2.99 116.25 111.94 2b39 h VAL 1424Ca -0.52 -0.53 -0.72 0.00 0.82 0.00 0.00 66.70 65.75 2b39 h VAL 1424Cb 1.31 0.16 -0.17 0.00 -1.52 0.00 0.00 31.29 31.07 2b39 h VAL 1424CO 0.42 0.24 1.25 1.51 0.02 0.00 0.00 177.57 181.02 2b39 s ASP 1425N -6.35 6.91 -0.04 0.57 -4.77 -1.26 -4.04 116.67 107.69 2b39 s ASP 1425Ca -0.11 -2.64 -0.30 0.00 -3.30 0.00 0.00 52.55 46.20 2b39 s ASP 1425Cb 0.17 -2.42 -0.03 0.00 -1.09 0.00 0.00 42.92 39.56 2b39 s ASP 1425CO 0.80 -0.89 1.02 -0.13 0.70 0.00 0.00 175.17 176.67 2b39 s ARG 1426N 2.16 4.49 0.00 2.11 0.52 -1.13 -4.90 118.95 122.20 2b39 s ARG 1426Ca 0.40 1.45 0.09 0.00 -0.52 0.00 0.00 55.73 57.15 2b39 s ARG 1426Cb -0.03 -3.49 0.02 0.00 0.52 0.00 0.00 34.95 31.97 2b39 s ARG 1426CO -0.03 -0.18 0.64 0.66 0.02 0.00 0.00 175.30 176.41 2b39 n TYR 1427N 4.38 0.00 -3.68 -0.53 4.01 -0.91 -4.87 117.16 115.56 2b39 n TYR 1427Ca 0.07 0.00 -0.09 0.00 -0.16 0.00 0.00 57.90 57.72 2b39 n TYR 1427Cb 0.50 0.00 -0.10 0.00 -0.31 0.00 0.00 39.34 39.43 2b39 n TYR 1427CO 0.00 0.00 0.00 0.42 -0.46 0.00 0.00 176.86 176.82 2b39 s ILE 1428N -1.06 -0.18 0.10 -0.72 1.01 -0.76 -4.97 121.20 114.61 2b39 s ILE 1428Ca 0.08 0.09 -0.11 0.00 0.00 0.00 0.00 60.65 60.71 2b39 s ILE 1428Cb 0.07 -0.70 -0.20 0.00 0.01 0.00 0.00 42.46 41.64 2b39 s ILE 1428CO 0.18 0.04 1.25 0.28 0.00 0.00 0.00 174.94 176.68 2b39 h SER 1429N 7.34 0.81 -4.26 3.58 0.02 -1.69 -3.38 113.55 115.98 2b39 h SER 1429Ca -0.31 -0.63 0.15 0.00 -0.84 0.00 0.00 61.79 60.16 2b39 h SER 1429Cb 1.17 -0.25 -0.20 0.00 0.14 0.00 0.00 62.40 63.27 2b39 h SER 1429CO 0.23 1.42 0.62 -0.75 -1.14 0.00 0.00 176.83 177.22 2b39 s LYS 1430N -3.39 0.56 0.10 3.45 2.20 -1.24 -4.78 119.74 116.65 2b39 s LYS 1430Ca -0.09 -0.08 0.00 0.00 -0.36 0.00 0.00 55.97 55.44 2b39 s LYS 1430Cb 0.08 0.26 -0.04 0.00 -1.51 0.00 0.00 37.83 36.62 2b39 s LYS 1430CO 0.90 -0.22 -0.01 1.52 -0.36 0.00 0.00 175.35 177.18 2b39 s TYR 1431N -2.12 0.81 -0.25 4.03 -0.85 -1.26 0.02 117.35 117.74 2b39 s TYR 1431Ca 0.04 -1.07 -0.28 0.00 -0.52 0.00 0.00 57.07 55.25 2b39 s TYR 1431Cb -0.01 -0.49 0.16 0.00 0.38 0.00 0.00 41.96 41.99 2b39 s TYR 1431CO -0.04 -0.33 1.19 -1.83 -1.52 0.00 0.00 175.55 173.02 2b39 s GLU 1432N -3.93 0.32 0.74 -3.49 -1.05 -0.55 -4.99 118.70 105.75 2b39 s GLU 1432Ca 0.15 0.19 -0.09 0.00 -0.15 0.00 0.00 54.97 55.08 2b39 s GLU 1432Cb 0.07 0.15 0.06 0.00 -0.44 0.00 0.00 34.13 33.98 2b39 s GLU 1432CO -0.03 -0.08 1.08 -1.64 0.95 0.00 0.00 175.26 175.53 2b39 s MET 1433N -0.56 2.19 -0.16 -4.83 -1.94 -1.26 -0.43 119.30 112.31 2b39 s MET 1433Ca 0.04 -0.06 -0.04 0.00 -1.71 0.00 0.00 55.69 53.92 2b39 s MET 1433Cb -0.03 -2.08 0.07 0.00 2.01 0.00 0.00 34.83 34.80 2b39 s MET 1433CO -0.06 -1.33 0.15 1.21 -0.01 0.00 0.00 175.02 174.98 2b39 s ASN 1434N -4.52 1.63 0.08 3.03 2.47 0.11 -4.81 114.94 112.94 2b39 s ASN 1434Ca 0.60 -0.27 -0.12 0.00 0.42 0.00 0.00 52.86 53.50 2b39 s ASN 1434Cb -0.11 0.10 -0.24 0.00 -1.45 0.00 0.00 41.25 39.55 2b39 s ASN 1434CO 0.47 -0.32 1.17 0.03 -3.72 0.00 0.00 177.10 174.73 2b39 h ARG 1435N 8.37 0.57 -4.23 0.43 3.08 -1.93 -3.27 114.38 117.40 2b39 h ARG 1435Ca -0.15 -0.71 -0.70 0.00 0.07 0.00 0.00 59.98 58.48 2b39 h ARG 1435Cb 1.14 0.22 -0.04 0.00 0.08 0.00 0.00 29.97 31.38 2b39 h ARG 1435CO 0.26 1.30 3.00 -0.40 -1.07 0.00 0.00 179.97 183.05 2b39 n ASP 1436N -3.77 3.94 -3.43 7.04 5.75 -1.26 -4.70 116.55 120.11 2b39 n ASP 1436Ca -0.11 -2.84 -0.01 0.00 -0.01 0.00 0.00 54.79 51.82 2b39 n ASP 1436Cb 0.94 -1.65 -0.04 0.00 -1.03 0.00 0.00 41.12 39.34 2b39 n ASP 1436CO 0.00 0.00 0.00 -0.94 -0.11 0.00 0.00 177.20 176.15 2b39 s SER 1437N 3.39 -1.01 0.06 -1.12 1.04 -1.26 -5.03 113.70 109.77 2b39 s SER 1437Ca 0.48 1.12 -0.03 0.00 0.48 0.00 0.00 55.95 58.00 2b39 s SER 1437Cb 0.13 2.03 0.08 0.00 0.10 0.00 0.00 66.02 68.36 2b39 s SER 1437CO -0.06 -0.24 0.37 0.59 0.98 0.00 0.00 173.24 174.87 2b39 n ASN 1438N 5.43 -0.12 -4.65 7.02 3.02 -1.26 -4.06 115.26 120.63 2b39 n ASN 1438Ca -0.07 0.41 -0.30 0.00 -0.03 0.00 0.00 54.58 54.59 2b39 n ASN 1438Cb 0.50 -0.11 -0.09 0.00 -0.61 0.00 0.00 39.78 39.48 2b39 n ASN 1438CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 2b39 s LYS 1439N -5.26 2.43 -0.24 3.52 1.02 -1.26 -4.76 119.74 115.19 2b39 s LYS 1439Ca -0.03 -0.88 -0.29 0.00 0.02 0.00 0.00 55.97 54.78 2b39 s LYS 1439Cb 0.06 -2.47 -0.06 0.00 -0.52 0.00 0.00 37.83 34.83 2b39 s LYS 1439CO 0.18 0.54 2.23 -1.71 -0.92 0.00 0.00 175.35 175.66 2b39 n ASN 1440N 0.66 3.09 -4.56 2.83 5.15 -1.26 -4.82 115.26 116.35 2b39 n ASN 1440Ca -0.12 0.21 -0.31 0.00 -0.60 0.00 0.00 54.58 53.76 2b39 n ASN 1440Cb 0.52 -1.52 -0.11 0.00 -0.53 0.00 0.00 39.78 38.15 2b39 n ASN 1440CO 0.00 0.00 0.00 0.42 1.40 0.00 0.00 177.26 179.08 2b39 s THR 1441N 8.30 3.38 -0.20 -0.44 -4.23 -1.23 0.75 115.64 121.97 2b39 s THR 1441Ca 1.02 -1.03 -0.04 0.00 -1.18 0.00 0.00 61.69 60.47 2b39 s THR 1441Cb -0.40 -2.50 -0.02 0.00 1.34 0.00 0.00 72.50 70.92 2b39 s THR 1441CO 0.37 0.28 -0.03 -0.22 -0.54 0.00 0.00 174.62 174.48 2b39 s LEU 1442N -1.70 3.05 -0.17 4.79 2.96 0.37 0.08 118.68 128.06 2b39 s LEU 1442Ca 0.18 -0.29 -0.06 0.00 -0.22 0.00 0.00 54.13 53.74 2b39 s LEU 1442Cb -0.11 -1.76 -0.04 0.00 0.50 0.00 0.00 46.19 44.78 2b39 s LEU 1442CO 0.09 0.05 0.03 -0.63 -1.32 0.00 0.00 176.35 174.57 2b39 s ILE 1443N 1.09 4.51 -0.10 6.68 1.01 0.43 -0.64 121.20 134.17 2b39 s ILE 1443Ca 0.01 -0.14 0.03 0.00 0.00 0.00 0.00 60.65 60.55 2b39 s ILE 1443Cb -0.15 -3.01 0.01 0.00 0.01 0.00 0.00 42.46 39.33 2b39 s ILE 1443CO 0.00 0.48 -0.19 -0.63 0.00 0.00 0.00 174.94 174.61 2b39 s ILE 1444N 0.26 1.69 -0.21 2.92 1.01 -0.37 -1.49 121.20 125.02 2b39 s ILE 1444Ca 0.02 -0.78 -0.10 0.00 0.00 0.00 0.00 60.65 59.78 2b39 s ILE 1444Cb -0.13 -1.50 -0.05 0.00 0.01 0.00 0.00 42.46 40.79 2b39 s ILE 1444CO 0.01 0.48 0.15 -0.31 0.00 0.00 0.00 174.94 175.27 2b39 s TYR 1445N 0.68 3.39 -0.06 3.97 2.02 0.10 -0.85 117.35 126.60 2b39 s TYR 1445Ca -0.12 0.32 0.02 0.00 -0.37 0.00 0.00 57.07 56.92 2b39 s TYR 1445Cb -0.16 -2.21 -0.03 0.00 -0.40 0.00 0.00 41.96 39.17 2b39 s TYR 1445CO 0.03 0.22 -0.11 -0.51 -1.57 0.00 0.00 175.55 173.61 2b39 s LEU 1446N 0.57 2.94 0.20 -1.29 1.43 -0.66 -1.85 118.68 120.02 2b39 s LEU 1446Ca 0.08 -0.12 0.01 0.00 -1.03 0.00 0.00 54.13 53.07 2b39 s LEU 1446Cb -0.12 -1.62 0.14 0.00 0.03 0.00 0.00 46.19 44.63 2b39 s LEU 1446CO 0.00 0.34 1.50 0.44 0.23 0.00 0.00 176.35 178.86 2b39 h ASP 1447N 5.40 0.40 -2.93 2.29 5.19 -1.90 -1.97 116.42 122.90 2b39 h ASP 1447Ca -0.46 -0.24 -0.10 0.00 -0.62 0.00 0.00 57.03 55.60 2b39 h ASP 1447Cb 1.17 -0.12 -0.02 0.00 0.18 0.00 0.00 39.33 40.54 2b39 h ASP 1447CO 0.52 0.95 0.09 2.29 -3.12 0.00 0.00 179.24 179.96 2b39 n LYS 1448N -3.86 0.78 -3.62 3.56 -0.00 -1.26 -1.26 118.16 112.49 2b39 n LYS 1448Ca -0.03 -1.95 -0.12 0.00 -0.00 0.00 0.00 58.31 56.20 2b39 n LYS 1448Cb 0.66 2.19 -0.12 0.00 -0.00 0.00 0.00 35.03 37.76 2b39 n LYS 1448CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.40 177.48 2b39 s VAL 1449N -2.46 -0.47 0.66 0.58 1.01 -1.08 -4.75 120.40 113.89 2b39 s VAL 1449Ca 0.17 0.19 -0.17 0.00 0.00 0.00 0.00 61.98 62.17 2b39 s VAL 1449Cb -0.03 -0.54 -0.05 0.00 0.00 0.00 0.00 36.38 35.76 2b39 s VAL 1449CO 0.12 0.06 0.62 -0.24 0.00 0.00 0.00 175.10 175.66 2b39 n SER 1450N 5.36 -0.78 -0.06 3.32 2.88 -1.26 -1.21 113.62 121.86 2b39 n SER 1450Ca -0.06 0.66 0.01 0.00 -1.33 0.00 0.00 58.87 58.15 2b39 n SER 1450Cb 0.50 -1.24 0.00 0.00 -0.75 0.00 0.00 64.21 62.72 2b39 n SER 1450CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2b39 n HIS 1451N -2.12 0.00 0.00 0.66 1.44 -1.26 -0.43 115.22 113.51 2b39 n HIS 1451Ca 0.11 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.82 2b39 n HIS 1451Cb 0.49 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.60 2b39 n HIS 1451CO 0.00 0.00 0.00 2.41 -2.81 0.00 0.00 176.34 175.94 2b39 n THR 1452N -0.39 0.00 -2.45 0.61 -1.04 -1.26 -4.72 114.28 105.03 2b39 n THR 1452Ca 0.01 0.38 -0.09 0.00 -2.04 0.00 0.00 64.05 62.31 2b39 n THR 1452Cb 0.06 -1.36 0.05 0.00 -1.82 0.00 0.00 70.33 67.25 2b39 n THR 1452CO 0.00 0.00 0.00 1.33 -0.64 0.00 0.00 175.07 175.76 2b39 n VAL 1453N -2.22 0.00 -4.19 12.58 0.24 -1.26 -5.04 118.33 118.45 2b39 n VAL 1453Ca 0.00 -0.65 -0.34 0.00 -2.04 0.00 0.00 64.34 61.31 2b39 n VAL 1453Cb 0.00 -1.15 -0.08 0.00 -1.47 0.00 0.00 33.84 31.14 2b39 n VAL 1453CO 0.00 0.00 0.00 -0.70 -2.14 0.00 0.00 176.83 173.99 2b39 s GLU 1454N -3.44 3.08 -0.32 7.34 2.12 -1.26 -4.64 118.70 121.58 2b39 s GLU 1454Ca 0.27 -0.39 -0.09 0.00 0.36 0.00 0.00 54.97 55.11 2b39 s GLU 1454Cb -0.02 -2.88 0.00 0.00 0.26 0.00 0.00 34.13 31.50 2b39 s GLU 1454CO 0.18 0.69 0.15 -0.51 -0.54 0.00 0.00 175.26 175.23 2b39 s ASP 1455N -1.24 5.53 0.06 -1.70 1.01 0.15 -4.90 116.67 115.58 2b39 s ASP 1455Ca 0.17 -0.66 0.01 0.00 0.71 0.00 0.00 52.55 52.78 2b39 s ASP 1455Cb -0.12 -1.99 -0.04 0.00 1.01 0.00 0.00 42.92 41.79 2b39 s ASP 1455CO 0.07 -0.24 0.18 0.00 0.21 0.00 0.00 175.17 175.40 2b39 s LEU 1457N -2.49 1.43 0.00 0.00 1.02 0.21 -4.96 118.68 113.89 2b39 s LEU 1457Ca 0.34 0.12 0.02 0.00 0.02 0.00 0.00 54.13 54.63 2b39 s LEU 1457Cb -0.13 0.14 -0.01 0.00 0.02 0.00 0.00 46.19 46.21 2b39 s LEU 1457CO 0.27 -0.07 -0.08 -0.55 0.02 0.00 0.00 176.35 175.94 2b39 s SER 1458N 0.50 0.89 -0.03 2.29 0.15 -1.26 0.28 113.70 116.51 2b39 s SER 1458Ca -0.04 -0.20 -0.29 0.00 0.70 0.00 0.00 55.95 56.12 2b39 s SER 1458Cb -0.06 -0.08 0.11 0.00 -1.71 0.00 0.00 66.02 64.28 2b39 s SER 1458CO -0.02 0.05 0.91 0.72 1.20 0.00 0.00 173.24 176.10 2b39 s PHE 1459N -0.35 -0.35 0.20 3.44 -0.12 -0.77 -4.61 117.98 115.43 2b39 s PHE 1459Ca 0.01 0.28 -0.16 0.00 -0.05 0.00 0.00 56.93 57.01 2b39 s PHE 1459Cb -0.04 0.52 -0.08 0.00 -0.63 0.00 0.00 43.02 42.80 2b39 s PHE 1459CO -0.00 -0.50 0.64 0.15 -0.05 0.00 0.00 175.22 175.45 2b39 s LYS 1460N -2.78 4.06 -0.14 1.99 1.02 -1.26 -0.65 119.74 121.98 2b39 s LYS 1460Ca 0.04 0.63 -0.01 0.00 0.02 0.00 0.00 55.97 56.65 2b39 s LYS 1460Cb -0.01 -2.82 0.04 0.00 -0.52 0.00 0.00 37.83 34.52 2b39 s LYS 1460CO -0.07 0.39 -0.05 0.14 -0.92 0.00 0.00 175.35 174.84 2b39 s VAL 1461N -1.59 1.01 0.45 3.17 -7.23 0.15 -0.17 120.40 116.20 2b39 s VAL 1461Ca 0.43 -0.46 -0.09 0.00 -1.81 0.00 0.00 61.98 60.05 2b39 s VAL 1461Cb -0.15 -1.14 -0.05 0.00 0.56 0.00 0.00 36.38 35.60 2b39 s VAL 1461CO 0.20 0.21 0.80 -1.00 -0.31 0.00 0.00 175.10 175.00 2b39 s HIS 1462N 1.69 3.52 -0.15 2.82 0.09 -0.55 -2.18 115.29 120.52 2b39 s HIS 1462Ca 0.02 0.99 0.01 0.00 -0.00 0.00 0.00 55.06 56.08 2b39 s HIS 1462Cb -0.14 -2.42 0.00 0.00 -0.00 0.00 0.00 32.58 30.02 2b39 s HIS 1462CO -0.08 -0.22 -0.17 -1.14 -0.00 0.00 0.00 174.74 173.13 2b39 s GLN 1463N -4.30 3.18 0.00 1.40 0.74 0.21 -0.93 119.66 119.96 2b39 s GLN 1463Ca 0.50 -0.77 0.21 0.00 0.05 0.00 0.00 55.36 55.35 2b39 s GLN 1463Cb -0.10 -2.59 0.00 0.00 1.10 0.00 0.00 33.01 31.42 2b39 s GLN 1463CO 0.38 0.01 1.03 0.66 -0.55 0.00 0.00 175.29 176.82 2b39 n TYR 1464N 4.07 0.00 -3.94 1.67 4.01 -0.85 0.12 117.16 122.24 2b39 n TYR 1464Ca -0.19 0.00 -0.14 0.00 -0.16 0.00 0.00 57.90 57.41 2b39 n TYR 1464Cb 0.52 0.00 -0.15 0.00 -0.31 0.00 0.00 39.34 39.40 2b39 n TYR 1464CO 0.00 0.00 0.00 -0.06 -0.46 0.00 0.00 176.86 176.34 2b39 s PHE 1465N -2.26 0.15 -0.31 -0.72 0.08 -1.26 -4.54 117.98 109.12 2b39 s PHE 1465Ca 0.17 -0.01 -0.29 0.00 0.12 0.00 0.00 56.93 56.93 2b39 s PHE 1465Cb 0.17 -0.14 0.00 0.00 -0.57 0.00 0.00 43.02 42.48 2b39 s PHE 1465CO 0.50 -0.02 1.33 -0.80 -0.10 0.00 0.00 175.22 176.13 2b39 s ASN 1466N 0.18 6.62 -0.04 1.36 0.01 -1.26 -4.91 114.94 116.89 2b39 s ASN 1466Ca -0.01 1.18 0.05 0.00 -0.71 0.00 0.00 52.86 53.37 2b39 s ASN 1466Cb -0.03 -2.54 -0.02 0.00 0.41 0.00 0.00 41.25 39.07 2b39 s ASN 1466CO -0.01 -1.13 -0.20 -0.69 -1.51 0.00 0.00 177.10 173.57 2b39 s VAL 1467N 4.54 2.58 -0.08 1.60 1.01 -1.26 -1.42 120.40 127.37 2b39 s VAL 1467Ca 0.58 -0.90 0.01 0.00 0.00 0.00 0.00 61.98 61.66 2b39 s VAL 1467Cb -0.17 -1.97 -0.03 0.00 0.00 0.00 0.00 36.38 34.22 2b39 s VAL 1467CO 0.25 0.58 -0.08 -0.83 0.00 0.00 0.00 175.10 175.02 2b39 s GLY 1468N -0.56 1.66 -1.14 4.51 0.00 0.24 -4.50 107.32 107.53 2b39 s GLY 1468Ca 0.08 -0.90 -0.05 0.00 0.00 0.00 0.00 44.72 43.86 2b39 s GLY 1468CO 0.01 -0.60 0.98 1.04 0.00 0.00 0.00 173.10 174.52 2b39 n LEU 1469N 2.43 -3.47 -4.77 0.66 4.77 0.47 0.63 117.00 117.74 2b39 n LEU 1469Ca -0.18 -0.50 -0.41 0.00 -0.03 0.00 0.00 56.01 54.89 2b39 n LEU 1469Cb 0.53 -2.77 -0.02 0.00 -2.33 0.00 0.00 43.42 38.83 2b39 n LEU 1469CO 0.27 0.48 0.99 -0.51 -1.33 0.00 0.00 177.39 177.29 2b39 s ILE 1470N -3.30 2.76 0.34 -0.08 2.07 -0.89 -4.56 121.20 117.54 2b39 s ILE 1470Ca 0.30 0.74 -0.10 0.00 -1.41 0.00 0.00 60.65 60.19 2b39 s ILE 1470Cb -0.13 -3.47 -0.07 0.00 0.13 0.00 0.00 42.46 38.92 2b39 s ILE 1470CO 0.64 0.17 0.68 -1.10 -1.91 0.00 0.00 174.94 173.42 2b39 s GLN 1471N -1.55 3.79 0.66 3.50 -1.52 -1.26 -4.99 119.66 118.29 2b39 s GLN 1471Ca 0.50 0.37 -0.15 0.00 -1.95 0.00 0.00 55.36 54.13 2b39 s GLN 1471Cb -0.40 -2.49 0.00 0.00 -0.22 0.00 0.00 33.01 29.90 2b39 s GLN 1471CO 0.51 0.11 1.14 -1.25 -0.25 0.00 0.00 175.29 175.54 2b39 s PRO 1472N -3.47 2.69 0.75 2.91 0.04 -1.26 -4.67 135.00 131.98 2b39 s PRO 1472Ca 0.50 1.51 -0.00 0.00 0.04 0.00 0.00 61.00 63.05 2b39 s PRO 1472Cb -0.10 -1.93 0.15 0.00 0.04 0.00 0.00 34.50 32.65 2b39 s PRO 1472CO 0.27 -1.36 1.02 0.20 0.04 0.00 0.00 177.00 177.18 2b39 s GLY 1473N -2.34 1.75 -0.07 0.56 0.00 -0.78 -4.88 107.32 101.56 2b39 s GLY 1473Ca 0.70 -1.87 -0.11 0.00 0.00 0.00 0.00 44.72 43.43 2b39 s GLY 1473CO 0.41 -1.25 0.28 0.00 0.00 0.00 0.00 173.10 172.54 2b39 s ALA 1474N -3.18 -0.69 -0.24 3.20 0.00 -1.22 -1.92 121.76 117.70 2b39 s ALA 1474Ca 0.68 0.55 0.02 0.00 0.00 0.00 0.00 51.96 53.20 2b39 s ALA 1474Cb -0.04 -0.23 0.06 0.00 0.00 0.00 0.00 23.12 22.91 2b39 s ALA 1474CO 0.45 -0.19 -0.08 0.08 0.00 0.00 0.00 175.76 176.02 2b39 s VAL 1475N -0.51 1.83 -0.04 0.00 1.01 0.25 -1.23 120.40 121.72 2b39 s VAL 1475Ca -0.06 -1.40 -0.03 0.00 0.00 0.00 0.00 61.98 60.49 2b39 s VAL 1475Cb -0.04 -2.01 -0.04 0.00 0.00 0.00 0.00 36.38 34.29 2b39 s VAL 1475CO 0.02 -0.05 0.12 -0.75 0.00 0.00 0.00 175.10 174.44 2b39 s LYS 1476N 1.26 3.26 -0.01 2.72 2.20 -0.74 -1.80 119.74 126.64 2b39 s LYS 1476Ca -0.07 -0.34 0.02 0.00 -0.36 0.00 0.00 55.97 55.23 2b39 s LYS 1476Cb -0.19 -3.01 -0.00 0.00 -1.51 0.00 0.00 37.83 33.12 2b39 s LYS 1476CO -0.06 0.69 -0.08 0.54 -0.36 0.00 0.00 175.35 176.08 2b39 s VAL 1477N -1.16 0.67 0.17 4.02 0.11 0.68 -0.77 120.40 124.11 2b39 s VAL 1477Ca 0.21 -0.34 -0.19 0.00 -2.93 0.00 0.00 61.98 58.74 2b39 s VAL 1477Cb -0.12 -0.57 0.04 0.00 -1.53 0.00 0.00 36.38 34.20 2b39 s VAL 1477CO 0.12 0.20 0.52 -0.72 -3.33 0.00 0.00 175.10 171.89 2b39 s TYR 1478N -0.05 -0.25 0.09 1.54 -0.85 -0.84 -1.11 117.35 115.88 2b39 s TYR 1478Ca 0.01 -0.06 -0.28 0.00 -0.52 0.00 0.00 57.07 56.22 2b39 s TYR 1478Cb -0.05 0.42 -0.06 0.00 0.38 0.00 0.00 41.96 42.65 2b39 s TYR 1478CO -0.00 -0.86 0.89 0.45 -1.52 0.00 0.00 175.55 174.50 2b39 s SER 1479N -2.83 7.39 0.16 -0.18 0.15 -0.91 -0.15 113.70 117.33 2b39 s SER 1479Ca 0.06 1.67 -0.13 0.00 0.70 0.00 0.00 55.95 58.24 2b39 s SER 1479Cb -0.01 -2.54 0.05 0.00 -1.71 0.00 0.00 66.02 61.81 2b39 s SER 1479CO -0.07 -0.03 1.71 0.22 1.20 0.00 0.00 173.24 176.26 2b39 h TYR 1480N 5.60 0.83 -0.81 3.44 3.20 -1.78 -2.92 116.97 124.52 2b39 h TYR 1480Ca -0.43 -0.07 -0.43 0.00 3.14 0.00 0.00 58.73 60.94 2b39 h TYR 1480Cb 1.21 -0.25 -0.25 0.00 1.54 0.00 0.00 36.73 38.98 2b39 h TYR 1480CO 0.65 0.68 0.55 0.66 -1.64 0.00 0.00 178.16 179.06 2b39 n TYR 1481N -4.51 2.52 -2.67 -3.82 4.02 -1.26 -4.47 117.16 106.96 2b39 n TYR 1481Ca 0.02 -1.68 -0.04 0.00 -0.01 0.00 0.00 57.90 56.19 2b39 n TYR 1481Cb 0.17 -0.86 0.05 0.00 -0.02 0.00 0.00 39.34 38.68 2b39 n TYR 1481CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 176.86 174.14 2b39 n ASN 1482N -0.81 -1.42 0.00 7.72 5.15 -1.10 -4.57 115.26 120.22 2b39 n ASN 1482Ca 0.49 -1.38 0.00 0.00 -0.60 0.00 0.00 54.58 53.09 2b39 n ASN 1482Cb 1.39 0.75 0.00 0.00 -0.53 0.00 0.00 39.78 41.39 2b39 n ASN 1482CO 0.00 0.00 0.00 0.18 1.40 0.00 0.00 177.26 178.84 2b39 n LEU 1483N 2.08 0.00 0.08 1.20 4.77 -1.23 -1.44 117.00 122.45 2b39 n LEU 1483Ca 0.07 0.20 -0.07 0.00 -0.03 0.00 0.00 56.01 56.17 2b39 n LEU 1483Cb 0.67 -0.20 0.06 0.00 -2.33 0.00 0.00 43.42 41.63 2b39 n LEU 1483CO -0.12 -0.20 0.38 0.44 -1.33 0.00 0.00 177.39 176.56 2b39 h ASP 1484N 0.00 0.32 -2.55 -1.43 5.19 -1.95 -3.39 116.42 112.62 2b39 h ASP 1484Ca 0.00 -0.21 -0.60 0.00 -0.62 0.00 0.00 57.03 55.60 2b39 h ASP 1484Cb 0.34 -0.10 -0.12 0.00 0.18 0.00 0.00 39.33 39.63 2b39 h ASP 1484CO 0.00 0.93 0.73 -1.61 -3.12 0.00 0.00 179.24 176.17 2b39 s GLU 1485N -3.56 3.14 0.13 3.56 2.02 -0.52 -4.68 118.70 118.78 2b39 s GLU 1485Ca -0.04 -0.63 -0.24 0.00 0.02 0.00 0.00 54.97 54.08 2b39 s GLU 1485Cb 0.11 -4.21 0.07 0.00 0.10 0.00 0.00 34.13 30.20 2b39 s GLU 1485CO 0.82 -1.94 0.63 -0.08 0.02 0.00 0.00 175.26 174.71 2b39 s THR 1486N 4.66 0.00 0.04 3.63 -1.32 -0.64 -2.15 115.64 119.86 2b39 s THR 1486Ca 0.27 0.00 -0.08 0.00 -1.21 0.00 0.00 61.69 60.67 2b39 s THR 1486Cb -0.14 -1.00 -0.00 0.00 -1.51 0.00 0.00 72.50 69.85 2b39 s THR 1486CO 0.12 0.00 0.15 0.00 -2.21 0.00 0.00 174.62 172.68 2b39 s ILE 1488N -2.78 -0.09 0.14 0.00 2.07 -1.26 -0.23 121.20 119.05 2b39 s ILE 1488Ca -0.03 0.20 0.07 0.00 -1.41 0.00 0.00 60.65 59.47 2b39 s ILE 1488Cb -0.00 -0.29 -0.04 0.00 0.13 0.00 0.00 42.46 42.26 2b39 s ILE 1488CO -0.05 0.08 -0.15 -0.13 -1.91 0.00 0.00 174.94 172.78 2b39 s ARG 1489N 1.38 1.11 0.08 3.50 3.00 -0.74 -4.97 118.95 122.32 2b39 s ARG 1489Ca -0.07 -1.31 0.06 0.00 0.00 0.00 0.00 55.73 54.40 2b39 s ARG 1489Cb -0.11 -1.03 -0.04 0.00 0.00 0.00 0.00 34.95 33.77 2b39 s ARG 1489CO -0.07 0.20 -0.07 -0.06 0.00 0.00 0.00 175.30 175.30 2b39 s PHE 1490N -2.20 2.82 -0.07 -0.53 0.08 -1.26 -0.58 117.98 116.22 2b39 s PHE 1490Ca 0.12 -0.11 0.03 0.00 0.12 0.00 0.00 56.93 57.09 2b39 s PHE 1490Cb -0.05 -1.48 0.01 0.00 -0.57 0.00 0.00 43.02 40.93 2b39 s PHE 1490CO 0.04 0.43 -0.17 1.52 -0.10 0.00 0.00 175.22 176.94 2b39 s TYR 1491N -1.20 1.88 0.05 0.36 -0.85 -0.81 -4.93 117.35 111.86 2b39 s TYR 1491Ca 0.22 -0.71 0.04 0.00 -0.52 0.00 0.00 57.07 56.10 2b39 s TYR 1491Cb -0.11 -1.31 -0.02 0.00 0.38 0.00 0.00 41.96 40.90 2b39 s TYR 1491CO 0.14 -0.31 -0.13 -1.58 -1.52 0.00 0.00 175.55 172.15 2b39 s HIS 1492N 0.47 1.08 0.00 -3.49 2.46 -1.26 -1.86 115.29 112.70 2b39 s HIS 1492Ca -0.15 -0.41 0.00 0.00 0.47 0.00 0.00 55.06 54.97 2b39 s HIS 1492Cb -0.16 -0.63 0.00 0.00 -0.13 0.00 0.00 32.58 31.66 2b39 s HIS 1492CO 0.05 0.02 0.00 -2.30 -2.47 0.00 0.00 174.74 170.04 2b39 n PRO 1493N 1.60 0.19 -3.03 2.88 -0.02 -1.26 -4.67 135.00 130.69 2b39 n PRO 1493Ca -0.20 0.00 -0.34 0.00 -2.02 0.00 0.00 63.50 60.94 2b39 n PRO 1493Cb 0.55 0.00 -0.06 0.00 -0.02 0.00 0.00 33.50 33.96 2b39 n PRO 1493CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2b39 s ASP 1494N -1.00 6.92 0.00 2.55 1.01 -1.26 -4.90 116.67 119.99 2b39 s ASP 1494Ca 0.00 1.45 0.00 0.00 0.71 0.00 0.00 52.55 54.71 2b39 s ASP 1494Cb 0.00 -2.44 0.00 0.00 1.01 0.00 0.00 42.92 41.49 2b39 s ASP 1494CO 0.00 -0.17 0.28 2.29 0.21 0.00 0.00 175.17 177.78 2b39 n LYS 1495N -0.10 0.00 0.00 8.23 2.85 -1.26 0.76 118.16 128.64 2b39 n LYS 1495Ca 0.03 0.03 0.02 0.00 -1.05 0.00 0.00 58.31 57.35 2b39 n LYS 1495Cb 0.53 -1.55 0.00 0.00 -0.65 0.00 0.00 35.03 33.35 2b39 n LYS 1495CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 177.40 177.74 2b39 n GLU 1496N -0.78 2.12 0.18 -1.58 1.02 -1.26 -4.56 120.64 115.78 2b39 n GLU 1496Ca 0.00 -0.47 0.12 0.00 -0.02 0.00 0.00 57.16 56.80 2b39 n GLU 1496Cb 0.05 -0.94 0.66 0.00 -0.02 0.00 0.00 31.44 31.20 2b39 n GLU 1496CO 0.00 0.00 0.00 -0.44 1.18 0.00 0.00 177.13 177.87 2b39 h ASP 1497N 0.58 0.00 -0.07 1.62 3.32 -0.02 -3.44 116.42 118.41 2b39 h ASP 1497Ca 0.00 0.00 -0.03 0.00 0.02 0.00 0.00 57.03 57.02 2b39 h ASP 1497Cb 0.17 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.71 2b39 h ASP 1497CO 0.00 0.00 -0.03 0.61 -1.72 0.00 0.00 179.24 178.10 2b39 n GLY 1498N -1.24 0.36 0.00 2.75 0.00 -1.26 -4.75 105.19 101.05 2b39 n GLY 1498Ca -0.02 -0.07 0.07 0.00 0.00 0.00 0.00 46.02 46.01 2b39 n GLY 1498CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2b39 n MET 1499N -1.13 0.87 -0.34 1.61 2.81 -1.26 0.25 117.12 119.93 2b39 n MET 1499Ca -0.01 0.00 0.09 0.00 -1.81 0.00 0.00 57.70 55.97 2b39 n MET 1499Cb 0.28 -1.26 0.27 0.00 -0.71 0.00 0.00 33.22 31.80 2b39 n MET 1499CO 0.00 0.00 0.00 -0.11 1.51 0.00 0.00 175.97 177.37 2b39 n LEU 1500N -0.76 3.39 -4.55 4.03 7.94 -1.26 0.18 117.00 125.97 2b39 n LEU 1500Ca 0.11 -1.70 -0.36 0.00 -1.11 0.00 0.00 56.01 52.95 2b39 n LEU 1500Cb 0.05 -0.43 -0.03 0.00 0.53 0.00 0.00 43.42 43.54 2b39 n LEU 1500CO 0.08 0.79 1.66 -0.94 -1.11 0.00 0.00 177.39 177.87 2b39 s SER 1501N -0.97 5.06 -0.07 1.96 1.04 0.70 -4.56 113.70 116.86 2b39 s SER 1501Ca 0.41 0.39 -0.35 0.00 0.48 0.00 0.00 55.95 56.89 2b39 s SER 1501Cb 0.22 -2.53 -0.12 0.00 0.10 0.00 0.00 66.02 63.69 2b39 s SER 1501CO 0.26 -2.55 1.83 0.29 0.98 0.00 0.00 173.24 174.06 2b39 n LYS 1502N 9.12 2.09 0.03 4.02 5.02 -1.26 -3.64 118.16 133.54 2b39 n LYS 1502Ca 0.26 0.77 0.12 0.00 -2.02 0.00 0.00 58.31 57.43 2b39 n LYS 1502Cb 0.52 -2.59 0.21 0.00 -0.02 0.00 0.00 35.03 33.16 2b39 n LYS 1502CO 0.00 0.00 0.00 -0.11 -0.52 0.00 0.00 177.40 176.77 2b39 n LEU 1503N 6.13 0.57 -4.78 -0.35 7.94 -1.26 -4.88 117.00 120.37 2b39 n LEU 1503Ca 0.22 0.12 -0.35 0.00 -1.11 0.00 0.00 56.01 54.89 2b39 n LEU 1503Cb 0.28 -0.22 -0.01 0.00 0.53 0.00 0.00 43.42 44.00 2b39 n LEU 1503CO 0.72 0.04 0.77 0.00 -1.11 0.00 0.00 177.39 177.81 2b39 n HIS 1505N -1.00 0.56 -1.17 0.00 -0.00 -1.26 -4.77 115.22 107.58 2b39 n HIS 1505Ca 0.10 -1.45 -0.46 0.00 0.46 0.00 0.00 57.72 56.36 2b39 n HIS 1505Cb 0.51 -0.20 -0.06 0.00 -0.12 0.00 0.00 29.99 30.11 2b39 n HIS 1505CO 0.00 0.00 0.00 1.63 0.46 0.00 0.00 176.34 178.43 2b39 n LYS 1506N -0.78 0.00 -0.51 1.57 5.02 -1.26 -0.74 118.16 121.46 2b39 n LYS 1506Ca -0.11 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.18 2b39 n LYS 1506Cb 0.37 -1.17 0.00 0.00 -0.02 0.00 0.00 35.03 34.22 2b39 n LYS 1506CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 2b39 n ASP 1507N 1.23 0.00 -0.00 4.39 8.00 -1.26 -4.56 116.55 124.35 2b39 n ASP 1507Ca 0.16 0.00 0.07 0.00 0.71 0.00 0.00 54.79 55.73 2b39 n ASP 1507Cb 0.06 -1.57 -0.09 0.00 -0.02 0.00 0.00 41.12 39.50 2b39 n ASP 1507CO 0.00 0.00 0.00 0.41 -0.39 0.00 0.00 177.20 177.22 2b39 n THR 1508N -2.00 0.00 -0.03 -3.53 -1.04 0.08 -3.31 114.28 104.46 2b39 n THR 1508Ca 0.00 -0.22 -0.18 0.00 -2.04 0.00 0.00 64.05 61.61 2b39 n THR 1508Cb 0.00 0.73 -0.14 0.00 -1.82 0.00 0.00 70.33 69.10 2b39 n THR 1508CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2b39 h ARG 1510N 0.05 0.31 -0.65 0.00 1.12 -1.82 -1.54 114.38 111.85 2b39 h ARG 1510Ca -0.43 -0.02 -0.04 0.00 -1.11 0.00 0.00 59.98 58.37 2b39 h ARG 1510Cb 2.02 -0.07 -0.03 0.00 -0.01 0.00 0.00 29.97 31.88 2b39 h ARG 1510CO 0.06 0.21 0.24 0.00 -3.11 0.00 0.00 179.97 177.36 2b39 n ALA 1512N -2.39 6.01 0.00 0.00 0.00 -0.58 -3.54 120.51 120.00 2b39 n ALA 1512Ca 0.04 -2.28 0.00 0.00 0.00 0.00 0.00 53.44 51.20 2b39 n ALA 1512Cb 0.19 -1.95 0.00 0.00 0.00 0.00 0.00 19.45 17.68 2b39 n ALA 1512CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2b39 n GLU 1513N 1.19 2.29 -0.18 0.00 -0.58 -1.12 -4.76 120.64 117.49 2b39 n GLU 1513Ca 0.40 0.00 -0.02 0.00 -0.42 0.00 0.00 57.16 57.12 2b39 n GLU 1513Cb 0.64 -0.81 0.05 0.00 -0.57 0.00 0.00 31.44 30.75 2b39 n GLU 1513CO 0.00 0.00 0.00 0.93 -0.48 0.00 0.00 177.13 177.58 2b39 h GLU 1514N 0.00 0.01 -0.27 3.49 4.39 -1.74 -2.05 114.58 118.41 2b39 h GLU 1514Ca 0.00 -0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.69 2b39 h GLU 1514Cb 0.07 -0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.70 2b39 h GLU 1514CO 0.00 0.01 0.15 -0.91 -1.16 0.00 0.00 179.01 177.10 2b39 h ASN 1515N 0.01 0.34 -0.73 1.42 -0.26 -1.86 -3.28 115.58 111.22 2b39 h ASN 1515Ca 0.27 -0.08 0.09 0.00 -0.56 0.00 0.00 56.30 56.01 2b39 h ASN 1515Cb 0.41 -0.09 -0.11 0.00 -1.06 0.00 0.00 38.32 37.47 2b39 h ASN 1515CO -0.55 0.32 -0.52 0.00 -1.06 0.00 0.00 177.43 175.62 2b39 n PHE 1517N -5.35 0.00 0.00 0.00 1.16 -1.20 -4.31 117.46 107.76 2b39 n PHE 1517Ca 0.01 0.00 0.00 0.00 -1.87 0.00 0.00 57.45 55.59 2b39 n PHE 1517Cb 0.32 0.00 0.00 0.00 -1.61 0.00 0.00 39.48 38.19 2b39 n PHE 1517CO 0.00 0.00 0.00 2.41 -1.87 0.00 0.00 176.76 177.30 2b39 n THR 1526N 0.00 0.00 -0.12 1.97 -1.04 -1.26 -4.52 114.28 109.30 2b39 n THR 1526Ca 0.00 0.06 0.27 0.00 -2.04 0.00 0.00 64.05 62.33 2b39 n THR 1526Cb 0.00 -0.95 0.72 0.00 -1.82 0.00 0.00 70.33 68.28 2b39 n THR 1526CO 0.00 0.00 0.00 0.25 -0.64 0.00 0.00 175.07 174.68 2b39 h LEU 1527N 0.00 0.00 0.00 -4.42 6.46 -2.00 -2.17 115.31 113.18 2b39 h LEU 1527Ca 0.00 0.00 -0.20 0.00 -0.12 0.00 0.00 57.88 57.56 2b39 h LEU 1527Cb 0.00 0.00 -0.04 0.00 -0.73 0.00 0.00 40.66 39.89 2b39 h LEU 1527CO 0.00 0.00 -1.90 -1.84 -0.62 0.00 0.00 178.44 174.08 2b39 n GLU 1528N -4.19 1.45 0.25 1.25 0.28 -1.26 -4.39 120.64 114.04 2b39 n GLU 1528Ca 0.16 -0.03 0.09 0.00 -0.16 0.00 0.00 57.16 57.22 2b39 n GLU 1528Cb 0.89 -1.36 0.64 0.00 1.43 0.00 0.00 31.44 33.05 2b39 n GLU 1528CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 177.13 176.53 2b39 h ASP 1529N 0.00 0.00 0.89 -1.84 3.32 -1.87 -2.54 116.42 114.38 2b39 h ASP 1529Ca -0.30 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.75 2b39 h ASP 1529Cb 1.61 0.00 0.00 0.00 0.22 0.00 0.00 39.33 41.16 2b39 h ASP 1529CO 0.02 0.13 -0.57 -2.11 -1.72 0.00 0.00 179.24 174.99 2b39 n ARG 1530N -3.99 0.27 -0.02 3.56 1.85 -0.94 -3.47 116.66 113.93 2b39 n ARG 1530Ca -0.02 0.09 0.13 0.00 -1.00 0.00 0.00 57.85 57.05 2b39 n ARG 1530Cb 0.22 -1.68 0.40 0.00 -1.05 0.00 0.00 32.46 30.35 2b39 n ARG 1530CO 0.00 0.00 0.00 1.28 -0.01 0.00 0.00 177.63 178.90 2b39 n LEU 1531N -2.08 1.94 -0.08 2.89 4.77 -0.96 -2.78 117.00 120.69 2b39 n LEU 1531Ca 0.04 -0.67 -0.20 0.00 -0.03 0.00 0.00 56.01 55.15 2b39 n LEU 1531Cb 0.43 -0.02 -0.13 0.00 -2.33 0.00 0.00 43.42 41.38 2b39 n LEU 1531CO 0.36 0.34 -1.14 0.47 -1.33 0.00 0.00 177.39 176.08 2b39 n ASP 1532N 0.51 2.03 0.06 -1.43 8.00 -1.18 -3.81 116.55 120.74 2b39 n ASP 1532Ca 0.18 0.02 0.13 0.00 0.71 0.00 0.00 54.79 55.83 2b39 n ASP 1532Cb 0.42 -0.60 0.48 0.00 -0.02 0.00 0.00 41.12 41.40 2b39 n ASP 1532CO 0.00 0.00 0.00 1.17 -0.39 0.00 0.00 177.20 177.98 2b39 n LYS 1533N -3.41 0.16 0.06 -1.24 3.00 -1.23 -2.93 118.16 112.58 2b39 n LYS 1533Ca -0.41 0.13 0.12 0.00 -0.00 0.00 0.00 58.31 58.15 2b39 n LYS 1533Cb 1.00 -1.68 0.20 0.00 0.00 0.00 0.00 35.03 34.54 2b39 n LYS 1533CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2b39 n ALA 1534N -1.67 2.86 0.96 3.14 0.00 -1.12 -3.61 120.51 121.07 2b39 n ALA 1534Ca 0.06 -0.23 0.10 0.00 0.00 0.00 0.00 53.44 53.38 2b39 n ALA 1534Cb 0.39 -1.20 -0.03 0.00 0.00 0.00 0.00 19.45 18.62 2b39 n ALA 1534CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2b39 n GLU 1536N -0.32 0.22 -0.02 0.00 1.02 -1.20 -4.79 120.64 115.55 2b39 n GLU 1536Ca 0.08 0.12 0.00 0.00 -0.02 0.00 0.00 57.16 57.34 2b39 n GLU 1536Cb 0.42 -1.90 0.00 0.00 -0.02 0.00 0.00 31.44 29.94 2b39 n GLU 1536CO 0.00 0.00 0.00 -2.30 1.18 0.00 0.00 177.13 176.01 2b39 n PRO 1537N -1.13 0.59 0.00 3.49 -0.02 -1.26 -2.67 135.00 134.00 2b39 n PRO 1537Ca 0.10 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.58 2b39 n PRO 1537Cb 0.50 -1.20 0.00 0.00 -0.02 0.00 0.00 33.50 32.78 2b39 n PRO 1537CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2b39 n GLY 1538N 0.77 0.48 3.90 -1.23 0.00 -1.26 -5.09 105.19 102.77 2b39 n GLY 1538Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.73 2b39 n GLY 1538CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2b39 s VAL 1539N -0.08 5.06 0.00 1.61 1.01 -1.09 -4.17 120.40 122.74 2b39 s VAL 1539Ca 0.00 0.04 0.00 0.00 0.00 0.00 0.00 61.98 62.02 2b39 s VAL 1539Cb 0.00 -3.70 0.00 0.00 0.00 0.00 0.00 36.38 32.68 2b39 s VAL 1539CO 0.00 -0.21 0.00 0.47 0.00 0.00 0.00 175.10 175.36 2b39 n ASP 1540N -0.62 0.00 -3.66 3.32 8.00 -0.96 -4.91 116.55 117.72 2b39 n ASP 1540Ca -0.02 -0.89 -0.12 0.00 0.71 0.00 0.00 54.79 54.47 2b39 n ASP 1540Cb 0.53 0.00 -0.08 0.00 -0.02 0.00 0.00 41.12 41.55 2b39 n ASP 1540CO 0.00 0.00 0.00 -0.72 -0.39 0.00 0.00 177.20 176.09 2b39 s TYR 1541N 0.00 -0.74 -0.12 1.24 -0.85 -1.20 -2.72 117.35 112.95 2b39 s TYR 1541Ca 0.00 1.69 -0.05 0.00 -0.52 0.00 0.00 57.07 58.19 2b39 s TYR 1541Cb 0.00 0.31 0.06 0.00 0.38 0.00 0.00 41.96 42.71 2b39 s TYR 1541CO 0.00 -0.36 0.26 0.08 -1.52 0.00 0.00 175.55 174.01 2b39 s VAL 1542N 0.66 -0.34 0.20 -3.49 1.01 -1.25 -2.97 120.40 114.21 2b39 s VAL 1542Ca -0.03 0.26 -0.02 0.00 0.00 0.00 0.00 61.98 62.19 2b39 s VAL 1542Cb -0.05 -0.43 -0.04 0.00 0.00 0.00 0.00 36.38 35.86 2b39 s VAL 1542CO -0.04 0.11 0.15 -0.31 0.00 0.00 0.00 175.10 175.00 2b39 s TYR 1543N 2.20 1.10 -0.37 5.22 1.51 -0.96 -1.08 117.35 124.97 2b39 s TYR 1543Ca -0.01 -1.34 0.05 0.00 -1.01 0.00 0.00 57.07 54.77 2b39 s TYR 1543Cb -0.12 -0.51 0.45 0.00 -0.11 0.00 0.00 41.96 41.67 2b39 s TYR 1543CO -0.09 -0.65 1.30 1.17 -1.11 0.00 0.00 175.55 176.17 2b39 n LYS 1544N -0.27 3.46 -0.84 -0.62 0.00 -0.64 -1.81 118.16 117.44 2b39 n LYS 1544Ca 0.01 -4.10 -0.34 0.00 0.00 0.00 0.00 58.31 53.88 2b39 n LYS 1544Cb 0.66 -2.28 0.10 0.00 0.00 0.00 0.00 35.03 33.51 2b39 n LYS 1544CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.40 177.65 2b39 n THR 1545N -0.69 0.00 -3.87 3.15 -2.24 -1.18 -3.87 114.28 105.58 2b39 n THR 1545Ca 0.46 -0.26 -0.22 0.00 -2.27 0.00 0.00 64.05 61.75 2b39 n THR 1545Cb 0.86 -0.47 -0.17 0.00 -2.10 0.00 0.00 70.33 68.45 2b39 n THR 1545CO 0.00 0.00 0.00 -0.60 -0.57 0.00 0.00 175.07 173.90 2b39 s ARG 1546N -3.24 0.66 0.16 -0.78 3.52 0.11 -0.56 118.95 118.81 2b39 s ARG 1546Ca 0.53 0.05 -0.32 0.00 -0.13 0.00 0.00 55.73 55.86 2b39 s ARG 1546Cb -0.20 -0.92 -0.10 0.00 -1.56 0.00 0.00 34.95 32.17 2b39 s ARG 1546CO 0.71 -0.24 1.57 -1.17 -0.81 0.00 0.00 175.30 175.36 2b39 s LEU 1547N 1.67 4.37 -0.06 -0.88 0.20 -0.55 -0.53 118.68 122.89 2b39 s LEU 1547Ca 0.00 2.61 0.02 0.00 0.69 0.00 0.00 54.13 57.46 2b39 s LEU 1547Cb -0.13 -3.59 -0.05 0.00 -0.43 0.00 0.00 46.19 41.99 2b39 s LEU 1547CO -0.04 -0.83 -0.03 0.00 -0.29 0.00 0.00 176.35 175.16 2b39 n ILE 1548N 4.00 0.39 -4.67 6.68 3.06 -0.08 -2.98 119.36 125.76 2b39 n ILE 1548Ca 0.14 -0.18 -0.25 0.00 -2.50 0.00 0.00 62.75 59.96 2b39 n ILE 1548Cb 0.39 -0.79 -0.16 0.00 0.54 0.00 0.00 39.64 39.61 2b39 n ILE 1548CO 0.00 0.00 0.00 -1.10 -2.50 0.00 0.00 176.55 172.95 2b39 s GLN 1549N -2.14 1.68 -0.70 9.51 -1.52 -0.89 -4.85 119.66 120.75 2b39 s GLN 1549Ca -0.07 -0.48 0.04 0.00 -1.95 0.00 0.00 55.36 52.90 2b39 s GLN 1549Cb 0.02 -1.42 0.17 0.00 -0.22 0.00 0.00 33.01 31.56 2b39 s GLN 1549CO 0.19 0.12 0.50 0.21 -0.25 0.00 0.00 175.29 176.05 2b39 s LYS 1550N 0.37 2.49 -1.06 2.91 2.20 -1.26 -0.34 119.74 125.05 2b39 s LYS 1550Ca -0.10 -3.29 -0.17 0.00 -0.36 0.00 0.00 55.97 52.06 2b39 s LYS 1550Cb -0.13 -3.46 0.15 0.00 -1.51 0.00 0.00 37.83 32.88 2b39 s LYS 1550CO 0.03 -1.27 1.27 0.15 -0.36 0.00 0.00 175.35 175.17 2b39 s LYS 1551N -1.36 3.82 0.40 4.03 1.02 0.34 -4.99 119.74 122.99 2b39 s LYS 1551Ca 0.24 -2.12 -0.26 0.00 0.02 0.00 0.00 55.97 53.85 2b39 s LYS 1551Cb -0.06 -4.99 -0.09 0.00 -0.52 0.00 0.00 37.83 32.17 2b39 s LYS 1551CO -0.15 -1.78 1.23 -0.51 -0.92 0.00 0.00 175.35 173.22 2b39 s LEU 1552N 2.23 4.22 0.13 3.17 1.02 -1.26 -1.25 118.68 126.93 2b39 s LEU 1552Ca 0.37 2.49 0.04 0.00 0.02 0.00 0.00 54.13 57.05 2b39 s LEU 1552Cb -0.04 -3.95 -0.04 0.00 0.02 0.00 0.00 46.19 42.18 2b39 s LEU 1552CO -0.05 -0.74 -0.10 -1.61 0.02 0.00 0.00 176.35 173.88 2b39 s GLU 1553N -2.23 0.98 -0.01 1.70 0.41 -1.26 -4.89 118.70 113.41 2b39 s GLU 1553Ca 0.56 -1.37 0.04 0.00 -0.41 0.00 0.00 54.97 53.79 2b39 s GLU 1553Cb -0.34 -0.54 0.12 0.00 -1.78 0.00 0.00 34.13 31.58 2b39 s GLU 1553CO 0.44 0.06 1.05 -0.40 -0.49 0.00 0.00 175.26 175.92 2b39 n ASP 1554N -0.02 0.83 0.00 -0.19 3.85 -1.26 -4.35 116.55 115.41 2b39 n ASP 1554Ca -0.12 -2.02 0.00 0.00 -0.71 0.00 0.00 54.79 51.94 2b39 n ASP 1554Cb 0.60 -0.14 0.00 0.00 -1.35 0.00 0.00 41.12 40.23 2b39 n ASP 1554CO 0.00 0.00 0.00 -0.67 -1.01 0.00 0.00 177.20 175.52 2b39 n ASP 1555N -0.09 0.00 -3.89 -1.12 -0.08 -1.26 -4.82 116.55 105.29 2b39 n ASP 1555Ca 0.04 0.00 -0.26 0.00 -1.51 0.00 0.00 54.79 53.07 2b39 n ASP 1555Cb 0.15 0.00 -0.17 0.00 2.34 0.00 0.00 41.12 43.44 2b39 n ASP 1555CO 0.00 0.00 0.00 -0.36 0.12 0.00 0.00 177.20 176.96 2b39 s PHE 1556N 0.00 1.28 0.30 -0.67 0.40 -1.26 -3.29 117.98 114.74 2b39 s PHE 1556Ca 0.00 -0.58 -0.29 0.00 -0.60 0.00 0.00 56.93 55.45 2b39 s PHE 1556Cb 0.00 -1.11 -0.10 0.00 0.51 0.00 0.00 43.02 42.32 2b39 s PHE 1556CO 0.00 -0.44 1.35 -0.51 0.70 0.00 0.00 175.22 176.32 2b39 s ASP 1557N 1.64 6.74 -0.29 1.36 -0.00 -0.48 -4.30 116.67 121.34 2b39 s ASP 1557Ca 0.03 2.66 -0.03 0.00 -0.00 0.00 0.00 52.55 55.21 2b39 s ASP 1557Cb -0.13 -2.64 0.04 0.00 -0.00 0.00 0.00 42.92 40.19 2b39 s ASP 1557CO -0.06 -0.59 0.00 -1.61 -0.00 0.00 0.00 175.17 172.91 2b39 s GLU 1558N -1.22 2.61 -0.47 8.23 2.02 -0.38 -2.97 118.70 126.51 2b39 s GLU 1558Ca 0.53 -1.15 -0.06 0.00 0.02 0.00 0.00 54.97 54.31 2b39 s GLU 1558Cb -0.40 -3.18 0.12 0.00 0.10 0.00 0.00 34.13 30.77 2b39 s GLU 1558CO 0.49 -0.55 0.31 0.71 0.02 0.00 0.00 175.26 176.24 2b39 s TYR 1559N 1.31 3.50 -0.04 1.61 1.51 -0.53 -0.51 117.35 124.21 2b39 s TYR 1559Ca -0.03 -2.19 -0.30 0.00 -1.01 0.00 0.00 57.07 53.54 2b39 s TYR 1559Cb -0.19 -3.37 -0.06 0.00 -0.11 0.00 0.00 41.96 38.24 2b39 s TYR 1559CO -0.01 -0.97 1.68 0.42 -1.11 0.00 0.00 175.55 175.56 2b39 s ILE 1560N 1.08 3.52 -0.00 2.71 1.01 0.54 -2.25 121.20 127.81 2b39 s ILE 1560Ca 0.08 0.64 0.02 0.00 0.00 0.00 0.00 60.65 61.39 2b39 s ILE 1560Cb -0.24 -3.41 -0.04 0.00 0.01 0.00 0.00 42.46 38.79 2b39 s ILE 1560CO -0.03 -0.06 -0.02 -0.32 0.00 0.00 0.00 174.94 174.51 2b39 s MET 1561N 4.05 2.71 -0.14 2.79 1.75 -0.74 -0.91 119.30 128.81 2b39 s MET 1561Ca 0.75 -0.65 -0.04 0.00 -1.25 0.00 0.00 55.69 54.50 2b39 s MET 1561Cb -0.34 -2.61 -0.03 0.00 2.84 0.00 0.00 34.83 34.68 2b39 s MET 1561CO 0.31 0.62 -0.00 0.08 -0.65 0.00 0.00 175.02 175.37 2b39 s VAL 1562N -1.05 4.24 -0.76 10.11 1.01 0.31 -1.51 120.40 132.75 2b39 s VAL 1562Ca 0.18 -0.24 -0.22 0.00 0.00 0.00 0.00 61.98 61.70 2b39 s VAL 1562Cb -0.11 -2.85 0.08 0.00 0.00 0.00 0.00 36.38 33.50 2b39 s VAL 1562CO 0.09 0.52 1.05 -0.63 0.00 0.00 0.00 175.10 176.12 2b39 s ILE 1563N 0.01 4.39 -1.70 2.22 1.09 -1.20 0.09 121.20 126.10 2b39 s ILE 1563Ca 0.03 -0.69 0.13 0.00 -1.10 0.00 0.00 60.65 59.01 2b39 s ILE 1563Cb -0.13 -4.74 0.29 0.00 -1.06 0.00 0.00 42.46 36.82 2b39 s ILE 1563CO 0.02 -1.51 1.26 -0.62 -0.10 0.00 0.00 174.94 173.99 2b39 n GLU 1564N 7.51 0.29 0.00 2.79 -0.58 -1.25 -3.79 120.64 125.61 2b39 n GLU 1564Ca 0.06 0.09 0.00 0.00 -0.42 0.00 0.00 57.16 56.89 2b39 n GLU 1564Cb 0.47 -1.50 0.00 0.00 -0.57 0.00 0.00 31.44 29.84 2b39 n GLU 1564CO 0.00 0.00 0.00 -1.71 -0.48 0.00 0.00 177.13 174.94 2b39 n ASN 1565N -1.15 0.00 -4.73 1.62 2.85 -1.26 -4.89 115.26 107.70 2b39 n ASN 1565Ca 0.08 0.00 -0.32 0.00 -0.11 0.00 0.00 54.58 54.23 2b39 n ASN 1565Cb 0.07 0.00 -0.08 0.00 1.24 0.00 0.00 39.78 41.02 2b39 n ASN 1565CO 0.00 0.00 0.00 -0.63 -2.11 0.00 0.00 177.26 174.52 2b39 s ILE 1566N -1.11 4.41 0.00 -1.44 1.01 -1.26 -1.61 121.20 121.19 2b39 s ILE 1566Ca 0.00 -0.59 0.07 0.00 0.00 0.00 0.00 60.65 60.13 2b39 s ILE 1566Cb 0.00 -3.02 0.12 0.00 0.01 0.00 0.00 42.46 39.57 2b39 s ILE 1566CO 0.00 0.31 0.95 -0.38 0.00 0.00 0.00 174.94 175.81 2b39 n ILE 1567N 1.11 0.00 -3.60 2.92 5.41 -0.24 -4.94 119.36 120.02 2b39 n ILE 1567Ca -0.13 -0.27 0.00 0.00 1.00 0.00 0.00 62.75 63.35 2b39 n ILE 1567Cb 0.52 0.54 -0.01 0.00 -0.71 0.00 0.00 39.64 39.98 2b39 n ILE 1567CO 0.00 0.00 0.00 -0.75 0.00 0.00 0.00 176.55 175.80 2b39 s LYS 1568N 0.00 0.16 -0.92 0.38 2.47 -1.21 -4.71 119.74 115.92 2b39 s LYS 1568Ca 0.09 -0.08 -0.14 0.00 -1.56 0.00 0.00 55.97 54.28 2b39 s LYS 1568Cb 0.11 0.06 0.21 0.00 -1.46 0.00 0.00 37.83 36.75 2b39 s LYS 1568CO -0.05 -0.07 0.93 -1.12 0.16 0.00 0.00 175.35 175.20 2b39 s SER 1569N -2.56 6.86 -0.54 1.43 0.01 -1.26 -4.71 113.70 112.93 2b39 s SER 1569Ca 0.13 -2.75 -0.10 0.00 1.31 0.00 0.00 55.95 54.53 2b39 s SER 1569Cb 0.03 -2.26 -0.14 0.00 0.21 0.00 0.00 66.02 63.86 2b39 s SER 1569CO -0.04 -0.62 1.64 0.61 0.41 0.00 0.00 173.24 175.24 2b39 n GLY 1570N 4.03 -0.23 2.25 3.44 0.00 -1.24 -4.61 105.19 108.84 2b39 n GLY 1570Ca 0.19 0.05 -0.11 0.00 0.00 0.00 0.00 46.02 46.15 2b39 n GLY 1570CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2b39 n SER 1571N 9.46 -1.08 0.00 1.61 3.41 -1.10 -2.99 113.62 122.94 2b39 n SER 1571Ca 0.29 -0.51 0.00 0.00 -0.26 0.00 0.00 58.87 58.39 2b39 n SER 1571Cb 0.40 -0.37 0.00 0.00 -0.26 0.00 0.00 64.21 63.99 2b39 n SER 1571CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 2b39 n ASP 1572N 3.51 0.00 -4.70 4.04 -0.08 -1.26 -5.01 116.55 113.05 2b39 n ASP 1572Ca 0.34 0.00 -0.42 0.00 -1.51 0.00 0.00 54.79 53.20 2b39 n ASP 1572Cb 0.15 0.00 -0.03 0.00 2.34 0.00 0.00 41.12 43.59 2b39 n ASP 1572CO 0.00 0.00 0.00 -0.70 0.12 0.00 0.00 177.20 176.62 2b39 s GLU 1573N 0.00 4.48 0.00 -0.67 2.12 -1.16 -4.88 118.70 118.58 2b39 s GLU 1573Ca 0.00 1.41 0.00 0.00 0.36 0.00 0.00 54.97 56.74 2b39 s GLU 1573Cb 0.00 -3.51 0.00 0.00 0.26 0.00 0.00 34.13 30.88 2b39 s GLU 1573CO 0.00 -0.21 0.62 0.28 -0.54 0.00 0.00 175.26 175.41 2b39 n VAL 1574N 4.30 0.36 -1.61 3.70 0.31 -1.26 -4.54 118.33 119.60 2b39 n VAL 1574Ca 0.08 -0.41 -0.53 0.00 -0.01 0.00 0.00 64.34 63.47 2b39 n VAL 1574Cb 0.50 0.94 -0.06 0.00 -0.91 0.00 0.00 33.84 34.30 2b39 n VAL 1574CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2b39 n GLN 1575N -0.18 1.15 -2.16 5.55 3.00 -1.26 -4.93 117.38 118.55 2b39 n GLN 1575Ca 0.00 0.42 -0.27 0.00 -0.01 0.00 0.00 57.00 57.14 2b39 n GLN 1575Cb 0.33 -2.07 0.06 0.00 0.00 0.00 0.00 30.24 28.57 2b39 n GLN 1575CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.06 177.14 2b39 s VAL 1576N 0.91 2.50 -1.41 5.09 1.01 -1.26 -4.28 120.40 122.96 2b39 s VAL 1576Ca 0.86 -0.14 -0.03 0.00 0.00 0.00 0.00 61.98 62.67 2b39 s VAL 1576Cb -0.97 -3.09 0.00 0.00 0.00 0.00 0.00 36.38 32.32 2b39 s VAL 1576CO 0.49 -0.11 0.37 0.29 0.00 0.00 0.00 175.10 176.15 2b39 n LYS 1577N -2.94 -2.59 -2.74 2.72 4.76 -1.25 -4.96 118.16 111.16 2b39 n LYS 1577Ca 0.07 0.33 -0.09 0.00 -2.87 0.00 0.00 58.31 55.76 2b39 n LYS 1577Cb 0.60 -4.25 -0.02 0.00 -1.84 0.00 0.00 35.03 29.53 2b39 n LYS 1577CO 0.00 0.00 0.00 1.04 -1.37 0.00 0.00 177.40 177.07 2b39 n GLN 1578N -4.45 1.63 -3.88 1.97 1.13 -1.26 -4.91 117.38 107.61 2b39 n GLN 1578Ca -0.30 -1.05 -0.34 0.00 -1.94 0.00 0.00 57.00 53.37 2b39 n GLN 1578Cb 0.68 0.27 -0.13 0.00 0.11 0.00 0.00 30.24 31.17 2b39 n GLN 1578CO 0.00 0.00 0.00 -1.21 -1.44 0.00 0.00 177.06 174.41 2b39 s GLU 1579N -2.53 1.97 -0.31 -1.09 0.41 -1.26 -3.20 118.70 112.69 2b39 s GLU 1579Ca 0.00 -1.69 -0.05 0.00 -0.41 0.00 0.00 54.97 52.82 2b39 s GLU 1579Cb -0.00 -3.37 0.03 0.00 -1.78 0.00 0.00 34.13 29.02 2b39 s GLU 1579CO 0.00 -0.92 0.05 1.03 -0.49 0.00 0.00 175.26 174.93 2b39 s ARG 1580N 1.10 2.71 -0.16 1.61 1.81 -0.57 -4.93 118.95 120.52 2b39 s ARG 1580Ca 0.05 -1.10 -0.29 0.00 -1.72 0.00 0.00 55.73 52.67 2b39 s ARG 1580Cb -0.21 -3.30 -0.03 0.00 -0.45 0.00 0.00 34.95 30.96 2b39 s ARG 1580CO -0.05 -0.56 1.53 0.15 -0.68 0.00 0.00 175.30 175.69 2b39 s LYS 1581N 1.38 4.02 -0.12 3.54 1.02 -1.26 -1.79 119.74 126.52 2b39 s LYS 1581Ca -0.01 1.81 -0.11 0.00 0.02 0.00 0.00 55.97 57.68 2b39 s LYS 1581Cb -0.19 -3.95 -0.05 0.00 -0.52 0.00 0.00 37.83 33.13 2b39 s LYS 1581CO 0.01 -1.01 0.23 -0.06 -0.92 0.00 0.00 175.35 173.60 2b39 s PHE 1582N 4.40 3.55 -0.04 3.18 0.40 -0.95 -0.42 117.98 128.10 2b39 s PHE 1582Ca 0.67 0.60 0.05 0.00 -0.60 0.00 0.00 56.93 57.65 2b39 s PHE 1582Cb -0.26 -2.15 -0.01 0.00 0.51 0.00 0.00 43.02 41.11 2b39 s PHE 1582CO 0.26 0.51 -0.18 0.42 0.70 0.00 0.00 175.22 176.92 2b39 s ILE 1583N -0.40 1.51 -0.17 0.64 -1.09 0.13 -1.45 121.20 120.37 2b39 s ILE 1583Ca 0.16 -0.77 -0.16 0.00 -2.23 0.00 0.00 60.65 57.65 2b39 s ILE 1583Cb -0.13 -1.28 0.04 0.00 -1.58 0.00 0.00 42.46 39.51 2b39 s ILE 1583CO 0.05 0.43 0.45 -0.55 -1.23 0.00 0.00 174.94 174.08 2b39 s SER 1584N -0.10 -0.46 1.05 3.58 0.15 -1.16 -0.04 113.70 116.72 2b39 s SER 1584Ca -0.01 0.89 -0.15 0.00 0.70 0.00 0.00 55.95 57.38 2b39 s SER 1584Cb -0.11 0.91 0.12 0.00 -1.71 0.00 0.00 66.02 65.22 2b39 s SER 1584CO 0.02 -0.16 0.44 1.57 1.20 0.00 0.00 173.24 176.30 2b39 n HIS 1585N 2.81 -1.15 0.08 3.44 -0.00 -1.26 -1.38 115.22 117.76 2b39 n HIS 1585Ca -0.13 0.15 0.03 0.00 0.46 0.00 0.00 57.72 58.23 2b39 n HIS 1585Cb 0.57 -1.71 0.42 0.00 -0.12 0.00 0.00 29.99 29.14 2b39 n HIS 1585CO 0.00 0.00 0.00 0.82 0.46 0.00 0.00 176.34 177.62 2b39 h ILE 1586N -1.97 1.14 -0.89 3.57 2.04 -1.88 -2.42 117.51 117.09 2b39 h ILE 1586Ca -0.50 -0.51 0.20 0.00 1.00 0.00 0.00 64.86 65.05 2b39 h ILE 1586Cb 1.32 0.94 -0.12 0.00 -0.74 0.00 0.00 36.82 38.22 2b39 h ILE 1586CO 0.39 0.18 0.41 0.07 0.00 0.00 0.00 178.15 179.20 2b39 h LYS 1587N 0.33 0.45 -0.91 2.37 2.10 -1.89 0.11 116.57 119.14 2b39 h LYS 1587Ca 0.08 -0.03 -0.14 0.00 -2.00 0.00 0.00 60.65 58.56 2b39 h LYS 1587Cb 0.20 -0.10 -0.08 0.00 -0.90 0.00 0.00 32.23 31.34 2b39 h LYS 1587CO 0.00 0.30 0.18 0.00 -2.00 0.00 0.00 179.45 177.93 2b39 h ARG 1589N 1.16 0.03 0.00 0.00 2.43 -0.87 -3.28 114.38 113.86 2b39 h ARG 1589Ca 0.17 -0.05 -0.00 0.00 -0.81 0.00 0.00 59.98 59.29 2b39 h ARG 1589Cb 1.62 0.02 -0.00 0.00 -0.42 0.00 0.00 29.97 31.19 2b39 h ARG 1589CO 0.41 1.02 -0.02 0.93 -1.51 0.00 0.00 179.97 180.81 2b39 h GLU 1590N 0.01 0.00 0.00 0.20 4.39 -1.76 -1.40 114.58 116.02 2b39 h GLU 1590Ca -0.02 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.68 2b39 h GLU 1590Cb 1.78 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 30.43 2b39 h GLU 1590CO 0.14 0.16 0.00 0.00 -1.16 0.00 0.00 179.01 178.15 2b39 n ALA 1591N -2.77 1.74 0.02 3.43 0.00 -1.26 -2.45 120.51 119.21 2b39 n ALA 1591Ca -0.02 -0.01 -0.02 0.00 0.00 0.00 0.00 53.44 53.39 2b39 n ALA 1591Cb 0.08 -1.04 -0.01 0.00 0.00 0.00 0.00 19.45 18.49 2b39 n ALA 1591CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 2b39 n LEU 1592N -0.65 0.92 -4.20 0.00 7.94 -1.24 -5.04 117.00 114.74 2b39 n LEU 1592Ca 0.02 0.13 -0.32 0.00 -1.11 0.00 0.00 56.01 54.72 2b39 n LEU 1592Cb 0.01 -0.30 -0.06 0.00 0.53 0.00 0.00 43.42 43.59 2b39 n LEU 1592CO 0.01 -0.47 -0.38 0.29 -1.11 0.00 0.00 177.39 175.74 2b39 n LYS 1593N -3.48 -1.26 -1.44 1.96 5.02 -0.53 -4.93 118.16 113.51 2b39 n LYS 1593Ca -0.03 0.15 -0.30 0.00 -2.02 0.00 0.00 58.31 56.11 2b39 n LYS 1593Cb 0.21 -3.60 0.09 0.00 -0.02 0.00 0.00 35.03 31.71 2b39 n LYS 1593CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2b39 s LEU 1594N -7.30 2.70 0.01 -0.35 1.43 -1.26 -5.07 118.68 108.84 2b39 s LEU 1594Ca 0.09 1.49 0.05 0.00 -1.03 0.00 0.00 54.13 54.73 2b39 s LEU 1594Cb -0.05 -4.13 -0.03 0.00 0.03 0.00 0.00 46.19 42.02 2b39 s LEU 1594CO 0.97 -2.01 -0.14 -0.54 0.23 0.00 0.00 176.35 174.86 2b39 s LYS 1595N -5.05 2.30 0.00 1.70 -0.14 -1.26 -5.01 119.74 112.28 2b39 s LYS 1595Ca 0.61 -0.84 -0.02 0.00 -1.36 0.00 0.00 55.97 54.36 2b39 s LYS 1595Cb -0.15 -2.31 -0.07 0.00 -1.68 0.00 0.00 37.83 33.61 2b39 s LYS 1595CO 0.55 0.58 2.14 -0.85 -0.76 0.00 0.00 175.35 177.01 2b39 n GLU 1596N 1.75 1.11 0.00 1.68 0.28 -1.26 -3.86 120.64 120.33 2b39 n GLU 1596Ca -0.16 -0.26 0.00 0.00 -0.16 0.00 0.00 57.16 56.58 2b39 n GLU 1596Cb 0.52 -1.33 0.00 0.00 1.43 0.00 0.00 31.44 32.06 2b39 n GLU 1596CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 2b39 n GLY 1597N 1.88 -1.95 3.52 -1.84 0.00 -1.16 -4.63 105.19 101.00 2b39 n GLY 1597Ca 0.11 0.91 -0.08 0.00 0.00 0.00 0.00 46.02 46.96 2b39 n GLY 1597CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2b39 s ALA 1598N 0.00 -1.85 -0.06 4.61 0.00 -1.25 -5.00 121.76 118.21 2b39 s ALA 1598Ca 0.00 1.13 -0.05 0.00 0.00 0.00 0.00 51.96 53.04 2b39 s ALA 1598Cb 0.00 0.24 -0.04 0.00 0.00 0.00 0.00 23.12 23.32 2b39 s ALA 1598CO 0.00 -0.63 0.16 -1.01 0.00 0.00 0.00 175.76 174.27 2b39 s HIS 1599N -2.82 3.56 0.00 0.00 3.76 -1.26 -1.49 115.29 117.05 2b39 s HIS 1599Ca 0.04 0.43 0.01 0.00 -0.15 0.00 0.00 55.06 55.39 2b39 s HIS 1599Cb -0.01 -1.88 -0.00 0.00 1.11 0.00 0.00 32.58 31.80 2b39 s HIS 1599CO -0.07 0.68 -0.03 0.71 -0.85 0.00 0.00 174.74 175.18 2b39 s TYR 1600N -1.18 0.31 -0.12 1.40 1.51 0.27 -1.33 117.35 118.21 2b39 s TYR 1600Ca 0.21 -0.09 -0.25 0.00 -1.01 0.00 0.00 57.07 55.93 2b39 s TYR 1600Cb -0.12 -0.20 -0.02 0.00 -0.11 0.00 0.00 41.96 41.50 2b39 s TYR 1600CO 0.12 -0.01 0.80 -1.17 -1.11 0.00 0.00 175.55 174.18 2b39 s LEU 1601N -0.18 4.24 -0.01 -1.29 1.98 0.12 -3.08 118.68 120.45 2b39 s LEU 1601Ca 0.00 1.23 0.08 0.00 -2.89 0.00 0.00 54.13 52.55 2b39 s LEU 1601Cb -0.02 -3.22 -0.02 0.00 0.66 0.00 0.00 46.19 43.59 2b39 s LEU 1601CO -0.00 -0.29 -0.25 0.68 -1.89 0.00 0.00 176.35 174.60 2b39 s VAL 1602N 1.60 1.97 -0.30 1.68 -7.23 -0.75 -1.21 120.40 116.16 2b39 s VAL 1602Ca 0.39 -1.11 -0.12 0.00 -1.81 0.00 0.00 61.98 59.33 2b39 s VAL 1602Cb -0.17 -1.65 0.14 0.00 0.56 0.00 0.00 36.38 35.26 2b39 s VAL 1602CO 0.16 0.51 0.76 -1.66 -0.31 0.00 0.00 175.10 174.56 2b39 s TRP 1603N -0.62 -1.13 0.35 2.82 -2.14 -1.24 -2.26 118.94 114.73 2b39 s TRP 1603Ca 0.10 1.96 -0.14 0.00 2.66 0.00 0.00 56.10 60.68 2b39 s TRP 1603Cb -0.10 0.68 0.06 0.00 -3.10 0.00 0.00 33.47 31.01 2b39 s TRP 1603CO -0.00 -0.56 0.73 0.41 -2.66 0.00 0.00 176.95 174.87 2b39 n GLY 1604N 5.28 1.05 3.32 3.67 0.00 -1.16 -2.95 105.19 114.40 2b39 n GLY 1604Ca -0.11 -1.23 -0.31 0.00 0.00 0.00 0.00 46.02 44.37 2b39 n GLY 1604CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2b39 s VAL 1605N -2.17 1.17 -0.11 1.61 1.01 -1.26 -2.25 120.40 118.40 2b39 s VAL 1605Ca 0.15 0.00 0.21 0.00 0.00 0.00 0.00 61.98 62.34 2b39 s VAL 1605Cb -0.04 -2.12 -0.22 0.00 0.00 0.00 0.00 36.38 33.99 2b39 s VAL 1605CO 0.11 0.00 0.62 -0.24 0.00 0.00 0.00 175.10 175.58 2b39 n SER 1606N -5.61 0.31 0.24 3.32 2.88 -1.26 -3.99 113.62 109.51 2b39 n SER 1606Ca 0.14 0.12 0.11 0.00 -1.33 0.00 0.00 58.87 57.91 2b39 n SER 1606Cb 0.60 1.31 0.60 0.00 -0.75 0.00 0.00 64.21 65.97 2b39 n SER 1606CO 0.00 0.00 0.00 0.77 -1.23 0.00 0.00 175.04 174.58 2b39 h SER 1607N 0.00 0.00 0.00 -3.46 4.64 -1.95 -2.02 113.55 110.76 2b39 h SER 1607Ca -0.07 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.25 2b39 h SER 1607Cb 1.19 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.28 2b39 h SER 1607CO 0.01 0.19 0.00 0.47 -0.87 0.00 0.00 176.83 176.63 2b39 n ASP 1608N -3.60 0.00 -4.82 4.97 9.92 -1.26 -4.66 116.55 117.09 2b39 n ASP 1608Ca -0.01 -0.75 -0.37 0.00 -0.53 0.00 0.00 54.79 53.13 2b39 n ASP 1608Cb 0.32 0.00 -0.06 0.00 -0.64 0.00 0.00 41.12 40.74 2b39 n ASP 1608CO 0.00 0.00 0.00 -0.76 0.13 0.00 0.00 177.20 176.57 2b39 s LEU 1609N -1.25 4.37 0.00 0.64 1.02 -0.76 -0.15 118.68 122.54 2b39 s LEU 1609Ca 0.05 0.59 0.00 0.00 0.02 0.00 0.00 54.13 54.79 2b39 s LEU 1609Cb 0.02 -2.27 0.00 0.00 0.02 0.00 0.00 46.19 43.96 2b39 s LEU 1609CO 0.04 0.30 0.00 1.87 0.02 0.00 0.00 176.35 178.58 2b39 n TRP 1610N 2.39 0.00 -4.51 0.29 -0.00 -0.06 -4.91 117.44 110.64 2b39 n TRP 1610Ca -0.16 0.00 0.00 0.00 -0.00 0.00 0.00 57.50 57.34 2b39 n TRP 1610Cb 0.53 0.00 0.00 0.00 -0.00 0.00 0.00 31.31 31.84 2b39 n TRP 1610CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 177.69 178.10 2b39 n GLY 1611N 2.53 0.06 3.46 5.87 0.00 -1.26 -0.76 105.19 115.09 2b39 n GLY 1611Ca 0.00 -0.95 -0.10 0.00 0.00 0.00 0.00 46.02 44.97 2b39 n GLY 1611CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2b39 n GLU 1612N 0.00 0.98 0.00 1.61 4.07 -0.71 -4.84 120.64 121.75 2b39 n GLU 1612Ca 0.00 -2.23 0.00 0.00 -0.06 0.00 0.00 57.16 54.87 2b39 n GLU 1612Cb 0.00 2.61 0.00 0.00 -0.06 0.00 0.00 31.44 33.99 2b39 n GLU 1612CO 0.00 0.00 0.00 1.17 -0.06 0.00 0.00 177.13 178.24 2b39 n LYS 1613N -0.51 0.00 0.00 5.31 4.81 -1.26 -2.05 118.16 124.46 2b39 n LYS 1613Ca -0.06 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.38 2b39 n LYS 1613Cb 0.56 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.61 2b39 n LYS 1613CO 0.00 0.00 0.00 -0.35 1.17 0.00 0.00 177.40 178.22 2b39 n PRO 1614N -1.81 0.00 -4.22 1.64 -0.04 -1.26 -4.78 135.00 124.53 2b39 n PRO 1614Ca 0.00 0.47 -0.34 0.00 -0.04 0.00 0.00 63.50 63.59 2b39 n PRO 1614Cb 0.00 -1.21 -0.12 0.00 -0.04 0.00 0.00 33.50 32.13 2b39 n PRO 1614CO 0.00 0.00 0.00 -1.59 -0.04 0.00 0.00 175.50 173.87 2b39 s LYS 1615N -1.89 3.71 -0.17 0.54 -2.85 -0.87 -5.05 119.74 113.16 2b39 s LYS 1615Ca 0.00 -0.49 -0.06 0.00 -1.00 0.00 0.00 55.97 54.42 2b39 s LYS 1615Cb 0.00 -3.03 -0.04 0.00 -2.06 0.00 0.00 37.83 32.71 2b39 s LYS 1615CO 0.00 0.17 0.04 0.42 0.10 0.00 0.00 175.35 176.08 2b39 s ILE 1616N 0.58 4.60 0.42 3.79 -1.09 -1.25 -1.73 121.20 126.53 2b39 s ILE 1616Ca -0.01 -0.10 -0.05 0.00 -2.23 0.00 0.00 60.65 58.26 2b39 s ILE 1616Cb -0.14 -3.05 -0.04 0.00 -1.58 0.00 0.00 42.46 37.65 2b39 s ILE 1616CO 0.02 0.48 0.71 -0.44 -1.23 0.00 0.00 174.94 174.49 2b39 s SER 1617N 0.22 6.33 -0.41 3.58 0.01 0.06 -4.46 113.70 119.03 2b39 s SER 1617Ca 0.03 0.85 0.04 0.00 1.31 0.00 0.00 55.95 58.17 2b39 s SER 1617Cb -0.13 -2.21 0.11 0.00 0.21 0.00 0.00 66.02 64.01 2b39 s SER 1617CO 0.01 -0.46 0.14 -0.31 0.41 0.00 0.00 173.24 173.03 2b39 s TYR 1618N -2.54 3.39 -0.57 2.43 2.02 0.44 -0.88 117.35 121.64 2b39 s TYR 1618Ca 0.46 -3.00 -0.28 0.00 -0.37 0.00 0.00 57.07 53.89 2b39 s TYR 1618Cb -0.10 -2.80 0.00 0.00 -0.40 0.00 0.00 41.96 38.67 2b39 s TYR 1618CO 0.40 -0.86 1.53 0.42 -1.57 0.00 0.00 175.55 175.47 2b39 s ILE 1619N 0.46 3.66 -0.75 2.71 1.01 0.79 0.23 121.20 129.30 2b39 s ILE 1619Ca 0.13 0.53 -0.26 0.00 0.00 0.00 0.00 60.65 61.06 2b39 s ILE 1619Cb -0.22 -4.30 -0.08 0.00 0.01 0.00 0.00 42.46 37.87 2b39 s ILE 1619CO -0.05 -1.11 2.17 -0.63 0.00 0.00 0.00 174.94 175.32 2b39 s ILE 1620N 6.75 3.21 0.28 2.92 1.01 0.95 -4.70 121.20 131.61 2b39 s ILE 1620Ca 0.56 -0.09 -0.03 0.00 0.00 0.00 0.00 60.65 61.09 2b39 s ILE 1620Cb -0.12 -3.49 0.06 0.00 0.01 0.00 0.00 42.46 38.92 2b39 s ILE 1620CO 0.24 -0.47 0.38 0.61 0.00 0.00 0.00 174.94 175.70 2b39 n GLY 1621N 6.52 -0.37 0.21 6.18 0.00 -1.26 -4.81 105.19 111.66 2b39 n GLY 1621Ca 0.39 -1.82 -0.05 0.00 0.00 0.00 0.00 46.02 44.54 2b39 n GLY 1621CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 2b39 h LYS 1622N 0.00 0.40 -0.00 1.61 2.10 -1.69 -2.72 116.57 116.26 2b39 h LYS 1622Ca -0.12 -0.22 0.00 0.00 -2.00 0.00 0.00 60.65 58.31 2b39 h LYS 1622Cb 0.38 0.01 0.00 0.00 -0.90 0.00 0.00 32.23 31.72 2b39 h LYS 1622CO 0.10 0.78 -0.22 -0.25 -2.00 0.00 0.00 179.45 177.87 2b39 n ASP 1623N -3.99 0.52 -4.83 7.07 9.92 -1.26 -4.49 116.55 119.49 2b39 n ASP 1623Ca -0.02 -0.41 -0.38 0.00 -0.53 0.00 0.00 54.79 53.45 2b39 n ASP 1623Cb 0.53 -0.02 -0.06 0.00 -0.64 0.00 0.00 41.12 40.93 2b39 n ASP 1623CO 0.00 0.00 0.00 -0.89 0.13 0.00 0.00 177.20 176.44 2b39 s THR 1624N -2.68 4.97 -0.00 -3.53 2.01 -1.03 -4.62 115.64 110.75 2b39 s THR 1624Ca 0.22 0.92 0.00 0.00 0.31 0.00 0.00 61.69 63.14 2b39 s THR 1624Cb 0.19 -3.75 0.01 0.00 0.01 0.00 0.00 72.50 68.96 2b39 s THR 1624CO 0.54 0.57 0.01 0.26 -0.69 0.00 0.00 174.62 175.31 2b39 s TRP 1625N -1.09 0.02 -0.22 4.92 0.52 -1.15 -4.40 118.94 117.54 2b39 s TRP 1625Ca 0.25 0.03 -0.07 0.00 0.02 0.00 0.00 56.10 56.33 2b39 s TRP 1625Cb -0.17 -0.06 -0.03 0.00 -1.15 0.00 0.00 33.47 32.05 2b39 s TRP 1625CO 0.15 -0.02 0.05 0.08 0.02 0.00 0.00 176.95 177.22 2b39 s VAL 1626N 0.24 4.29 -0.57 4.03 1.01 -1.26 -3.63 120.40 124.52 2b39 s VAL 1626Ca -0.02 -0.19 -0.12 0.00 0.00 0.00 0.00 61.98 61.65 2b39 s VAL 1626Cb -0.03 -2.97 0.14 0.00 0.00 0.00 0.00 36.38 33.52 2b39 s VAL 1626CO -0.01 0.39 0.48 -1.61 0.00 0.00 0.00 175.10 174.35 2b39 s GLU 1627N 1.15 2.84 -0.84 2.72 0.41 -0.35 -4.95 118.70 119.69 2b39 s GLU 1627Ca 0.04 -1.94 -0.23 0.00 -0.41 0.00 0.00 54.97 52.43 2b39 s GLU 1627Cb -0.14 -4.11 -0.18 0.00 -1.78 0.00 0.00 34.13 27.92 2b39 s GLU 1627CO 0.03 -1.25 2.32 1.28 -0.49 0.00 0.00 175.26 177.14 2b39 n LEU 1628N 4.72 1.16 -4.74 1.80 4.32 -1.26 0.10 117.00 123.11 2b39 n LEU 1628Ca -0.05 -1.44 -0.42 0.00 -0.02 0.00 0.00 56.01 54.08 2b39 n LEU 1628Cb 0.41 -1.47 -0.02 0.00 -1.62 0.00 0.00 43.42 40.72 2b39 n LEU 1628CO 0.44 -2.54 1.31 1.87 -1.22 0.00 0.00 177.39 177.25 2b39 n TRP 1629N 16.52 2.83 -0.21 -1.77 -0.00 -0.44 -4.92 117.44 129.44 2b39 n TRP 1629Ca 0.49 0.16 -0.17 0.00 -0.00 0.00 0.00 57.50 57.98 2b39 n TRP 1629Cb 0.39 -2.64 0.16 0.00 -0.00 0.00 0.00 31.31 29.22 2b39 n TRP 1629CO 0.00 0.00 0.00 -2.30 -0.00 0.00 0.00 177.69 175.39 2b39 n PRO 1630N 2.94 -3.41 -3.75 5.87 -0.02 -1.26 -4.11 135.00 131.25 2b39 n PRO 1630Ca 0.12 -0.81 -0.24 0.00 -2.02 0.00 0.00 63.50 60.54 2b39 n PRO 1630Cb 0.36 -1.02 -0.02 0.00 -0.02 0.00 0.00 33.50 32.80 2b39 n PRO 1630CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 2b39 n GLU 1631N -3.99 0.87 0.00 -0.52 -0.58 -1.26 -4.60 120.64 110.56 2b39 n GLU 1631Ca 0.08 -2.95 0.00 0.00 -0.42 0.00 0.00 57.16 53.86 2b39 n GLU 1631Cb 0.33 0.51 0.00 0.00 -0.57 0.00 0.00 31.44 31.71 2b39 n GLU 1631CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2b39 n ALA 1632N -1.89 0.00 -0.31 0.62 0.00 -1.26 -3.20 120.51 114.46 2b39 n ALA 1632Ca -0.16 0.00 0.15 0.00 0.00 0.00 0.00 53.44 53.43 2b39 n ALA 1632Cb 0.53 0.00 0.31 0.00 0.00 0.00 0.00 19.45 20.29 2b39 n ALA 1632CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 177.50 178.55 2b39 h GLU 1633N 0.00 0.14 0.00 0.00 4.11 -2.05 -1.37 114.58 115.41 2b39 h GLU 1633Ca 0.00 -0.01 0.00 0.00 0.07 0.00 0.00 59.36 59.42 2b39 h GLU 1633Cb 0.00 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.22 2b39 h GLU 1633CO 0.00 0.09 0.00 0.93 0.07 0.00 0.00 179.01 180.10 2b39 h GLU 1634N 0.15 0.00 0.00 1.06 5.08 -2.02 -3.12 114.58 115.73 2b39 h GLU 1634Ca 0.58 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.93 2b39 h GLU 1634Cb 1.22 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.47 2b39 h GLU 1634CO -0.72 0.00 -0.04 0.00 -1.00 0.00 0.00 179.01 177.25 2b39 h GLN 1636N 0.00 0.00 -6.39 0.00 4.20 -1.73 -3.12 115.11 108.07 2b39 h GLN 1636Ca -0.00 0.00 -0.52 0.00 0.06 0.00 0.00 58.65 58.19 2b39 h GLN 1636Cb 0.11 0.00 0.23 0.00 0.30 0.00 0.00 27.48 28.13 2b39 h GLN 1636CO 0.01 0.22 -1.41 -0.25 -0.67 0.00 0.00 178.83 176.72 2b39 n ASP 1637N -4.14 -3.61 -0.03 1.46 8.00 -0.99 -4.57 116.55 112.67 2b39 n ASP 1637Ca -0.02 0.16 -0.05 0.00 0.71 0.00 0.00 54.79 55.58 2b39 n ASP 1637Cb 0.28 -0.91 0.16 0.00 -0.02 0.00 0.00 41.12 40.63 2b39 n ASP 1637CO 0.00 0.00 0.00 -0.33 -0.39 0.00 0.00 177.20 176.48 2b39 h GLU 1638N -1.38 0.62 0.65 -1.24 5.08 -1.90 0.48 114.58 116.89 2b39 h GLU 1638Ca -0.45 -0.23 -0.03 0.00 -1.00 0.00 0.00 59.36 57.65 2b39 h GLU 1638Cb 1.32 -0.04 0.01 0.00 0.50 0.00 0.00 28.75 30.54 2b39 h GLU 1638CO 0.29 0.79 -0.31 0.93 -1.00 0.00 0.00 179.01 179.71 2b39 h GLU 1639N 0.55 -0.84 0.00 2.33 5.08 -1.93 -3.21 114.58 116.56 2b39 h GLU 1639Ca 0.08 0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.50 2b39 h GLU 1639Cb 0.67 0.19 0.00 0.00 0.50 0.00 0.00 28.75 30.11 2b39 h GLU 1639CO 0.05 -0.53 0.00 -0.91 -1.00 0.00 0.00 179.01 176.62 2b39 h ASN 1640N -0.99 0.00 -0.12 1.42 4.21 -1.78 -3.29 115.58 115.04 2b39 h ASN 1640Ca -0.09 0.00 0.03 0.00 1.21 0.00 0.00 56.30 57.45 2b39 h ASN 1640Cb 0.70 0.00 -0.00 0.00 -1.12 0.00 0.00 38.32 37.90 2b39 h ASN 1640CO 0.15 0.00 0.39 -0.61 -1.29 0.00 0.00 177.43 176.07 2b39 h GLN 1641N 0.00 0.00 0.01 0.81 5.75 -0.83 -1.33 115.11 119.53 2b39 h GLN 1641Ca 0.00 0.00 -0.20 0.00 -0.15 0.00 0.00 58.65 58.30 2b39 h GLN 1641Cb 0.64 0.00 -0.03 0.00 1.07 0.00 0.00 27.48 29.16 2b39 h GLN 1641CO 0.00 0.00 -1.10 0.87 -2.65 0.00 0.00 178.83 175.95 2b39 h LYS 1642N 0.00 0.03 0.00 1.69 1.57 -1.75 -3.38 116.57 114.73 2b39 h LYS 1642Ca 0.06 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2b39 h LYS 1642Cb 0.84 0.02 0.00 0.00 0.08 0.00 0.00 32.23 33.17 2b39 h LYS 1642CO -0.00 1.03 0.00 0.94 -0.57 0.00 0.00 179.45 180.85 2b39 n GLN 1643N -4.38 0.00 0.21 3.15 7.27 -0.52 -2.09 117.38 121.01 2b39 n GLN 1643Ca -0.28 0.11 0.15 0.00 0.07 0.00 0.00 57.00 57.06 2b39 n GLN 1643Cb 0.68 -0.96 0.60 0.00 2.41 0.00 0.00 30.24 32.97 2b39 n GLN 1643CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 2b39 h GLU 1645N 0.00 -0.27 -0.24 0.00 4.57 -1.73 -1.96 114.58 114.94 2b39 h GLU 1645Ca 0.11 0.02 -0.02 0.00 -1.18 0.00 0.00 59.36 58.29 2b39 h GLU 1645Cb 1.30 0.06 -0.01 0.00 -0.16 0.00 0.00 28.75 29.94 2b39 h GLU 1645CO -0.00 0.09 0.07 -0.44 -1.18 0.00 0.00 179.01 177.55 2b39 h ASP 1646N -0.91 0.30 1.07 1.04 3.45 0.44 -2.92 116.42 118.88 2b39 h ASP 1646Ca -0.03 -0.03 -0.20 0.00 0.43 0.00 0.00 57.03 57.21 2b39 h ASP 1646Cb 0.50 -0.08 -0.03 0.00 -0.56 0.00 0.00 39.33 39.16 2b39 h ASP 1646CO 0.05 0.31 -0.94 -0.07 -1.57 0.00 0.00 179.24 177.02 2b39 h LEU 1647N 0.34 0.00 0.00 1.55 3.38 -0.68 -3.19 115.31 116.71 2b39 h LEU 1647Ca 0.08 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.05 2b39 h LEU 1647Cb 0.12 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.87 2b39 h LEU 1647CO -0.00 0.92 0.00 0.00 0.09 0.00 0.00 178.44 179.45 2b39 n ALA 1648N -2.33 2.04 0.18 1.53 0.00 -0.74 -1.22 120.51 119.97 2b39 n ALA 1648Ca 0.00 -0.10 0.11 0.00 0.00 0.00 0.00 53.44 53.46 2b39 n ALA 1648Cb 0.91 -1.28 -0.03 0.00 0.00 0.00 0.00 19.45 19.05 2b39 n ALA 1648CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2b39 n ASN 1649N -1.13 0.58 0.06 0.00 3.02 -1.20 -3.89 115.26 112.71 2b39 n ASN 1649Ca 0.11 0.13 -0.13 0.00 -0.03 0.00 0.00 54.58 54.66 2b39 n ASN 1649Cb 0.09 0.90 -0.03 0.00 -0.61 0.00 0.00 39.78 40.14 2b39 n ASN 1649CO 0.00 0.00 0.00 -0.26 -2.62 0.00 0.00 177.26 174.38 2b39 h PHE 1650N 0.00 0.59 0.00 3.10 -1.00 -1.30 0.50 116.94 118.83 2b39 h PHE 1650Ca 0.00 -0.31 0.00 0.00 2.81 0.00 0.00 57.97 60.47 2b39 h PHE 1650Cb 0.94 -0.07 0.00 0.00 3.61 0.00 0.00 35.95 40.43 2b39 h PHE 1650CO 0.00 1.12 0.00 2.41 -1.61 0.00 0.00 178.31 180.23 2b39 n THR 1651N -3.76 0.64 0.00 -1.55 -1.04 -1.21 -2.86 114.28 104.50 2b39 n THR 1651Ca -0.06 0.16 0.00 0.00 -2.04 0.00 0.00 64.05 62.11 2b39 n THR 1651Cb 0.81 -0.89 0.00 0.00 -1.82 0.00 0.00 70.33 68.42 2b39 n THR 1651CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 2b39 n GLU 1652N -1.34 0.00 -0.28 -2.82 1.02 -0.92 -4.76 120.64 111.55 2b39 n GLU 1652Ca 0.07 0.00 0.16 0.00 -0.02 0.00 0.00 57.16 57.36 2b39 n GLU 1652Cb 0.14 -0.02 0.43 0.00 -0.02 0.00 0.00 31.44 31.97 2b39 n GLU 1652CO 0.00 0.00 0.00 -0.97 1.18 0.00 0.00 177.13 177.34 2b39 h ASN 1653N 0.00 0.57 -0.30 1.62 -0.00 -0.20 -1.26 115.58 116.01 2b39 h ASN 1653Ca 0.00 0.05 -0.15 0.00 -0.00 0.00 0.00 56.30 56.21 2b39 h ASN 1653Cb 0.00 -0.05 -0.09 0.00 -0.00 0.00 0.00 38.32 38.18 2b39 h ASN 1653CO 0.00 0.24 0.19 0.23 -0.00 0.00 0.00 177.43 178.09 2b39 n MET 1654N -4.58 1.46 0.00 6.67 2.81 -1.13 -3.06 117.12 119.29 2b39 n MET 1654Ca 0.20 -0.95 0.00 0.00 -1.81 0.00 0.00 57.70 55.14 2b39 n MET 1654Cb 0.60 -1.40 0.00 0.00 -0.71 0.00 0.00 33.22 31.71 2b39 n MET 1654CO 0.00 0.00 0.00 0.28 1.51 0.00 0.00 175.97 177.76 2b39 n VAL 1655N 0.00 0.00 -2.48 2.03 0.31 -0.47 -4.68 118.33 113.03 2b39 n VAL 1655Ca 0.18 -0.05 -0.15 0.00 -0.01 0.00 0.00 64.34 64.30 2b39 n VAL 1655Cb 0.84 0.53 0.02 0.00 -0.91 0.00 0.00 33.84 34.32 2b39 n VAL 1655CO 0.00 0.00 0.00 0.52 -1.32 0.00 0.00 176.83 176.03 2b39 n VAL 1656N -1.35 1.83 -1.64 2.52 0.31 -1.17 -5.09 118.33 113.73 2b39 n VAL 1656Ca 0.00 -3.81 -0.24 0.00 -0.01 0.00 0.00 64.34 60.28 2b39 n VAL 1656Cb 0.00 -0.15 0.18 0.00 -0.91 0.00 0.00 33.84 32.96 2b39 n VAL 1656CO 0.00 0.00 0.00 2.22 -1.32 0.00 0.00 176.83 177.73 2b39 n PHE 1657N -0.48 -3.96 -3.15 3.52 1.16 -1.22 -5.05 117.46 108.28 2b39 n PHE 1657Ca 0.26 -0.95 0.05 0.00 -1.87 0.00 0.00 57.45 54.93 2b39 n PHE 1657Cb 0.82 -0.86 -0.00 0.00 -1.61 0.00 0.00 39.48 37.82 2b39 n PHE 1657CO 0.00 0.00 0.00 0.20 -1.87 0.00 0.00 176.76 175.09 2b39 s GLY 1658N -5.21 -1.04 0.06 4.97 0.00 -1.26 -5.08 107.32 99.76 2b39 s GLY 1658Ca 0.62 1.66 0.24 0.00 0.00 0.00 0.00 44.72 47.23 2b39 s GLY 1658CO 0.44 3.81 1.74 0.00 0.00 0.00 0.00 173.10 179.09 2b39 n PRO 1660N -1.68 0.56 0.00 0.00 -0.02 -1.26 -4.98 135.00 127.62 2b39 n PRO 1660Ca 0.05 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.53 2b39 n PRO 1660Cb 0.29 -1.24 0.00 0.00 -0.02 0.00 0.00 33.50 32.53 2b39 n PRO 1660CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57