#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x88 s ILE 19 N 0.00 4.14 -0.08 2.41 -4.36 -0.26 -4.79 121.20 118.26 1x88 s ILE 19 Ca 0.00 0.82 -0.18 0.00 -0.26 0.00 0.00 60.65 61.03 1x88 s ILE 19 Cb 0.00 -3.51 -0.05 0.00 1.25 0.00 0.00 42.46 40.16 1x88 s ILE 19 CO 0.00 -0.78 0.49 -1.58 0.24 0.00 0.00 174.94 173.31 1x88 s GLN 20 N -4.67 4.28 -0.11 0.37 0.74 -0.65 -4.82 119.66 114.80 1x88 s GLN 20 Ca 0.59 0.50 0.01 0.00 0.05 0.00 0.00 55.36 56.52 1x88 s GLN 20 Cb -0.14 -3.39 0.02 0.00 1.10 0.00 0.00 33.01 30.60 1x88 s GLN 20 CO 0.47 0.28 -0.15 0.08 -0.55 0.00 0.00 175.29 175.42 1x88 s VAL 21 N 0.22 1.48 0.17 1.34 1.01 -1.26 -0.10 120.40 123.26 1x88 s VAL 21 Ca 0.27 -0.62 0.07 0.00 0.00 0.00 0.00 61.98 61.69 1x88 s VAL 21 Cb -0.16 -1.36 -0.04 0.00 0.00 0.00 0.00 36.38 34.81 1x88 s VAL 21 CO 0.12 0.44 -0.14 0.68 0.00 0.00 0.00 175.10 176.20 1x88 s VAL 22 N 1.06 1.58 -0.01 2.92 -7.23 -0.14 -1.71 120.40 116.86 1x88 s VAL 22 Ca -0.05 -2.05 0.07 0.00 -1.81 0.00 0.00 61.98 58.13 1x88 s VAL 22 Cb -0.15 -1.89 -0.02 0.00 0.56 0.00 0.00 36.38 34.89 1x88 s VAL 22 CO -0.03 -0.55 -0.22 -0.69 -0.31 0.00 0.00 175.10 173.30 1x88 s VAL 23 N -2.75 1.77 -0.07 1.32 1.01 -0.86 -0.49 120.40 120.33 1x88 s VAL 23 Ca 0.18 -0.98 0.00 0.00 0.00 0.00 0.00 61.98 61.19 1x88 s VAL 23 Cb -0.02 -1.48 0.02 0.00 0.00 0.00 0.00 36.38 34.91 1x88 s VAL 23 CO 0.05 0.49 -0.06 -0.60 0.00 0.00 0.00 175.10 174.98 1x88 s ARG 24 N -0.57 1.14 -0.08 2.72 3.52 -0.05 0.09 118.95 125.71 1x88 s ARG 24 Ca 0.09 -0.16 -0.08 0.00 -0.13 0.00 0.00 55.73 55.45 1x88 s ARG 24 Cb -0.09 -1.18 -0.04 0.00 -1.56 0.00 0.00 34.95 32.08 1x88 s ARG 24 CO -0.01 -0.16 0.20 0.00 -0.81 0.00 0.00 175.30 174.52 1x88 s ARG 26 N -1.18 3.67 0.66 0.00 1.70 -0.86 -3.31 118.95 119.63 1x88 s ARG 26 Ca 0.19 0.25 -0.09 0.00 -0.47 0.00 0.00 55.73 55.60 1x88 s ARG 26 Cb -0.13 -2.47 0.02 0.00 -0.57 0.00 0.00 34.95 31.80 1x88 s ARG 26 CO 0.08 0.00 1.01 -1.25 -1.08 0.00 0.00 175.30 174.06 1x88 s PRO 27 N -3.99 2.79 0.54 3.89 0.04 -1.25 -4.27 135.00 132.75 1x88 s PRO 27 Ca 0.48 0.19 -0.20 0.00 0.04 0.00 0.00 61.00 61.51 1x88 s PRO 27 Cb -0.10 -2.14 -0.06 0.00 0.04 0.00 0.00 34.50 32.25 1x88 s PRO 27 CO 0.34 -0.94 1.15 -0.06 0.04 0.00 0.00 177.00 177.54 1x88 s PHE 28 N -3.21 2.63 0.60 0.56 0.40 -1.26 -4.95 117.98 112.75 1x88 s PHE 28 Ca 0.57 1.53 0.01 0.00 -0.60 0.00 0.00 56.93 58.44 1x88 s PHE 28 Cb -0.11 -3.35 0.06 0.00 0.51 0.00 0.00 43.02 40.13 1x88 s PHE 28 CO 0.48 -1.73 0.84 0.54 0.70 0.00 0.00 175.22 176.05 1x88 s ASN 29 N -1.67 5.00 0.27 1.36 2.20 -1.26 -4.85 114.94 115.98 1x88 s ASN 29 Ca 0.73 -0.17 -0.00 0.00 -0.94 0.00 0.00 52.86 52.47 1x88 s ASN 29 Cb -0.26 -0.54 0.55 0.00 -2.00 0.00 0.00 41.25 39.00 1x88 s ASN 29 CO 0.29 -1.36 1.78 0.25 -2.94 0.00 0.00 177.10 175.12 1x88 h LEU 30 N -0.09 0.63 -0.47 3.54 7.12 -1.98 0.72 115.31 124.78 1x88 h LEU 30 Ca -0.40 0.08 -0.00 0.00 0.13 0.00 0.00 57.88 57.70 1x88 h LEU 30 Cb 1.29 -0.03 -0.02 0.00 -0.53 0.00 0.00 40.66 41.37 1x88 h LEU 30 CO 0.48 0.28 0.28 0.00 -0.13 0.00 0.00 178.44 179.35 1x88 h ALA 31 N 1.56 0.59 -0.11 1.25 0.00 -2.00 -1.18 119.26 119.38 1x88 h ALA 31 Ca 0.48 -0.06 -0.13 0.00 0.00 0.00 0.00 54.91 55.20 1x88 h ALA 31 Cb 0.64 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 1x88 h ALA 31 CO -0.34 0.08 -0.51 0.93 0.00 0.00 0.00 179.25 179.40 1x88 h GLU 32 N 0.62 0.29 -0.33 0.00 5.08 -1.73 -2.69 114.58 115.83 1x88 h GLU 32 Ca 0.17 -0.17 -0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1x88 h GLU 32 Cb -0.02 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.23 1x88 h GLU 32 CO -0.03 0.73 0.20 -0.09 -1.00 0.00 0.00 179.01 178.82 1x88 h ARG 33 N 0.23 0.44 -0.21 2.33 2.43 -0.37 -2.35 114.38 116.87 1x88 h ARG 33 Ca 0.01 -0.04 -0.08 0.00 -0.81 0.00 0.00 59.98 59.06 1x88 h ARG 33 Cb 0.98 -0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 30.42 1x88 h ARG 33 CO 0.08 0.33 -0.22 0.87 -1.51 0.00 0.00 179.97 179.53 1x88 h LYS 34 N 0.43 0.39 0.00 0.20 1.57 -1.15 -2.22 116.57 115.79 1x88 h LYS 34 Ca 0.12 -0.13 0.00 0.00 -1.87 0.00 0.00 60.65 58.77 1x88 h LYS 34 Cb 0.00 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.28 1x88 h LYS 34 CO -0.02 0.59 0.00 0.00 -0.57 0.00 0.00 179.45 179.45 1x88 n ALA 35 N -2.48 2.30 -3.94 3.86 0.00 -0.98 -4.84 120.51 114.42 1x88 n ALA 35 Ca -0.00 -0.04 -0.29 0.00 0.00 0.00 0.00 53.44 53.11 1x88 n ALA 35 Cb 0.37 -1.10 0.01 0.00 0.00 0.00 0.00 19.45 18.72 1x88 n ALA 35 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1x88 n SER 36 N -0.63 -2.77 -4.77 0.00 7.64 -0.83 -4.91 113.62 107.35 1x88 n SER 36 Ca 0.05 -0.88 -0.38 0.00 1.01 0.00 0.00 58.87 58.66 1x88 n SER 36 Cb 0.02 -3.51 -0.02 0.00 -1.01 0.00 0.00 64.21 59.69 1x88 n SER 36 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1x88 s ALA 37 N -3.52 3.10 -0.11 -0.43 0.00 -0.92 -5.04 121.76 114.84 1x88 s ALA 37 Ca 0.40 0.92 0.01 0.00 0.00 0.00 0.00 51.96 53.29 1x88 s ALA 37 Cb -0.21 -3.37 -0.02 0.00 0.00 0.00 0.00 23.12 19.53 1x88 s ALA 37 CO 0.86 -0.51 -0.14 -1.01 0.00 0.00 0.00 175.76 174.95 1x88 s HIS 38 N -1.48 2.76 0.30 0.00 3.76 -1.26 -4.95 115.29 114.43 1x88 s HIS 38 Ca 0.59 -0.61 -0.29 0.00 -0.15 0.00 0.00 55.06 54.60 1x88 s HIS 38 Cb -0.29 -1.79 -0.10 0.00 1.11 0.00 0.00 32.58 31.50 1x88 s HIS 38 CO 0.36 -0.17 1.38 0.45 -0.85 0.00 0.00 174.74 175.91 1x88 s SER 39 N 0.17 6.68 0.00 1.40 0.15 -1.26 -4.65 113.70 116.19 1x88 s SER 39 Ca -0.08 2.72 0.20 0.00 0.70 0.00 0.00 55.95 59.49 1x88 s SER 39 Cb -0.15 -2.64 0.40 0.00 -1.71 0.00 0.00 66.02 61.92 1x88 s SER 39 CO 0.05 -0.64 1.34 2.30 1.20 0.00 0.00 173.24 177.49 1x88 n ILE 40 N 1.40 0.60 -4.87 6.45 -5.35 -0.50 -4.91 119.36 112.17 1x88 n ILE 40 Ca 0.03 -0.80 -0.33 0.00 -0.27 0.00 0.00 62.75 61.38 1x88 n ILE 40 Cb 0.41 0.87 -0.14 0.00 -1.74 0.00 0.00 39.64 39.04 1x88 n ILE 40 CO 0.00 0.00 0.00 -0.69 -1.76 0.00 0.00 176.55 174.10 1x88 s VAL 41 N -1.28 2.95 -0.11 7.28 1.01 -1.26 -0.77 120.40 128.22 1x88 s VAL 41 Ca 0.35 -0.73 0.01 0.00 0.00 0.00 0.00 61.98 61.61 1x88 s VAL 41 Cb 0.20 -2.19 0.02 0.00 0.00 0.00 0.00 36.38 34.41 1x88 s VAL 41 CO 0.28 0.55 -0.11 -0.70 0.00 0.00 0.00 175.10 175.12 1x88 s GLU 42 N -0.08 1.78 -0.17 2.72 2.12 0.29 -4.98 118.70 120.37 1x88 s GLU 42 Ca -0.03 -0.38 -0.03 0.00 0.36 0.00 0.00 54.97 54.90 1x88 s GLU 42 Cb -0.14 -1.66 -0.02 0.00 0.26 0.00 0.00 34.13 32.58 1x88 s GLU 42 CO 0.04 -0.16 -0.07 0.00 -0.54 0.00 0.00 175.26 174.53 1x88 s ASP 44 N 0.78 5.06 0.50 0.00 -1.08 -0.44 -4.87 116.67 116.62 1x88 s ASP 44 Ca -0.02 -2.20 0.14 0.00 -0.52 0.00 0.00 52.55 49.95 1x88 s ASP 44 Cb -0.15 -1.76 1.18 0.00 -1.46 0.00 0.00 42.92 40.73 1x88 s ASP 44 CO 0.02 -0.46 2.13 1.55 0.52 0.00 0.00 175.17 178.92 1x88 h PRO 45 N 7.74 0.10 0.05 4.34 0.13 -1.84 1.13 132.00 143.65 1x88 h PRO 45 Ca -0.09 -0.01 -0.00 0.00 -0.87 0.00 0.00 66.00 65.03 1x88 h PRO 45 Cb 1.02 -0.02 0.00 0.00 0.13 0.00 0.00 31.00 32.13 1x88 h PRO 45 CO 0.65 0.08 -0.02 0.28 -0.23 0.00 0.00 178.00 178.75 1x88 h VAL 46 N 0.10 1.21 -0.00 1.56 2.07 -1.94 -3.05 116.25 116.20 1x88 h VAL 46 Ca 0.03 -0.89 0.00 0.00 0.82 0.00 0.00 66.70 66.66 1x88 h VAL 46 Cb 0.00 1.79 0.00 0.00 -1.52 0.00 0.00 31.29 31.56 1x88 h VAL 46 CO -0.01 0.22 -0.25 0.54 0.02 0.00 0.00 177.57 178.10 1x88 n ARG 47 N -4.93 0.06 -3.69 1.57 1.74 -1.07 -4.93 116.66 105.40 1x88 n ARG 47 Ca -0.08 -0.02 -0.24 0.00 -0.77 0.00 0.00 57.85 56.74 1x88 n ARG 47 Cb 0.22 -1.50 0.05 0.00 -1.02 0.00 0.00 32.46 30.21 1x88 n ARG 47 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 1x88 n LYS 48 N -1.45 -6.14 -4.44 5.56 5.02 0.38 -4.83 118.16 112.25 1x88 n LYS 48 Ca 0.07 0.71 -0.26 0.00 -2.02 0.00 0.00 58.31 56.81 1x88 n LYS 48 Cb 0.33 -5.57 -0.11 0.00 -0.02 0.00 0.00 35.03 29.67 1x88 n LYS 48 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 1x88 s GLU 49 N -6.13 1.57 -0.13 1.97 2.02 -0.77 -0.87 118.70 116.35 1x88 s GLU 49 Ca 0.33 -1.61 0.00 0.00 0.02 0.00 0.00 54.97 53.72 1x88 s GLU 49 Cb -0.16 -1.80 0.02 0.00 0.10 0.00 0.00 34.13 32.29 1x88 s GLU 49 CO 0.78 0.37 -0.13 0.08 0.02 0.00 0.00 175.26 176.38 1x88 s VAL 50 N -1.98 1.46 -0.12 2.63 1.01 0.76 -1.33 120.40 122.83 1x88 s VAL 50 Ca 0.24 -0.57 0.01 0.00 0.00 0.00 0.00 61.98 61.66 1x88 s VAL 50 Cb -0.07 -1.38 -0.01 0.00 0.00 0.00 0.00 36.38 34.92 1x88 s VAL 50 CO 0.12 0.44 -0.17 -0.55 0.00 0.00 0.00 175.10 174.93 1x88 s SER 51 N 1.42 3.67 -0.10 3.32 0.15 0.29 -1.00 113.70 121.45 1x88 s SER 51 Ca 0.03 -0.41 0.03 0.00 0.70 0.00 0.00 55.95 56.30 1x88 s SER 51 Cb -0.13 -1.53 -0.01 0.00 -1.71 0.00 0.00 66.02 62.64 1x88 s SER 51 CO -0.08 0.16 -0.22 -0.69 1.20 0.00 0.00 173.24 173.62 1x88 s VAL 52 N 0.34 2.30 -0.36 4.45 1.01 0.32 -0.55 120.40 127.90 1x88 s VAL 52 Ca -0.14 -0.94 -0.29 0.00 0.00 0.00 0.00 61.98 60.61 1x88 s VAL 52 Cb -0.17 -1.89 0.02 0.00 0.00 0.00 0.00 36.38 34.34 1x88 s VAL 52 CO 0.07 0.55 1.15 -0.60 0.00 0.00 0.00 175.10 176.27 1x88 s ARG 53 N 0.25 3.93 0.02 2.72 3.52 0.05 -1.13 118.95 128.31 1x88 s ARG 53 Ca -0.14 0.96 0.22 0.00 -0.13 0.00 0.00 55.73 56.64 1x88 s ARG 53 Cb -0.17 -3.82 -0.13 0.00 -1.56 0.00 0.00 34.95 29.27 1x88 s ARG 53 CO 0.07 -1.10 0.83 0.25 -0.81 0.00 0.00 175.30 174.55 1x88 n THR 54 N 6.25 0.10 -3.40 4.11 -2.24 -0.82 -4.96 114.28 113.33 1x88 n THR 54 Ca 0.13 -0.28 0.00 0.00 -2.27 0.00 0.00 64.05 61.62 1x88 n THR 54 Cb 0.48 0.29 0.00 0.00 -2.10 0.00 0.00 70.33 69.00 1x88 n THR 54 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1x88 n GLY 55 N 1.35 0.69 0.00 3.38 0.00 -1.20 -4.98 105.19 104.43 1x88 n GLY 55 Ca 0.00 -0.70 0.00 0.00 0.00 0.00 0.00 46.02 45.32 1x88 n GLY 55 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1x88 n GLY 56 N 0.00 0.51 3.07 -0.02 0.00 -1.26 -2.34 105.19 105.15 1x88 n GLY 56 Ca 0.00 -1.68 -0.33 0.00 0.00 0.00 0.00 46.02 44.02 1x88 n GLY 56 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1x88 s LEU 57 N -1.24 4.21 0.00 0.99 1.43 0.12 -4.82 118.68 119.37 1x88 s LEU 57 Ca 0.00 -1.74 0.00 0.00 -1.03 0.00 0.00 54.13 51.36 1x88 s LEU 57 Cb 0.00 -1.63 0.00 0.00 0.03 0.00 0.00 46.19 44.59 1x88 s LEU 57 CO 0.00 -0.31 0.00 0.00 0.23 0.00 0.00 176.35 176.27 1x88 n ALA 58 N 4.41 0.00 0.00 4.21 0.00 -1.26 -2.70 120.51 125.16 1x88 n ALA 58 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.38 1x88 n ALA 58 Cb 0.42 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.87 1x88 n ALA 58 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1x88 n ASP 59 N 4.54 0.00 -3.64 0.00 3.85 -1.26 -4.51 116.55 115.54 1x88 n ASP 59 Ca 0.00 0.17 -0.08 0.00 -0.71 0.00 0.00 54.79 54.16 1x88 n ASP 59 Cb 0.00 -0.17 -0.07 0.00 -1.35 0.00 0.00 41.12 39.53 1x88 n ASP 59 CO 0.00 0.00 0.00 -1.59 -1.01 0.00 0.00 177.20 174.60 1x88 s LYS 60 N -2.19 0.55 0.37 0.11 -2.85 -1.10 -5.18 119.74 109.44 1x88 s LYS 60 Ca 0.00 0.74 -0.13 0.00 -1.00 0.00 0.00 55.97 55.58 1x88 s LYS 60 Cb 0.00 0.22 0.04 0.00 -2.06 0.00 0.00 37.83 36.03 1x88 s LYS 60 CO 0.00 -0.08 0.71 -1.12 0.10 0.00 0.00 175.35 174.96 1x88 s SER 61 N 0.63 0.21 0.10 0.03 0.01 -1.26 0.11 113.70 113.53 1x88 s SER 61 Ca -0.01 -1.20 0.07 0.00 1.31 0.00 0.00 55.95 56.12 1x88 s SER 61 Cb -0.05 0.80 -0.04 0.00 0.21 0.00 0.00 66.02 66.94 1x88 s SER 61 CO -0.08 -1.57 -0.11 -0.94 0.41 0.00 0.00 173.24 170.95 1x88 s SER 62 N -3.10 4.36 0.11 2.44 1.04 -0.99 -4.88 113.70 112.69 1x88 s SER 62 Ca 0.19 -0.39 -0.07 0.00 0.48 0.00 0.00 55.95 56.16 1x88 s SER 62 Cb -0.04 -0.83 -0.01 0.00 0.10 0.00 0.00 66.02 65.24 1x88 s SER 62 CO 0.13 0.18 0.18 -0.13 0.98 0.00 0.00 173.24 174.58 1x88 s ARG 63 N -2.15 0.93 -0.13 4.02 0.52 -1.26 -1.93 118.95 118.94 1x88 s ARG 63 Ca 0.21 -1.12 0.01 0.00 -0.52 0.00 0.00 55.73 54.31 1x88 s ARG 63 Cb -0.11 0.32 0.02 0.00 0.52 0.00 0.00 34.95 35.70 1x88 s ARG 63 CO 0.13 -0.30 -0.15 0.15 0.02 0.00 0.00 175.30 175.15 1x88 s LYS 64 N -3.93 2.33 -0.02 3.54 -0.14 -0.28 -4.90 119.74 116.34 1x88 s LYS 64 Ca 0.12 -0.59 0.08 0.00 -1.36 0.00 0.00 55.97 54.22 1x88 s LYS 64 Cb 0.05 -2.03 -0.02 0.00 -1.68 0.00 0.00 37.83 34.15 1x88 s LYS 64 CO -0.06 -0.13 -0.26 0.99 -0.76 0.00 0.00 175.35 175.14 1x88 s THR 65 N 1.17 2.09 0.02 2.17 2.01 -1.26 -0.52 115.64 121.31 1x88 s THR 65 Ca -0.02 -1.11 0.02 0.00 0.31 0.00 0.00 61.69 60.89 1x88 s THR 65 Cb -0.14 -1.72 -0.01 0.00 0.01 0.00 0.00 72.50 70.63 1x88 s THR 65 CO -0.05 0.57 -0.06 -0.31 -0.69 0.00 0.00 174.62 174.07 1x88 s TYR 66 N -0.62 0.56 -0.08 4.92 1.51 -0.17 -4.97 117.35 118.50 1x88 s TYR 66 Ca 0.10 -0.29 -0.01 0.00 -1.01 0.00 0.00 57.07 55.87 1x88 s TYR 66 Cb -0.10 -0.34 -0.03 0.00 -0.11 0.00 0.00 41.96 41.37 1x88 s TYR 66 CO -0.01 -0.05 -0.03 0.95 -1.11 0.00 0.00 175.55 175.31 1x88 s THR 67 N -0.73 4.06 0.38 -0.71 -4.23 -1.26 -0.17 115.64 112.98 1x88 s THR 67 Ca -0.04 -0.34 0.04 0.00 -1.18 0.00 0.00 61.69 60.17 1x88 s THR 67 Cb -0.06 -2.69 -0.03 0.00 1.34 0.00 0.00 72.50 71.06 1x88 s THR 67 CO 0.00 0.60 0.14 -0.36 -0.54 0.00 0.00 174.62 174.46 1x88 s PHE 68 N -0.83 1.76 0.31 3.99 0.40 -0.05 -5.00 117.98 118.56 1x88 s PHE 68 Ca 0.13 -1.31 0.03 0.00 -0.60 0.00 0.00 56.93 55.18 1x88 s PHE 68 Cb -0.11 -1.07 0.50 0.00 0.51 0.00 0.00 43.02 42.85 1x88 s PHE 68 CO 0.02 -0.36 1.81 -0.44 0.70 0.00 0.00 175.22 176.95 1x88 h ASP 69 N 1.92 0.53 -4.75 1.36 3.32 -1.62 -3.45 116.42 113.74 1x88 h ASP 69 Ca -0.35 -0.13 -0.10 0.00 0.02 0.00 0.00 57.03 56.48 1x88 h ASP 69 Cb 1.26 -0.14 -0.21 0.00 0.22 0.00 0.00 39.33 40.47 1x88 h ASP 69 CO 0.55 0.65 -0.12 -0.04 -1.72 0.00 0.00 179.24 178.56 1x88 s MET 70 N -4.83 0.75 -0.04 3.56 -1.94 -1.25 -5.00 119.30 110.55 1x88 s MET 70 Ca -0.08 0.12 0.02 0.00 -1.71 0.00 0.00 55.69 54.05 1x88 s MET 70 Cb 0.15 0.35 0.01 0.00 2.01 0.00 0.00 34.83 37.35 1x88 s MET 70 CO 0.78 -0.20 -0.07 0.08 -0.01 0.00 0.00 175.02 175.60 1x88 s VAL 71 N -0.93 0.70 -0.21 -6.03 1.01 -1.26 -2.04 120.40 111.64 1x88 s VAL 71 Ca -0.10 -0.27 0.01 0.00 0.00 0.00 0.00 61.98 61.62 1x88 s VAL 71 Cb -0.03 -0.66 0.03 0.00 0.00 0.00 0.00 36.38 35.71 1x88 s VAL 71 CO 0.05 0.24 -0.16 -0.36 0.00 0.00 0.00 175.10 174.88 1x88 s PHE 72 N 0.52 2.93 0.94 5.22 0.08 0.11 -4.55 117.98 123.24 1x88 s PHE 72 Ca -0.08 -1.74 -0.12 0.00 0.12 0.00 0.00 56.93 55.11 1x88 s PHE 72 Cb -0.12 -1.95 0.16 0.00 -0.57 0.00 0.00 43.02 40.54 1x88 s PHE 72 CO 0.01 -0.80 1.10 0.20 -0.10 0.00 0.00 175.22 175.63 1x88 s GLY 73 N 1.26 1.58 0.53 4.36 0.00 -1.26 -1.42 107.32 112.37 1x88 s GLY 73 Ca 0.02 -0.34 0.31 0.00 0.00 0.00 0.00 44.72 44.71 1x88 s GLY 73 CO -0.10 0.22 1.87 0.00 0.00 0.00 0.00 173.10 175.10 1x88 h ALA 74 N -1.67 2.84 -0.01 3.20 0.00 -1.83 -0.32 119.26 121.47 1x88 h ALA 74 Ca -0.52 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.36 1x88 h ALA 74 Cb 1.32 0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.17 1x88 h ALA 74 CO 0.58 -1.11 -0.00 -1.13 0.00 0.00 0.00 179.25 177.59 1x88 n SER 75 N -4.28 1.19 -4.72 0.00 3.41 -1.26 -3.84 113.62 104.12 1x88 n SER 75 Ca 0.20 -1.39 -0.42 0.00 -0.26 0.00 0.00 58.87 56.99 1x88 n SER 75 Cb 0.98 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.91 1x88 n SER 75 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 1x88 s THR 76 N -2.00 2.09 0.37 6.66 2.01 -0.13 -4.99 115.64 119.65 1x88 s THR 76 Ca 0.40 0.07 -0.07 0.00 0.31 0.00 0.00 61.69 62.40 1x88 s THR 76 Cb 0.21 -3.04 -0.05 0.00 0.01 0.00 0.00 72.50 69.62 1x88 s THR 76 CO 0.34 0.01 0.68 -0.54 -0.69 0.00 0.00 174.62 174.42 1x88 s LYS 77 N 0.96 3.67 0.24 4.92 3.01 -1.26 -4.98 119.74 126.30 1x88 s LYS 77 Ca 0.73 0.20 -0.04 0.00 -1.01 0.00 0.00 55.97 55.85 1x88 s LYS 77 Cb -0.49 -2.50 0.43 0.00 -1.01 0.00 0.00 37.83 34.26 1x88 s LYS 77 CO 0.34 0.04 1.75 1.96 0.51 0.00 0.00 175.35 179.96 1x88 h GLN 78 N 1.23 0.53 -0.36 1.68 1.08 -1.88 -1.45 115.11 115.94 1x88 h GLN 78 Ca -0.47 -0.03 -0.01 0.00 -1.45 0.00 0.00 58.65 56.69 1x88 h GLN 78 Cb 1.19 -0.12 -0.02 0.00 -0.05 0.00 0.00 27.48 28.49 1x88 h GLN 78 CO 0.64 0.35 0.19 0.97 -0.95 0.00 0.00 178.83 180.03 1x88 h ILE 79 N 0.54 1.12 -0.00 2.54 6.09 -1.86 -1.58 117.51 124.36 1x88 h ILE 79 Ca 0.40 -0.30 -0.18 0.00 -1.37 0.00 0.00 64.86 63.41 1x88 h ILE 79 Cb 0.54 0.64 -0.02 0.00 0.47 0.00 0.00 36.82 38.45 1x88 h ILE 79 CO -0.34 0.13 -0.82 0.44 -3.07 0.00 0.00 178.15 174.48 1x88 h ASP 80 N 0.50 0.14 -0.43 2.19 3.32 -1.67 -1.02 116.42 119.44 1x88 h ASP 80 Ca 0.13 -0.11 -0.13 0.00 0.02 0.00 0.00 57.03 56.94 1x88 h ASP 80 Cb 0.02 -0.04 -0.01 0.00 0.22 0.00 0.00 39.33 39.52 1x88 h ASP 80 CO -0.02 0.89 -0.26 0.58 -1.72 0.00 0.00 179.24 178.71 1x88 h VAL 81 N 0.06 1.27 -0.15 -1.35 2.07 -0.99 -1.80 116.25 115.35 1x88 h VAL 81 Ca -0.02 -1.42 -0.02 0.00 0.82 0.00 0.00 66.70 66.06 1x88 h VAL 81 Cb 1.43 1.25 -0.01 0.00 -1.52 0.00 0.00 31.29 32.44 1x88 h VAL 81 CO 0.12 0.48 0.02 0.22 0.02 0.00 0.00 177.57 178.43 1x88 h TYR 82 N 0.76 0.27 -0.22 1.57 5.03 -1.19 -0.44 116.97 122.76 1x88 h TYR 82 Ca 0.09 -0.04 0.01 0.00 2.58 0.00 0.00 58.73 61.37 1x88 h TYR 82 Cb 0.84 -0.07 -0.01 0.00 1.55 0.00 0.00 36.73 39.03 1x88 h TYR 82 CO 0.06 0.44 0.13 0.00 -1.32 0.00 0.00 178.16 177.46 1x88 h ARG 83 N 0.03 0.26 -0.32 1.82 3.08 -1.17 0.42 114.38 118.50 1x88 h ARG 83 Ca 0.05 -0.02 -0.13 0.00 0.07 0.00 0.00 59.98 59.95 1x88 h ARG 83 Cb 0.31 -0.06 -0.00 0.00 0.08 0.00 0.00 29.97 30.30 1x88 h ARG 83 CO 0.00 0.17 -0.32 0.77 -1.07 0.00 0.00 179.97 179.53 1x88 h SER 84 N 0.27 0.83 0.00 7.04 0.02 -1.31 -3.35 113.55 117.04 1x88 h SER 84 Ca 0.08 -0.47 -0.38 0.00 -0.84 0.00 0.00 61.79 60.18 1x88 h SER 84 Cb -0.01 -0.23 -0.06 0.00 0.14 0.00 0.00 62.40 62.24 1x88 h SER 84 CO -0.04 1.13 -2.31 0.52 -1.14 0.00 0.00 176.83 174.99 1x88 n VAL 85 N -4.20 1.30 0.10 2.27 0.31 -0.18 -4.77 118.33 113.14 1x88 n VAL 85 Ca -0.03 -0.38 -0.23 0.00 -0.01 0.00 0.00 64.34 63.69 1x88 n VAL 85 Cb 0.49 -1.67 -0.15 0.00 -0.91 0.00 0.00 33.84 31.60 1x88 n VAL 85 CO 0.00 0.00 0.00 0.58 -1.32 0.00 0.00 176.83 176.09 1x88 h VAL 86 N -0.61 1.26 -0.67 2.52 2.07 -1.12 -3.32 116.25 116.38 1x88 h VAL 86 Ca -0.57 -2.60 0.13 0.00 0.82 0.00 0.00 66.70 64.48 1x88 h VAL 86 Cb 1.60 3.01 -0.13 0.00 -1.52 0.00 0.00 31.29 34.25 1x88 h VAL 86 CO -0.28 0.78 -0.24 0.00 0.02 0.00 0.00 177.57 177.85 1x88 h PRO 88 N -0.06 0.97 -0.41 0.00 0.11 -1.79 -1.74 132.00 129.08 1x88 h PRO 88 Ca 0.30 -0.12 -0.13 0.00 0.11 0.00 0.00 66.00 66.16 1x88 h PRO 88 Cb 0.53 -0.19 -0.01 0.00 0.11 0.00 0.00 31.00 31.45 1x88 h PRO 88 CO -0.72 0.74 -0.27 0.82 -0.21 0.00 0.00 178.00 178.36 1x88 h ILE 89 N 0.97 1.28 -0.37 4.15 2.04 -1.00 -2.60 117.51 121.98 1x88 h ILE 89 Ca 0.24 -1.43 -0.09 0.00 1.00 0.00 0.00 64.86 64.58 1x88 h ILE 89 Cb 0.08 1.30 -0.02 0.00 -0.74 0.00 0.00 36.82 37.44 1x88 h ILE 89 CO -0.03 0.48 -0.15 0.25 0.00 0.00 0.00 178.15 178.69 1x88 h LEU 90 N 0.72 0.67 -1.14 1.44 5.85 -0.13 -1.18 115.31 121.54 1x88 h LEU 90 Ca 0.08 -0.21 -0.00 0.00 0.84 0.00 0.00 57.88 58.59 1x88 h LEU 90 Cb 0.85 -0.18 -0.04 0.00 0.37 0.00 0.00 40.66 41.66 1x88 h LEU 90 CO 0.07 0.84 0.49 0.44 -0.34 0.00 0.00 178.44 179.95 1x88 h ASP 91 N 0.61 0.95 -0.30 1.25 3.32 -1.18 -0.61 116.42 120.45 1x88 h ASP 91 Ca 0.10 -0.05 -0.14 0.00 0.02 0.00 0.00 57.03 56.97 1x88 h ASP 91 Cb 0.61 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.91 1x88 h ASP 91 CO 0.04 0.72 -0.32 -0.33 -1.72 0.00 0.00 179.24 177.63 1x88 h GLU 92 N 1.09 0.83 -0.54 3.56 5.08 -1.01 -2.09 114.58 121.50 1x88 h GLU 92 Ca 0.29 -0.39 -0.01 0.00 -1.00 0.00 0.00 59.36 58.24 1x88 h GLU 92 Cb -0.06 -0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.15 1x88 h GLU 92 CO -0.06 1.03 0.28 0.28 -1.00 0.00 0.00 179.01 179.54 1x88 h VAL 93 N 0.69 1.19 0.00 3.13 2.07 -0.63 -1.52 116.25 121.18 1x88 h VAL 93 Ca 0.07 -0.50 -0.02 0.00 0.82 0.00 0.00 66.70 67.08 1x88 h VAL 93 Cb 0.87 0.53 -0.00 0.00 -1.52 0.00 0.00 31.29 31.17 1x88 h VAL 93 CO 0.08 0.21 -0.07 0.40 0.02 0.00 0.00 177.57 178.20 1x88 h ILE 94 N 0.73 0.44 0.00 4.57 2.04 -0.90 0.43 117.51 124.82 1x88 h ILE 94 Ca 0.19 -0.36 0.00 0.00 1.00 0.00 0.00 64.86 65.69 1x88 h ILE 94 Cb 0.07 1.25 0.00 0.00 -0.74 0.00 0.00 36.82 37.40 1x88 h ILE 94 CO -0.03 0.07 0.00 0.23 0.00 0.00 0.00 178.15 178.42 1x88 n MET 95 N -3.57 0.24 0.00 2.37 2.81 -0.60 -4.87 117.12 113.51 1x88 n MET 95 Ca -0.02 0.04 0.00 0.00 -1.81 0.00 0.00 57.70 55.91 1x88 n MET 95 Cb 0.19 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.20 1x88 n MET 95 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1x88 n GLY 96 N 1.04 1.42 3.80 3.03 0.00 0.14 -4.91 105.19 109.70 1x88 n GLY 96 Ca 0.10 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.90 1x88 n GLY 96 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1x88 s TYR 97 N -2.00 2.79 -0.12 1.61 2.02 -1.02 -4.52 117.35 116.10 1x88 s TYR 97 Ca 0.00 -0.37 -0.06 0.00 -0.37 0.00 0.00 57.07 56.28 1x88 s TYR 97 Cb 0.00 -1.77 -0.04 0.00 -0.40 0.00 0.00 41.96 39.75 1x88 s TYR 97 CO 0.00 0.22 0.08 -0.80 -1.57 0.00 0.00 175.55 173.48 1x88 s ASN 98 N -3.94 5.87 0.06 2.29 0.01 -1.26 -2.70 114.94 115.27 1x88 s ASN 98 Ca 0.40 0.28 0.02 0.00 -0.71 0.00 0.00 52.86 52.85 1x88 s ASN 98 Cb -0.04 -1.86 -0.03 0.00 0.41 0.00 0.00 41.25 39.73 1x88 s ASN 98 CO 0.25 0.34 -0.07 0.00 -1.51 0.00 0.00 177.10 176.12 1x88 s THR 100 N -2.44 -0.00 -0.10 0.00 2.01 -0.38 -0.91 115.64 113.81 1x88 s THR 100 Ca -0.01 0.01 0.01 0.00 0.31 0.00 0.00 61.69 62.01 1x88 s THR 100 Cb -0.03 -0.05 0.02 0.00 0.01 0.00 0.00 72.50 72.45 1x88 s THR 100 CO -0.03 0.00 -0.13 -0.63 -0.69 0.00 0.00 174.62 173.15 1x88 s ILE 101 N 0.04 1.29 -0.01 1.82 1.01 0.06 -0.92 121.20 124.49 1x88 s ILE 101 Ca -0.00 -0.51 0.01 0.00 0.00 0.00 0.00 60.65 60.14 1x88 s ILE 101 Cb -0.01 -1.21 -0.04 0.00 0.01 0.00 0.00 42.46 41.22 1x88 s ILE 101 CO -0.00 0.40 0.02 -0.36 0.00 0.00 0.00 174.94 175.00 1x88 s PHE 102 N 1.09 3.13 -0.21 3.97 0.08 -0.04 -0.57 117.98 125.44 1x88 s PHE 102 Ca -0.05 0.12 -0.03 0.00 0.12 0.00 0.00 56.93 57.09 1x88 s PHE 102 Cb -0.14 -1.69 -0.00 0.00 -0.57 0.00 0.00 43.02 40.61 1x88 s PHE 102 CO -0.02 0.48 -0.08 0.00 -0.10 0.00 0.00 175.22 175.50 1x88 s ALA 103 N -1.10 2.70 -0.03 5.36 0.00 0.21 -0.04 121.76 128.87 1x88 s ALA 103 Ca 0.20 -1.16 0.04 0.00 0.00 0.00 0.00 51.96 51.04 1x88 s ALA 103 Cb -0.12 -1.57 -0.01 0.00 0.00 0.00 0.00 23.12 21.43 1x88 s ALA 103 CO 0.10 -0.38 -0.15 -0.47 0.00 0.00 0.00 175.76 174.86 1x88 s TYR 104 N 1.38 1.48 0.00 0.00 6.14 -0.13 -2.48 117.35 123.73 1x88 s TYR 104 Ca 0.05 -0.36 0.00 0.00 0.64 0.00 0.00 57.07 57.40 1x88 s TYR 104 Cb -0.14 -0.98 0.00 0.00 0.42 0.00 0.00 41.96 41.26 1x88 s TYR 104 CO -0.05 -0.10 0.00 0.41 0.64 0.00 0.00 175.55 176.46 1x88 n GLY 105 N 2.97 1.73 3.76 8.97 0.00 -1.26 -0.19 105.19 121.17 1x88 n GLY 105 Ca -0.17 -1.26 -0.38 0.00 0.00 0.00 0.00 46.02 44.22 1x88 n GLY 105 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1x88 s GLN 106 N -1.97 3.48 0.25 1.61 0.74 -1.26 -1.95 119.66 120.56 1x88 s GLN 106 Ca 0.00 2.00 -0.31 0.00 0.05 0.00 0.00 55.36 57.10 1x88 s GLN 106 Cb 0.00 -2.35 -0.13 0.00 1.10 0.00 0.00 33.01 31.63 1x88 s GLN 106 CO 0.00 -0.85 1.45 2.41 -0.55 0.00 0.00 175.29 177.75 1x88 n THR 107 N -0.72 0.97 -0.34 -0.34 -1.04 -1.26 -2.09 114.28 109.45 1x88 n THR 107 Ca 0.09 -0.24 0.00 0.00 -2.04 0.00 0.00 64.05 61.85 1x88 n THR 107 Cb 0.46 -1.59 0.00 0.00 -1.82 0.00 0.00 70.33 67.39 1x88 n THR 107 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1x88 n GLY 108 N 2.16 0.75 0.37 3.41 0.00 -1.26 -4.96 105.19 105.66 1x88 n GLY 108 Ca 0.11 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.24 1x88 n GLY 108 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1x88 n THR 109 N -2.18 0.00 0.00 2.61 -2.24 -0.89 -4.98 114.28 106.60 1x88 n THR 109 Ca 0.00 -0.19 0.00 0.00 -2.27 0.00 0.00 64.05 61.59 1x88 n THR 109 Cb 0.00 1.18 0.00 0.00 -2.10 0.00 0.00 70.33 69.41 1x88 n THR 109 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1x88 n GLY 110 N 1.44 1.65 0.09 3.38 0.00 -1.26 -4.27 105.19 106.22 1x88 n GLY 110 Ca 0.08 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.97 1x88 n GLY 110 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1x88 h LYS 111 N 0.00 -0.13 -0.32 1.61 1.57 -1.94 -0.75 116.57 116.61 1x88 h LYS 111 Ca 0.00 0.01 -0.13 0.00 -1.87 0.00 0.00 60.65 58.65 1x88 h LYS 111 Cb 0.00 0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.33 1x88 h LYS 111 CO 0.00 0.06 -0.34 1.15 -0.57 0.00 0.00 179.45 179.74 1x88 h THR 112 N -0.30 1.28 -0.78 -0.16 2.02 -1.96 -0.40 112.91 112.61 1x88 h THR 112 Ca -0.01 -1.50 0.00 0.00 0.77 0.00 0.00 66.41 65.67 1x88 h THR 112 Cb 0.25 1.41 -0.04 0.00 -1.74 0.00 0.00 68.15 68.03 1x88 h THR 112 CO 0.02 0.49 0.49 0.15 0.37 0.00 0.00 175.52 177.04 1x88 h PHE 113 N 0.61 1.00 -0.05 3.16 3.57 -1.85 0.36 116.94 123.74 1x88 h PHE 113 Ca 0.06 0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.55 1x88 h PHE 113 Cb 0.87 -0.33 -0.00 0.00 2.79 0.00 0.00 35.95 39.28 1x88 h PHE 113 CO 0.04 0.66 -0.07 1.15 -2.23 0.00 0.00 178.31 177.86 1x88 h THR 114 N 1.06 1.40 -0.04 4.41 2.02 -0.88 -0.72 112.91 120.16 1x88 h THR 114 Ca 0.28 -1.30 -0.20 0.00 0.77 0.00 0.00 66.41 65.96 1x88 h THR 114 Cb -0.07 2.17 -0.00 0.00 -1.74 0.00 0.00 68.15 68.50 1x88 h THR 114 CO -0.06 0.35 -0.82 0.24 0.37 0.00 0.00 175.52 175.61 1x88 h MET 115 N -0.36 0.37 0.00 6.66 2.86 -0.95 -2.13 114.93 121.39 1x88 h MET 115 Ca 0.00 -0.35 -0.19 0.00 -2.06 0.00 0.00 59.70 57.10 1x88 h MET 115 Cb 0.61 0.09 -0.03 0.00 0.06 0.00 0.00 31.60 32.32 1x88 h MET 115 CO 0.02 1.01 -1.66 0.39 1.06 0.00 0.00 176.91 177.72 1x88 n GLU 116 N -3.78 0.26 0.00 1.72 1.02 0.12 -1.11 120.64 118.87 1x88 n GLU 116 Ca -0.05 0.10 0.00 0.00 -0.02 0.00 0.00 57.16 57.19 1x88 n GLU 116 Cb 0.76 -1.02 0.00 0.00 -0.02 0.00 0.00 31.44 31.16 1x88 n GLU 116 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1x88 n GLY 117 N 2.48 -2.77 3.28 0.62 0.00 -0.27 -0.99 105.19 107.54 1x88 n GLY 117 Ca -0.23 -1.73 -0.19 0.00 0.00 0.00 0.00 46.02 43.87 1x88 n GLY 117 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1x88 s GLU 118 N -0.72 1.72 -0.06 1.61 2.02 -0.72 -4.74 118.70 117.81 1x88 s GLU 118 Ca 0.00 -1.99 -0.09 0.00 0.02 0.00 0.00 54.97 52.91 1x88 s GLU 118 Cb 0.00 0.32 -0.05 0.00 0.10 0.00 0.00 34.13 34.51 1x88 s GLU 118 CO 0.00 -0.63 0.23 1.03 0.02 0.00 0.00 175.26 175.90 1x88 s ARG 119 N -3.49 3.58 0.38 1.61 1.81 -1.26 -3.61 118.95 117.97 1x88 s ARG 119 Ca 0.41 0.00 -0.26 0.00 -1.72 0.00 0.00 55.73 54.16 1x88 s ARG 119 Cb 0.03 -3.17 -0.09 0.00 -0.45 0.00 0.00 34.95 31.26 1x88 s ARG 119 CO 0.27 0.73 1.22 -1.12 -0.68 0.00 0.00 175.30 175.72 1x88 s SER 120 N -1.19 6.58 0.85 0.23 0.01 -1.26 -4.97 113.70 113.95 1x88 s SER 120 Ca 0.20 2.48 -0.12 0.00 1.31 0.00 0.00 55.95 59.82 1x88 s SER 120 Cb -0.13 -2.63 0.11 0.00 0.21 0.00 0.00 66.02 63.58 1x88 s SER 120 CO 0.09 -0.65 1.18 -2.84 0.41 0.00 0.00 173.24 171.43 1x88 s PRO 121 N -2.11 1.37 -1.80 12.44 0.02 -1.26 -3.95 135.00 139.70 1x88 s PRO 121 Ca 0.54 1.68 0.00 0.00 0.02 0.00 0.00 61.00 63.24 1x88 s PRO 121 Cb -0.34 -1.75 0.00 0.00 0.02 0.00 0.00 34.50 32.42 1x88 s PRO 121 CO 0.44 -2.40 0.00 -1.71 -0.33 0.00 0.00 177.00 173.00 1x88 n ASN 122 N -3.69 -5.87 -4.10 2.53 5.15 -1.26 -2.92 115.26 105.10 1x88 n ASN 122 Ca 0.13 0.01 -0.34 0.00 -0.60 0.00 0.00 54.58 53.78 1x88 n ASN 122 Cb 0.51 -4.90 -0.00 0.00 -0.53 0.00 0.00 39.78 34.86 1x88 n ASN 122 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 1x88 n GLU 123 N -2.96 -4.15 0.10 1.20 1.02 -1.25 -4.85 120.64 109.75 1x88 n GLU 123 Ca -0.24 0.47 -0.00 0.00 -0.02 0.00 0.00 57.16 57.36 1x88 n GLU 123 Cb 0.69 -5.26 0.29 0.00 -0.02 0.00 0.00 31.44 27.14 1x88 n GLU 123 CO 0.00 0.00 0.00 1.49 1.18 0.00 0.00 177.13 179.80 1x88 h GLU 124 N -1.75 0.25 -5.01 3.49 4.81 -1.72 -3.45 114.58 111.21 1x88 h GLU 124 Ca -0.59 -0.09 -0.32 0.00 -0.13 0.00 0.00 59.36 58.24 1x88 h GLU 124 Cb 1.38 -0.02 -0.16 0.00 0.63 0.00 0.00 28.75 30.58 1x88 h GLU 124 CO 0.74 0.52 -0.72 0.71 -0.73 0.00 0.00 179.01 179.52 1x88 s TYR 125 N -4.40 1.16 0.70 0.92 1.51 -1.26 -5.09 117.35 110.88 1x88 s TYR 125 Ca -0.05 -0.72 -0.11 0.00 -1.01 0.00 0.00 57.07 55.18 1x88 s TYR 125 Cb 0.14 -0.61 0.02 0.00 -0.11 0.00 0.00 41.96 41.40 1x88 s TYR 125 CO 0.76 0.03 1.08 0.95 -1.11 0.00 0.00 175.55 177.25 1x88 s THR 126 N -2.96 3.43 0.35 -0.71 -4.23 -1.26 -4.82 115.64 105.45 1x88 s THR 126 Ca 0.11 0.40 0.02 0.00 -1.18 0.00 0.00 61.69 61.04 1x88 s THR 126 Cb 0.00 -3.45 0.26 0.00 1.34 0.00 0.00 72.50 70.66 1x88 s THR 126 CO -0.00 -0.58 2.01 4.11 -0.54 0.00 0.00 174.62 179.62 1x88 h TRP 127 N -0.61 0.81 -0.03 3.99 5.08 -2.01 -1.55 115.95 121.62 1x88 h TRP 127 Ca -0.45 0.02 -0.04 0.00 1.08 0.00 0.00 58.89 59.50 1x88 h TRP 127 Cb 1.26 -0.28 -0.01 0.00 -3.00 0.00 0.00 29.16 27.14 1x88 h TRP 127 CO 0.49 0.51 -0.16 0.93 -1.28 0.00 0.00 178.44 178.93 1x88 h GLU 128 N 0.88 0.05 -0.15 0.12 5.08 -1.99 -3.08 114.58 115.49 1x88 h GLU 128 Ca 0.24 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.59 1x88 h GLU 128 Cb -0.10 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.15 1x88 h GLU 128 CO -0.05 0.21 0.00 0.39 -1.00 0.00 0.00 179.01 178.56 1x88 n GLU 129 N -4.32 1.49 -2.04 2.33 -0.58 -0.94 -4.99 120.64 111.58 1x88 n GLU 129 Ca -0.02 -1.56 -0.42 0.00 -0.42 0.00 0.00 57.16 54.73 1x88 n GLU 129 Cb 0.24 -1.27 -0.03 0.00 -0.57 0.00 0.00 31.44 29.82 1x88 n GLU 129 CO 0.00 0.00 0.00 0.34 -0.48 0.00 0.00 177.13 176.99 1x88 s ASP 130 N -1.05 6.61 0.37 1.62 -1.08 -0.63 -4.86 116.67 117.65 1x88 s ASP 130 Ca 0.19 2.08 0.27 0.00 -0.52 0.00 0.00 52.55 54.57 1x88 s ASP 130 Cb 0.12 -2.53 1.29 0.00 -1.46 0.00 0.00 42.92 40.33 1x88 s ASP 130 CO 0.17 -1.00 1.81 1.55 0.52 0.00 0.00 175.17 178.22 1x88 h PRO 131 N 9.79 0.00 -0.01 4.34 0.13 -1.92 -2.13 132.00 142.20 1x88 h PRO 131 Ca -0.37 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.76 1x88 h PRO 131 Cb 1.17 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.30 1x88 h PRO 131 CO 0.96 0.00 -0.15 1.28 -0.23 0.00 0.00 178.00 179.86 1x88 n LEU 132 N -2.46 1.32 -4.76 1.56 4.77 -1.26 -4.32 117.00 111.86 1x88 n LEU 132 Ca -0.00 -0.40 -0.39 0.00 -0.03 0.00 0.00 56.01 55.18 1x88 n LEU 132 Cb 0.14 -0.06 0.03 0.00 -2.33 0.00 0.00 43.42 41.20 1x88 n LEU 132 CO 0.17 0.23 1.04 0.00 -1.33 0.00 0.00 177.39 177.50 1x88 n ALA 133 N -0.23 1.87 -2.47 -1.18 0.00 -0.80 -1.75 120.51 115.95 1x88 n ALA 133 Ca 0.15 0.19 0.00 0.00 0.00 0.00 0.00 53.44 53.78 1x88 n ALA 133 Cb 0.36 -2.38 0.00 0.00 0.00 0.00 0.00 19.45 17.43 1x88 n ALA 133 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1x88 n GLY 134 N 0.65 1.93 0.17 0.00 0.00 -0.16 -4.76 105.19 103.02 1x88 n GLY 134 Ca 0.08 -2.08 -0.06 0.00 0.00 0.00 0.00 46.02 43.96 1x88 n GLY 134 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1x88 h ILE 135 N 0.00 0.92 0.60 -0.61 2.04 -1.20 -2.84 117.51 116.43 1x88 h ILE 135 Ca 0.00 -0.12 -0.02 0.00 1.00 0.00 0.00 64.86 65.71 1x88 h ILE 135 Cb 0.00 0.54 -0.00 0.00 -0.74 0.00 0.00 36.82 36.61 1x88 h ILE 135 CO 0.00 0.07 -0.36 0.40 0.00 0.00 0.00 178.15 178.25 1x88 h ILE 136 N 0.36 0.26 -0.59 -0.67 2.04 -1.39 -0.54 117.51 116.97 1x88 h ILE 136 Ca 0.18 0.00 -0.03 0.00 1.00 0.00 0.00 64.86 66.01 1x88 h ILE 136 Cb 0.13 0.26 -0.03 0.00 -0.74 0.00 0.00 36.82 36.44 1x88 h ILE 136 CO -0.16 0.00 0.25 1.55 0.00 0.00 0.00 178.15 179.79 1x88 h PRO 137 N -0.91 0.85 -0.60 2.37 0.13 -1.81 -2.15 132.00 129.87 1x88 h PRO 137 Ca -0.07 -0.12 -0.09 0.00 -0.87 0.00 0.00 66.00 64.85 1x88 h PRO 137 Cb 0.74 -0.15 -0.02 0.00 0.13 0.00 0.00 31.00 31.69 1x88 h PRO 137 CO 0.08 0.69 0.04 0.00 -0.23 0.00 0.00 178.00 178.57 1x88 h ARG 138 N 0.84 1.02 -0.10 0.86 3.08 -1.41 -2.02 114.38 116.66 1x88 h ARG 138 Ca 0.20 -0.29 -0.01 0.00 0.07 0.00 0.00 59.98 59.95 1x88 h ARG 138 Cb 0.14 -0.11 -0.00 0.00 0.08 0.00 0.00 29.97 30.08 1x88 h ARG 138 CO -0.02 0.98 0.02 1.15 -1.07 0.00 0.00 179.97 181.03 1x88 h THR 139 N 0.95 1.21 -0.74 2.04 2.02 -0.78 -0.77 112.91 116.84 1x88 h THR 139 Ca 0.18 -0.67 0.00 0.00 0.77 0.00 0.00 66.41 66.70 1x88 h THR 139 Cb 0.49 1.47 -0.04 0.00 -1.74 0.00 0.00 68.15 68.34 1x88 h THR 139 CO 0.02 0.19 0.47 -0.07 0.37 0.00 0.00 175.52 176.50 1x88 h LEU 140 N -0.07 0.86 -0.54 2.58 3.38 -1.34 -1.44 115.31 118.75 1x88 h LEU 140 Ca 0.03 -0.04 -0.03 0.00 0.09 0.00 0.00 57.88 57.93 1x88 h LEU 140 Cb 0.28 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.79 1x88 h LEU 140 CO 0.00 0.65 0.20 -0.74 0.09 0.00 0.00 178.44 178.64 1x88 h HIS 141 N 1.01 0.82 -0.40 1.13 2.76 -1.26 -3.03 115.15 116.18 1x88 h HIS 141 Ca 0.27 -0.07 -0.05 0.00 -2.20 0.00 0.00 60.37 58.32 1x88 h HIS 141 Cb -0.08 -0.25 -0.02 0.00 1.55 0.00 0.00 27.41 28.61 1x88 h HIS 141 CO -0.02 0.68 0.04 1.96 -1.30 0.00 0.00 177.93 179.29 1x88 h GLN 142 N 0.73 0.62 -0.45 5.26 1.08 -0.68 -2.86 115.11 118.80 1x88 h GLN 142 Ca 0.18 -0.13 0.05 0.00 -1.45 0.00 0.00 58.65 57.30 1x88 h GLN 142 Cb 0.22 -0.09 -0.05 0.00 -0.05 0.00 0.00 27.48 27.51 1x88 h GLN 142 CO -0.01 0.61 0.19 0.82 -0.95 0.00 0.00 178.83 179.49 1x88 h ILE 143 N 0.59 0.90 -0.21 2.54 2.04 -1.15 0.16 117.51 122.38 1x88 h ILE 143 Ca 0.13 -0.13 -0.09 0.00 1.00 0.00 0.00 64.86 65.77 1x88 h ILE 143 Cb 0.32 0.49 -0.01 0.00 -0.74 0.00 0.00 36.82 36.87 1x88 h ILE 143 CO 0.01 0.07 -0.26 -0.26 0.00 0.00 0.00 178.15 177.70 1x88 h PHE 144 N 0.38 0.44 -0.09 1.37 0.04 -1.58 -2.27 116.94 115.23 1x88 h PHE 144 Ca 0.21 -0.09 -0.03 0.00 2.80 0.00 0.00 57.97 60.85 1x88 h PHE 144 Cb 0.17 -0.11 -0.00 0.00 2.20 0.00 0.00 35.95 38.21 1x88 h PHE 144 CO -0.13 0.63 -0.08 0.93 -0.60 0.00 0.00 178.31 179.06 1x88 h GLU 145 N 0.35 0.21 0.00 1.51 4.39 -1.11 -2.53 114.58 117.40 1x88 h GLU 145 Ca 0.05 -0.11 -0.05 0.00 0.34 0.00 0.00 59.36 59.60 1x88 h GLU 145 Cb 0.65 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.30 1x88 h GLU 145 CO 0.05 0.63 -0.23 0.87 -1.16 0.00 0.00 179.01 179.17 1x88 h LYS 146 N -0.20 0.00 -0.36 2.33 1.57 -0.65 -2.99 116.57 116.27 1x88 h LYS 146 Ca 0.02 0.00 -0.08 0.00 -1.87 0.00 0.00 60.65 58.71 1x88 h LYS 146 Cb 0.58 0.00 -0.05 0.00 0.08 0.00 0.00 32.23 32.84 1x88 h LYS 146 CO 0.02 0.23 0.03 1.28 -0.57 0.00 0.00 179.45 180.43 1x88 n LEU 147 N -3.75 4.30 -0.11 2.94 4.77 -0.86 -4.76 117.00 119.52 1x88 n LEU 147 Ca -0.01 -3.25 -0.05 0.00 -0.03 0.00 0.00 56.01 52.66 1x88 n LEU 147 Cb 0.33 -0.60 0.02 0.00 -2.33 0.00 0.00 43.42 40.85 1x88 n LEU 147 CO 0.34 0.85 0.87 0.74 -1.33 0.00 0.00 177.39 178.85 1x88 h THR 148 N 1.71 0.74 -0.12 -5.08 2.02 -1.30 -3.39 112.91 107.49 1x88 h THR 148 Ca 0.10 -0.05 -0.22 0.00 0.77 0.00 0.00 66.41 67.02 1x88 h THR 148 Cb 1.65 0.60 -0.19 0.00 -1.74 0.00 0.00 68.15 68.47 1x88 h THR 148 CO 0.35 0.02 -0.45 -0.90 0.37 0.00 0.00 175.52 174.92 1x88 n ASP 149 N -5.16 -1.26 -1.22 4.18 5.68 -1.26 -4.95 116.55 112.56 1x88 n ASP 149 Ca 0.02 -2.39 0.12 0.00 -0.50 0.00 0.00 54.79 52.04 1x88 n ASP 149 Cb 0.19 0.69 0.28 0.00 -1.14 0.00 0.00 41.12 41.14 1x88 n ASP 149 CO 0.00 0.00 0.00 -0.46 -1.33 0.00 0.00 177.20 175.41 1x88 n ASN 150 N -0.84 3.59 0.00 -1.12 6.94 -1.26 -4.93 115.26 117.64 1x88 n ASN 150 Ca -0.06 -1.99 0.00 0.00 -0.02 0.00 0.00 54.58 52.51 1x88 n ASN 150 Cb 0.85 -0.38 0.00 0.00 -2.36 0.00 0.00 39.78 37.90 1x88 n ASN 150 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1x88 n GLY 151 N 1.57 0.74 3.40 4.83 0.00 -1.26 -5.04 105.19 109.42 1x88 n GLY 151 Ca 0.22 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.83 1x88 n GLY 151 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1x88 s THR 152 N -2.55 4.66 0.36 2.61 2.01 -1.26 -4.37 115.64 117.09 1x88 s THR 152 Ca 0.00 -0.76 -0.26 0.00 0.31 0.00 0.00 61.69 60.98 1x88 s THR 152 Cb 0.00 -3.56 -0.09 0.00 0.01 0.00 0.00 72.50 68.86 1x88 s THR 152 CO 0.00 -0.19 1.08 -1.61 -0.69 0.00 0.00 174.62 173.21 1x88 s GLU 153 N 1.58 4.31 0.17 4.92 0.41 -0.07 -4.84 118.70 125.17 1x88 s GLU 153 Ca 0.03 1.65 -0.20 0.00 -0.41 0.00 0.00 54.97 56.04 1x88 s GLU 153 Cb -0.19 -2.77 0.05 0.00 -1.78 0.00 0.00 34.13 29.44 1x88 s GLU 153 CO 0.07 -0.05 0.54 -0.59 -0.49 0.00 0.00 175.26 174.75 1x88 s PHE 154 N -1.46 -0.31 0.02 1.61 -0.12 -1.26 -0.46 117.98 115.99 1x88 s PHE 154 Ca 0.53 0.02 0.02 0.00 -0.05 0.00 0.00 56.93 57.45 1x88 s PHE 154 Cb -0.26 0.45 -0.01 0.00 -0.63 0.00 0.00 43.02 42.57 1x88 s PHE 154 CO 0.33 -0.87 -0.06 -1.54 -0.05 0.00 0.00 175.22 173.04 1x88 s SER 155 N -2.81 0.61 -0.09 1.98 1.04 -0.50 -4.98 113.70 108.94 1x88 s SER 155 Ca 0.05 -0.32 0.04 0.00 0.48 0.00 0.00 55.95 56.20 1x88 s SER 155 Cb -0.01 0.00 -0.00 0.00 0.10 0.00 0.00 66.02 66.11 1x88 s SER 155 CO -0.08 -0.09 -0.23 -0.69 0.98 0.00 0.00 173.24 173.13 1x88 s VAL 156 N -0.77 1.96 0.01 5.02 1.01 -1.26 -1.67 120.40 124.70 1x88 s VAL 156 Ca -0.05 -0.97 0.04 0.00 0.00 0.00 0.00 61.98 61.00 1x88 s VAL 156 Cb -0.06 -1.70 -0.01 0.00 0.00 0.00 0.00 36.38 34.61 1x88 s VAL 156 CO -0.00 0.54 -0.13 -0.54 0.00 0.00 0.00 175.10 174.97 1x88 s LYS 157 N 0.31 0.94 0.13 2.72 1.02 -0.48 -0.55 119.74 123.82 1x88 s LYS 157 Ca -0.17 -0.56 0.06 0.00 0.02 0.00 0.00 55.97 55.32 1x88 s LYS 157 Cb -0.17 -0.91 -0.04 0.00 -0.52 0.00 0.00 37.83 36.19 1x88 s LYS 157 CO 0.08 0.24 -0.15 0.14 -0.92 0.00 0.00 175.35 174.74 1x88 s VAL 158 N -0.54 1.41 0.02 3.17 -7.23 -0.01 -0.68 120.40 116.55 1x88 s VAL 158 Ca 0.03 -1.74 -0.08 0.00 -1.81 0.00 0.00 61.98 58.38 1x88 s VAL 158 Cb -0.06 -1.58 0.00 0.00 0.56 0.00 0.00 36.38 35.30 1x88 s VAL 158 CO 0.00 -0.39 0.15 -0.94 -0.31 0.00 0.00 175.10 173.62 1x88 s SER 159 N -2.47 0.06 -0.28 4.85 1.04 -0.60 -0.62 113.70 115.68 1x88 s SER 159 Ca 0.10 -0.33 -0.02 0.00 0.48 0.00 0.00 55.95 56.18 1x88 s SER 159 Cb -0.05 0.24 0.09 0.00 0.10 0.00 0.00 66.02 66.40 1x88 s SER 159 CO 0.04 -0.47 0.09 -0.22 0.98 0.00 0.00 173.24 173.65 1x88 s LEU 160 N -1.80 1.69 -0.17 2.42 2.96 -1.26 -0.81 118.68 121.71 1x88 s LEU 160 Ca -0.09 -1.37 -0.06 0.00 -0.22 0.00 0.00 54.13 52.38 1x88 s LEU 160 Cb -0.04 -0.71 -0.04 0.00 0.50 0.00 0.00 46.19 45.90 1x88 s LEU 160 CO -0.02 -0.39 0.04 -0.22 -1.32 0.00 0.00 176.35 174.44 1x88 s LEU 161 N 1.76 3.71 0.05 -0.68 2.96 -0.38 -1.83 118.68 124.26 1x88 s LEU 161 Ca 0.07 0.06 0.08 0.00 -0.22 0.00 0.00 54.13 54.11 1x88 s LEU 161 Cb -0.17 -1.92 -0.03 0.00 0.50 0.00 0.00 46.19 44.57 1x88 s LEU 161 CO -0.23 0.20 -0.21 -1.61 -1.32 0.00 0.00 176.35 173.18 1x88 s GLU 162 N 0.22 1.39 -0.16 1.98 2.02 -0.29 0.38 118.70 124.24 1x88 s GLU 162 Ca 0.03 -0.98 0.00 0.00 0.02 0.00 0.00 54.97 54.04 1x88 s GLU 162 Cb -0.13 -1.53 0.00 0.00 0.10 0.00 0.00 34.13 32.58 1x88 s GLU 162 CO 0.01 0.39 -0.16 0.42 0.02 0.00 0.00 175.26 175.93 1x88 s ILE 163 N -0.84 2.49 -0.04 -1.63 1.01 0.78 -0.89 121.20 122.08 1x88 s ILE 163 Ca 0.08 -0.82 -0.02 0.00 0.00 0.00 0.00 60.65 59.89 1x88 s ILE 163 Cb -0.09 -2.05 0.03 0.00 0.01 0.00 0.00 42.46 40.36 1x88 s ILE 163 CO 0.02 0.52 0.06 -0.47 0.00 0.00 0.00 174.94 175.06 1x88 s TYR 164 N 0.99 0.08 -1.45 3.97 6.14 -0.56 -0.80 117.35 125.71 1x88 s TYR 164 Ca -0.02 0.23 -0.10 0.00 0.64 0.00 0.00 57.07 57.82 1x88 s TYR 164 Cb -0.15 -0.47 0.04 0.00 0.42 0.00 0.00 41.96 41.80 1x88 s TYR 164 CO -0.04 -0.19 1.01 0.09 0.64 0.00 0.00 175.55 177.06 1x88 n ASN 165 N 5.21 -5.63 -1.34 4.32 3.02 -1.26 -1.38 115.26 118.19 1x88 n ASN 165 Ca -0.05 -0.59 -0.17 0.00 -0.03 0.00 0.00 54.58 53.73 1x88 n ASN 165 Cb 0.50 -4.47 -0.07 0.00 -0.61 0.00 0.00 39.78 35.12 1x88 n ASN 165 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1x88 n GLU 166 N -4.71 -1.33 -4.17 3.52 -0.58 -1.26 -4.99 120.64 107.12 1x88 n GLU 166 Ca 0.01 1.11 -0.30 0.00 -0.42 0.00 0.00 57.16 57.56 1x88 n GLU 166 Cb 0.55 -5.41 -0.09 0.00 -0.57 0.00 0.00 31.44 25.93 1x88 n GLU 166 CO 0.00 0.00 0.00 -1.21 -0.48 0.00 0.00 177.13 175.44 1x88 s GLU 167 N -3.47 2.36 -0.14 3.49 2.02 -0.48 -4.95 118.70 117.54 1x88 s GLU 167 Ca 0.00 -0.92 -0.05 0.00 0.02 0.00 0.00 54.97 54.02 1x88 s GLU 167 Cb 0.00 -2.44 -0.04 0.00 0.10 0.00 0.00 34.13 31.76 1x88 s GLU 167 CO 0.00 0.53 0.04 -0.51 0.02 0.00 0.00 175.26 175.33 1x88 s LEU 168 N -2.27 3.72 0.05 1.80 1.43 -1.26 -1.50 118.68 120.66 1x88 s LEU 168 Ca 0.24 0.12 0.05 0.00 -1.03 0.00 0.00 54.13 53.51 1x88 s LEU 168 Cb -0.11 -1.90 -0.03 0.00 0.03 0.00 0.00 46.19 44.18 1x88 s LEU 168 CO 0.16 0.27 -0.15 -0.36 0.23 0.00 0.00 176.35 176.50 1x88 s PHE 169 N -0.20 1.28 -0.38 0.29 0.40 -0.07 -0.60 117.98 118.70 1x88 s PHE 169 Ca 0.07 -0.40 -0.09 0.00 -0.60 0.00 0.00 56.93 55.91 1x88 s PHE 169 Cb -0.12 -0.74 0.05 0.00 0.51 0.00 0.00 43.02 42.72 1x88 s PHE 169 CO 0.02 0.06 0.19 0.34 0.70 0.00 0.00 175.22 176.52 1x88 s ASP 170 N -1.40 5.55 0.00 1.36 -1.08 -1.26 -1.14 116.67 118.70 1x88 s ASP 170 Ca 0.01 -1.25 0.29 0.00 -0.52 0.00 0.00 52.55 51.08 1x88 s ASP 170 Cb -0.09 -1.96 1.41 0.00 -1.46 0.00 0.00 42.92 40.83 1x88 s ASP 170 CO 0.02 -0.43 1.94 0.18 0.52 0.00 0.00 175.17 177.41 1x88 n LEU 171 N 4.90 0.78 -0.43 -1.34 7.99 -0.76 -3.63 117.00 124.51 1x88 n LEU 171 Ca -0.11 -0.27 0.04 0.00 -0.01 0.00 0.00 56.01 55.66 1x88 n LEU 171 Cb 0.44 -0.01 0.08 0.00 -0.11 0.00 0.00 43.42 43.82 1x88 n LEU 171 CO 0.36 0.13 0.49 0.18 -1.51 0.00 0.00 177.39 177.04 1x88 n LEU 172 N -0.38 2.22 -4.56 2.23 4.77 -1.26 -4.14 117.00 115.89 1x88 n LEU 172 Ca 0.21 -1.49 -0.43 0.00 -0.03 0.00 0.00 56.01 54.27 1x88 n LEU 172 Cb 0.23 -0.09 -0.05 0.00 -2.33 0.00 0.00 43.42 41.18 1x88 n LEU 172 CO 0.17 0.51 0.59 0.21 -1.33 0.00 0.00 177.39 177.54 1x88 s ASN 173 N -0.86 6.47 0.51 -1.43 3.84 -1.24 -4.92 114.94 117.30 1x88 s ASN 173 Ca 0.14 0.07 0.32 0.00 0.21 0.00 0.00 52.86 53.60 1x88 s ASN 173 Cb 0.08 -2.40 1.25 0.00 -0.55 0.00 0.00 41.25 39.63 1x88 s ASN 173 CO 0.12 -0.88 1.93 -0.65 -2.79 0.00 0.00 177.10 174.83 1x88 h PRO 174 N 8.84 0.00 -0.10 0.43 0.11 -1.92 -3.24 132.00 136.11 1x88 h PRO 174 Ca -0.25 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.86 1x88 h PRO 174 Cb 1.09 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.20 1x88 h PRO 174 CO 0.95 0.00 0.00 -1.13 -0.21 0.00 0.00 178.00 177.61 1x88 n SER 175 N -3.00 2.56 -4.74 -2.05 3.41 -1.26 -4.99 113.62 103.55 1x88 n SER 175 Ca 0.01 -1.75 -0.32 0.00 -0.26 0.00 0.00 58.87 56.56 1x88 n SER 175 Cb 0.32 -0.06 -0.07 0.00 -0.26 0.00 0.00 64.21 64.14 1x88 n SER 175 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1x88 s SER 176 N -1.32 5.40 0.34 4.04 1.04 -1.22 -5.10 113.70 116.88 1x88 s SER 176 Ca 0.22 0.02 -0.26 0.00 0.48 0.00 0.00 55.95 56.40 1x88 s SER 176 Cb 0.15 -1.45 -0.09 0.00 0.10 0.00 0.00 66.02 64.72 1x88 s SER 176 CO 0.21 0.23 1.05 -0.62 0.98 0.00 0.00 173.24 175.09 1x88 s ASP 177 N -1.97 7.03 0.33 7.02 3.68 -1.26 -4.90 116.67 126.60 1x88 s ASP 177 Ca 0.24 2.09 0.22 0.00 2.13 0.00 0.00 52.55 57.24 1x88 s ASP 177 Cb -0.12 -2.60 1.20 0.00 -1.45 0.00 0.00 42.92 39.95 1x88 s ASP 177 CO 0.16 -0.30 1.68 0.52 0.13 0.00 0.00 175.17 177.36 1x88 n VAL 178 N 0.50 1.02 0.18 1.11 0.31 -1.26 -0.32 118.33 119.86 1x88 n VAL 178 Ca 0.02 0.74 0.11 0.00 -0.01 0.00 0.00 64.34 65.20 1x88 n VAL 178 Cb 0.48 -1.74 0.11 0.00 -0.91 0.00 0.00 33.84 31.78 1x88 n VAL 178 CO 0.00 0.00 0.00 -1.28 -1.32 0.00 0.00 176.83 174.23 1x88 h SER 179 N 0.00 0.00 -2.79 4.52 0.87 -1.99 -3.46 113.55 110.71 1x88 h SER 179 Ca 0.00 0.00 -0.54 0.00 -1.23 0.00 0.00 61.79 60.02 1x88 h SER 179 Cb 0.00 0.00 0.01 0.00 -0.44 0.00 0.00 62.40 61.97 1x88 h SER 179 CO 0.00 0.07 0.93 -0.70 -0.53 0.00 0.00 176.83 176.60 1x88 s GLU 180 N -3.21 4.24 0.08 2.24 2.56 0.56 -5.01 118.70 120.15 1x88 s GLU 180 Ca 0.05 2.13 -0.00 0.00 0.00 0.00 0.00 54.97 57.14 1x88 s GLU 180 Cb 0.06 -3.63 -0.04 0.00 2.00 0.00 0.00 34.13 32.52 1x88 s GLU 180 CO 0.71 -0.67 0.24 1.03 -0.56 0.00 0.00 175.26 176.01 1x88 s ARG 181 N 2.70 3.46 0.18 4.30 1.81 -1.26 -4.64 118.95 125.50 1x88 s ARG 181 Ca 0.69 -0.41 0.04 0.00 -1.72 0.00 0.00 55.73 54.32 1x88 s ARG 181 Cb -0.35 -3.00 -0.03 0.00 -0.45 0.00 0.00 34.95 31.11 1x88 s ARG 181 CO 0.29 0.58 0.27 -0.51 -0.68 0.00 0.00 175.30 175.24 1x88 s LEU 182 N -2.64 4.20 -0.07 2.53 1.43 0.23 -4.99 118.68 119.37 1x88 s LEU 182 Ca 0.36 0.06 -0.01 0.00 -1.03 0.00 0.00 54.13 53.51 1x88 s LEU 182 Cb -0.13 -2.77 -0.03 0.00 0.03 0.00 0.00 46.19 43.29 1x88 s LEU 182 CO 0.28 0.02 -0.02 -1.10 0.23 0.00 0.00 176.35 175.76 1x88 s GLN 183 N -3.43 2.91 -0.09 1.70 -1.52 -1.26 -4.37 119.66 113.60 1x88 s GLN 183 Ca 0.34 -0.46 -0.01 0.00 -1.95 0.00 0.00 55.36 53.28 1x88 s GLN 183 Cb -0.10 -2.73 -0.03 0.00 -0.22 0.00 0.00 33.01 29.93 1x88 s GLN 183 CO 0.27 0.69 -0.04 1.41 -0.25 0.00 0.00 175.29 177.38 1x88 s MET 184 N -0.92 3.05 0.05 2.91 -2.45 -1.26 -1.36 119.30 119.32 1x88 s MET 184 Ca 0.14 -0.49 0.00 0.00 -1.25 0.00 0.00 55.69 54.09 1x88 s MET 184 Cb -0.11 -2.74 -0.03 0.00 1.25 0.00 0.00 34.83 33.20 1x88 s MET 184 CO 0.03 0.58 -0.05 -0.06 1.05 0.00 0.00 175.02 176.57 1x88 s PHE 185 N -0.56 0.56 0.38 4.11 0.40 -0.01 -4.97 117.98 117.88 1x88 s PHE 185 Ca 0.09 -0.78 -0.25 0.00 -0.60 0.00 0.00 56.93 55.39 1x88 s PHE 185 Cb -0.12 -0.36 -0.09 0.00 0.51 0.00 0.00 43.02 42.96 1x88 s PHE 185 CO 0.02 -0.22 1.07 -0.51 0.70 0.00 0.00 175.22 176.28 1x88 s ASP 186 N -2.29 6.78 -0.30 1.36 1.01 -1.26 0.13 116.67 122.09 1x88 s ASP 186 Ca -0.02 2.12 -0.26 0.00 0.71 0.00 0.00 52.55 55.10 1x88 s ASP 186 Cb -0.01 -2.60 0.01 0.00 1.01 0.00 0.00 42.92 41.33 1x88 s ASP 186 CO -0.04 -0.48 0.92 -0.62 0.21 0.00 0.00 175.17 175.15 1x88 s ASP 187 N -1.41 6.80 0.44 0.27 -1.08 -0.09 -4.63 116.67 116.98 1x88 s ASP 187 Ca 0.56 0.87 0.18 0.00 -0.52 0.00 0.00 52.55 53.65 1x88 s ASP 187 Cb -0.25 -2.47 1.12 0.00 -1.46 0.00 0.00 42.92 39.86 1x88 s ASP 187 CO 0.31 -0.72 1.89 -0.65 0.52 0.00 0.00 175.17 176.52 1x88 h PRO 188 N 8.04 0.35 -0.57 4.34 0.11 -1.94 -0.31 132.00 142.02 1x88 h PRO 188 Ca -0.22 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.87 1x88 h PRO 188 Cb 1.08 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.11 1x88 h PRO 188 CO 0.95 0.23 0.00 2.89 -0.21 0.00 0.00 178.00 181.86 1x88 n ARG 189 N -4.47 4.84 -3.27 1.05 1.85 -1.26 -4.77 116.66 110.63 1x88 n ARG 189 Ca 0.17 -3.16 -0.05 0.00 -1.00 0.00 0.00 57.85 53.81 1x88 n ARG 189 Cb 0.65 -2.25 -0.05 0.00 -1.05 0.00 0.00 32.46 29.76 1x88 n ARG 189 CO 0.00 0.00 0.00 -0.80 -0.01 0.00 0.00 177.63 176.82 1x88 s ASN 190 N -0.83 -0.24 0.24 2.89 0.01 -0.13 -5.05 114.94 111.83 1x88 s ASN 190 Ca 0.54 0.06 -0.05 0.00 -0.71 0.00 0.00 52.86 52.70 1x88 s ASN 190 Cb 0.41 1.41 0.40 0.00 0.41 0.00 0.00 41.25 43.89 1x88 s ASN 190 CO 0.16 -0.32 1.77 0.07 -1.51 0.00 0.00 177.10 177.28 1x88 h LYS 191 N 8.12 0.60 -0.48 -0.60 2.10 -1.86 -2.19 116.57 122.25 1x88 h LYS 191 Ca -0.12 -0.04 -0.12 0.00 -2.00 0.00 0.00 60.65 58.37 1x88 h LYS 191 Cb 1.15 -0.13 -0.07 0.00 -0.90 0.00 0.00 32.23 32.27 1x88 h LYS 191 CO 0.25 0.39 0.09 2.89 -2.00 0.00 0.00 179.45 181.07 1x88 n ARG 192 N -4.86 3.13 -4.32 0.07 1.85 -1.26 -4.91 116.66 106.35 1x88 n ARG 192 Ca 0.13 -3.02 -0.24 0.00 -1.00 0.00 0.00 57.85 53.72 1x88 n ARG 192 Cb 0.32 -2.01 -0.08 0.00 -1.05 0.00 0.00 32.46 29.65 1x88 n ARG 192 CO 0.00 0.00 0.00 0.20 -0.01 0.00 0.00 177.63 177.82 1x88 s GLY 193 N -1.65 1.70 0.18 2.89 0.00 -0.82 -4.75 107.32 104.86 1x88 s GLY 193 Ca 0.48 -1.66 0.04 0.00 0.00 0.00 0.00 44.72 43.58 1x88 s GLY 193 CO 0.09 -1.73 -0.06 -1.34 0.00 0.00 0.00 173.10 170.06 1x88 s VAL 194 N -2.27 1.10 -0.12 1.40 -7.23 -1.26 -0.91 120.40 111.11 1x88 s VAL 194 Ca 0.30 -2.05 0.02 0.00 -1.81 0.00 0.00 61.98 58.44 1x88 s VAL 194 Cb -0.07 -2.04 0.01 0.00 0.56 0.00 0.00 36.38 34.85 1x88 s VAL 194 CO 0.18 -0.58 -0.18 -0.63 -0.31 0.00 0.00 175.10 173.58 1x88 s ILE 195 N -3.38 1.71 -0.62 -0.62 1.01 0.34 -4.68 121.20 114.96 1x88 s ILE 195 Ca 0.21 -0.77 -0.16 0.00 0.00 0.00 0.00 60.65 59.94 1x88 s ILE 195 Cb 0.04 -1.54 0.15 0.00 0.01 0.00 0.00 42.46 41.12 1x88 s ILE 195 CO 0.04 0.48 0.59 -0.63 0.00 0.00 0.00 174.94 175.42 1x88 s ILE 196 N 0.93 5.28 0.11 2.92 -1.09 -1.26 -0.83 121.20 127.26 1x88 s ILE 196 Ca -0.07 -1.72 -0.32 0.00 -2.23 0.00 0.00 60.65 56.31 1x88 s ILE 196 Cb -0.15 -4.39 -0.11 0.00 -1.58 0.00 0.00 42.46 36.23 1x88 s ILE 196 CO -0.02 -0.94 1.80 1.17 -1.23 0.00 0.00 174.94 175.73 1x88 n LYS 197 N 5.00 2.64 0.00 2.79 4.81 -0.46 -2.36 118.16 130.58 1x88 n LYS 197 Ca -0.06 0.96 0.00 0.00 -0.87 0.00 0.00 58.31 58.34 1x88 n LYS 197 Cb 0.42 -2.83 0.00 0.00 0.02 0.00 0.00 35.03 32.64 1x88 n LYS 197 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1x88 n GLY 198 N 4.12 2.03 3.66 3.14 0.00 -1.26 -4.04 105.19 112.84 1x88 n GLY 198 Ca 0.18 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.78 1x88 n GLY 198 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1x88 s LEU 199 N 0.00 4.38 0.22 0.99 2.96 -1.00 -4.94 118.68 121.29 1x88 s LEU 199 Ca 0.00 2.53 -0.25 0.00 -0.22 0.00 0.00 54.13 56.18 1x88 s LEU 199 Cb 0.00 -3.53 -0.09 0.00 0.50 0.00 0.00 46.19 43.07 1x88 s LEU 199 CO 0.00 -1.03 0.83 -1.61 -1.32 0.00 0.00 176.35 173.22 1x88 s GLU 200 N 4.37 4.57 -0.21 1.98 2.02 -1.26 -5.05 118.70 125.13 1x88 s GLU 200 Ca 0.84 1.20 -0.02 0.00 0.02 0.00 0.00 54.97 57.01 1x88 s GLU 200 Cb -0.40 -3.11 0.00 0.00 0.10 0.00 0.00 34.13 30.72 1x88 s GLU 200 CO 0.38 0.48 -0.09 -1.21 0.02 0.00 0.00 175.26 174.83 1x88 s GLU 201 N -1.47 3.26 -0.18 1.61 2.02 -1.26 -4.51 118.70 118.16 1x88 s GLU 201 Ca 0.41 -0.69 -0.13 0.00 0.02 0.00 0.00 54.97 54.58 1x88 s GLU 201 Cb -0.22 -2.87 -0.05 0.00 0.10 0.00 0.00 34.13 31.10 1x88 s GLU 201 CO 0.26 -0.19 0.26 0.42 0.02 0.00 0.00 175.26 176.02 1x88 s ILE 202 N 1.40 5.32 -0.07 -1.63 1.01 0.21 -4.86 121.20 122.59 1x88 s ILE 202 Ca 0.05 0.45 -0.27 0.00 0.00 0.00 0.00 60.65 60.88 1x88 s ILE 202 Cb -0.14 -3.59 -0.03 0.00 0.01 0.00 0.00 42.46 38.71 1x88 s ILE 202 CO -0.06 0.38 0.88 -0.89 0.00 0.00 0.00 174.94 175.25 1x88 s THR 203 N 0.58 4.91 -0.50 2.92 2.01 -1.26 -0.83 115.64 123.47 1x88 s THR 203 Ca 0.14 1.81 -0.16 0.00 0.31 0.00 0.00 61.69 63.79 1x88 s THR 203 Cb -0.13 -4.21 0.09 0.00 0.01 0.00 0.00 72.50 68.27 1x88 s THR 203 CO 0.03 0.14 0.46 -0.69 -0.69 0.00 0.00 174.62 173.87 1x88 s VAL 204 N 1.31 5.18 0.23 3.82 1.01 0.28 -4.93 120.40 127.30 1x88 s VAL 204 Ca 0.45 -1.16 0.14 0.00 0.00 0.00 0.00 61.98 61.41 1x88 s VAL 204 Cb -0.19 -4.23 0.04 0.00 0.00 0.00 0.00 36.38 32.00 1x88 s VAL 204 CO 0.21 -0.72 1.66 0.45 0.00 0.00 0.00 175.10 176.70 1x88 h HIS 205 N 8.84 0.00 -2.65 5.22 3.86 -1.94 -3.37 115.15 125.11 1x88 h HIS 205 Ca -0.29 0.00 0.12 0.00 -1.16 0.00 0.00 60.37 59.04 1x88 h HIS 205 Cb 1.10 0.00 -0.07 0.00 1.06 0.00 0.00 27.41 29.50 1x88 h HIS 205 CO 0.69 0.52 0.36 0.54 0.86 0.00 0.00 177.93 180.89 1x88 s ASN 206 N -6.68 -0.24 0.51 2.45 2.20 -1.26 -5.03 114.94 106.89 1x88 s ASN 206 Ca -0.01 -0.46 0.22 0.00 -0.94 0.00 0.00 52.86 51.68 1x88 s ASN 206 Cb 0.12 0.59 1.32 0.00 -2.00 0.00 0.00 41.25 41.28 1x88 s ASN 206 CO 0.73 -1.08 2.02 0.07 -2.94 0.00 0.00 177.10 175.90 1x88 h LYS 207 N 2.00 0.06 0.00 3.55 2.10 -1.91 -1.75 116.57 120.62 1x88 h LYS 207 Ca -0.22 -0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.42 1x88 h LYS 207 Cb 1.24 -0.01 0.00 0.00 -0.90 0.00 0.00 32.23 32.56 1x88 h LYS 207 CO 0.25 0.04 0.00 -0.25 -2.00 0.00 0.00 179.45 177.49 1x88 n ASP 208 N -4.42 0.00 -0.00 7.07 8.00 -1.26 -2.68 116.55 123.26 1x88 n ASP 208 Ca 0.08 -0.90 0.06 0.00 0.71 0.00 0.00 54.79 54.74 1x88 n ASP 208 Cb 0.48 0.00 -0.08 0.00 -0.02 0.00 0.00 41.12 41.50 1x88 n ASP 208 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1x88 n GLU 209 N -0.91 2.05 0.24 -1.24 1.02 -0.66 -4.74 120.64 116.40 1x88 n GLU 209 Ca 0.15 -0.04 -0.16 0.00 -0.02 0.00 0.00 57.16 57.09 1x88 n GLU 209 Cb 0.07 -1.17 -0.08 0.00 -0.02 0.00 0.00 31.44 30.24 1x88 n GLU 209 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 1x88 h VAL 210 N 0.00 0.21 -0.29 2.62 2.07 -1.60 -3.03 116.25 116.23 1x88 h VAL 210 Ca 0.00 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.55 1x88 h VAL 210 Cb 0.39 0.21 -0.03 0.00 -1.52 0.00 0.00 31.29 30.35 1x88 h VAL 210 CO 0.00 0.00 0.11 0.22 0.02 0.00 0.00 177.57 177.92 1x88 h TYR 211 N -0.79 0.20 -0.72 1.57 -0.00 -1.85 -1.91 116.97 113.47 1x88 h TYR 211 Ca -0.03 0.01 0.00 0.00 -0.00 0.00 0.00 58.73 58.72 1x88 h TYR 211 Cb 0.71 -0.05 -0.04 0.00 -0.00 0.00 0.00 36.73 37.36 1x88 h TYR 211 CO -0.22 0.10 0.46 0.37 -0.00 0.00 0.00 178.16 178.87 1x88 h GLN 212 N 0.25 0.96 -0.38 1.82 4.15 -1.88 0.87 115.11 120.89 1x88 h GLN 212 Ca 0.13 -0.07 -0.03 0.00 0.77 0.00 0.00 58.65 59.45 1x88 h GLN 212 Cb 0.09 -0.21 -0.02 0.00 0.21 0.00 0.00 27.48 27.55 1x88 h GLN 212 CO -0.12 0.65 0.13 0.82 -1.93 0.00 0.00 178.83 178.38 1x88 h ILE 213 N 0.99 1.21 -0.67 2.39 2.04 -1.33 -2.12 117.51 120.02 1x88 h ILE 213 Ca 0.26 -0.67 -0.06 0.00 1.00 0.00 0.00 64.86 65.39 1x88 h ILE 213 Cb -0.09 0.92 -0.03 0.00 -0.74 0.00 0.00 36.82 36.89 1x88 h ILE 213 CO -0.05 0.24 0.16 -0.07 0.00 0.00 0.00 178.15 178.43 1x88 h LEU 214 N 0.47 1.01 -1.21 1.44 3.38 -0.59 -2.83 115.31 116.98 1x88 h LEU 214 Ca 0.13 -0.23 0.01 0.00 0.09 0.00 0.00 57.88 57.87 1x88 h LEU 214 Cb 0.24 -0.27 -0.04 0.00 0.09 0.00 0.00 40.66 40.68 1x88 h LEU 214 CO -0.01 0.98 0.53 -0.33 0.09 0.00 0.00 178.44 179.70 1x88 h GLU 215 N 0.99 1.05 -0.58 1.13 5.08 -0.63 -1.60 114.58 120.02 1x88 h GLU 215 Ca 0.21 -0.07 -0.03 0.00 -1.00 0.00 0.00 59.36 58.47 1x88 h GLU 215 Cb 0.36 -0.24 -0.03 0.00 0.50 0.00 0.00 28.75 29.35 1x88 h GLU 215 CO 0.00 0.70 0.23 0.87 -1.00 0.00 0.00 179.01 179.82 1x88 h LYS 216 N 1.08 0.86 -0.66 2.33 1.57 -1.15 -0.63 116.57 119.98 1x88 h LYS 216 Ca 0.29 -0.15 -0.07 0.00 -1.87 0.00 0.00 60.65 58.85 1x88 h LYS 216 Cb -0.12 -0.14 -0.03 0.00 0.08 0.00 0.00 32.23 32.02 1x88 h LYS 216 CO -0.06 0.74 0.13 0.78 -0.57 0.00 0.00 179.45 180.46 1x88 h GLY 217 N 0.80 1.15 0.99 3.86 0.00 -1.30 -1.77 103.07 106.80 1x88 h GLY 217 Ca 0.19 -0.74 -0.02 0.00 0.00 0.00 0.00 47.33 46.77 1x88 h GLY 217 CO -0.02 0.68 0.28 0.00 0.00 0.00 0.00 176.54 177.49 1x88 h ALA 218 N 1.12 0.76 -0.74 3.60 0.00 -0.90 -0.88 119.26 122.22 1x88 h ALA 218 Ca 0.20 -0.13 -0.04 0.00 0.00 0.00 0.00 54.91 54.94 1x88 h ALA 218 Cb 0.40 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.93 1x88 h ALA 218 CO 0.01 0.32 0.31 0.00 0.00 0.00 0.00 179.25 179.89 1x88 h ALA 219 N 1.11 0.96 -0.23 0.00 0.00 -0.88 -2.38 119.26 117.84 1x88 h ALA 219 Ca 0.20 -0.18 -0.11 0.00 0.00 0.00 0.00 54.91 54.82 1x88 h ALA 219 Cb 0.12 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 1x88 h ALA 219 CO -0.02 0.57 -0.33 -0.22 0.00 0.00 0.00 179.25 179.24 1x88 h LYS 220 N 1.06 0.48 0.00 0.00 3.64 -0.98 -2.60 116.57 118.17 1x88 h LYS 220 Ca 0.25 -0.21 -0.06 0.00 -1.27 0.00 0.00 60.65 59.36 1x88 h LYS 220 Cb 0.18 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 31.98 1x88 h LYS 220 CO -0.02 0.75 -0.28 0.00 -2.27 0.00 0.00 179.45 177.63 1x88 h ARG 221 N 0.41 0.00 -0.44 1.90 3.08 -0.75 -1.81 114.38 116.78 1x88 h ARG 221 Ca 0.05 0.00 -0.09 0.00 0.07 0.00 0.00 59.98 60.01 1x88 h ARG 221 Cb 0.78 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.81 1x88 h ARG 221 CO 0.06 0.28 -0.10 1.15 -1.07 0.00 0.00 179.97 180.29 1x88 h THR 222 N 0.00 1.26 -0.52 2.04 2.02 -1.04 -0.39 112.91 116.28 1x88 h THR 222 Ca -0.00 -1.15 -0.09 0.00 0.77 0.00 0.00 66.41 65.93 1x88 h THR 222 Cb 0.54 1.02 -0.02 0.00 -1.74 0.00 0.00 68.15 67.95 1x88 h THR 222 CO 0.04 0.40 -0.05 0.74 0.37 0.00 0.00 175.52 177.01 1x88 h THR 223 N 0.71 1.26 -0.68 3.16 2.02 -1.26 -2.39 112.91 115.73 1x88 h THR 223 Ca 0.12 -1.15 -0.03 0.00 0.77 0.00 0.00 66.41 66.12 1x88 h THR 223 Cb 0.58 0.92 -0.03 0.00 -1.74 0.00 0.00 68.15 67.87 1x88 h THR 223 CO 0.04 0.41 0.30 0.00 0.37 0.00 0.00 175.52 176.63 1x88 h ALA 224 N 1.10 0.88 -0.37 6.16 0.00 -0.78 -2.63 119.26 123.62 1x88 h ALA 224 Ca 0.15 -0.16 -0.04 0.00 0.00 0.00 0.00 54.91 54.85 1x88 h ALA 224 Cb 0.57 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 18.07 1x88 h ALA 224 CO 0.03 0.48 0.06 0.00 0.00 0.00 0.00 179.25 179.82 1x88 h ALA 225 N 1.14 1.43 -0.18 0.00 0.00 -0.78 0.20 119.26 121.06 1x88 h ALA 225 Ca 0.23 -0.17 -0.11 0.00 0.00 0.00 0.00 54.91 54.86 1x88 h ALA 225 Cb 0.17 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 1x88 h ALA 225 CO -0.02 0.41 -0.37 1.15 0.00 0.00 0.00 179.25 180.42 1x88 h THR 226 N 0.53 1.30 0.13 0.00 2.02 -1.10 -3.31 112.91 112.49 1x88 h THR 226 Ca 0.12 -1.48 -0.34 0.00 0.77 0.00 0.00 66.41 65.48 1x88 h THR 226 Cb 0.25 1.56 -0.01 0.00 -1.74 0.00 0.00 68.15 68.22 1x88 h THR 226 CO 0.00 0.46 -1.76 0.25 0.37 0.00 0.00 175.52 174.84 1x88 h LEU 227 N 0.34 0.44 -8.82 2.58 6.46 -1.05 -3.47 115.31 111.79 1x88 h LEU 227 Ca 0.04 -0.75 -0.65 0.00 -0.12 0.00 0.00 57.88 56.40 1x88 h LEU 227 Cb 0.81 -0.14 -0.23 0.00 -0.73 0.00 0.00 40.66 40.37 1x88 h LEU 227 CO 0.07 1.64 -0.70 -0.04 -0.62 0.00 0.00 178.44 178.79 1x88 s MET 228 N -2.59 3.43 0.21 1.25 -1.94 0.64 -5.08 119.30 115.23 1x88 s MET 228 Ca -0.15 -0.57 -0.32 0.00 -1.71 0.00 0.00 55.69 52.94 1x88 s MET 228 Cb 0.06 -2.77 -0.12 0.00 2.01 0.00 0.00 34.83 34.01 1x88 s MET 228 CO 0.83 0.31 1.68 0.09 -0.01 0.00 0.00 175.02 177.91 1x88 n ASN 229 N 3.31 3.78 -4.26 3.03 3.02 -1.26 -2.65 115.26 120.23 1x88 n ASN 229 Ca -0.18 1.08 -0.37 0.00 -0.03 0.00 0.00 54.58 55.08 1x88 n ASN 229 Cb 0.53 -1.55 -0.04 0.00 -0.61 0.00 0.00 39.78 38.11 1x88 n ASN 229 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1x88 n ALA 230 N 3.62 -1.32 -0.13 5.41 0.00 -1.26 -4.84 120.51 121.99 1x88 n ALA 230 Ca 0.15 -0.06 -0.04 0.00 0.00 0.00 0.00 53.44 53.49 1x88 n ALA 230 Cb 0.34 -3.16 0.02 0.00 0.00 0.00 0.00 19.45 16.64 1x88 n ALA 230 CO 0.00 0.00 0.00 -0.92 0.00 0.00 0.00 177.50 176.58 1x88 h TYR 231 N -1.44 -0.26 0.00 0.00 5.03 -1.79 -0.63 116.97 117.88 1x88 h TYR 231 Ca -0.60 0.04 -0.01 0.00 2.58 0.00 0.00 58.73 60.74 1x88 h TYR 231 Cb 1.38 0.18 -0.00 0.00 1.55 0.00 0.00 36.73 39.84 1x88 h TYR 231 CO 0.64 -0.20 -0.05 0.66 -1.32 0.00 0.00 178.16 177.89 1x88 h SER 232 N -0.01 0.00 0.00 -2.11 4.64 -1.89 -1.40 113.55 112.78 1x88 h SER 232 Ca 0.21 0.00 -0.08 0.00 -0.47 0.00 0.00 61.79 61.45 1x88 h SER 232 Cb 0.33 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.40 1x88 h SER 232 CO -0.45 0.05 -1.93 -1.54 -0.87 0.00 0.00 176.83 172.09 1x88 n SER 233 N -3.54 0.77 0.02 4.97 3.41 -0.86 -4.54 113.62 113.85 1x88 n SER 233 Ca -0.02 0.00 0.11 0.00 -0.26 0.00 0.00 58.87 58.70 1x88 n SER 233 Cb 0.16 1.61 -0.10 0.00 -0.26 0.00 0.00 64.21 65.62 1x88 n SER 233 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1x88 n ARG 234 N -2.27 0.49 -2.61 4.33 1.74 -0.30 -0.81 116.66 117.22 1x88 n ARG 234 Ca -0.10 -0.08 -0.30 0.00 -0.77 0.00 0.00 57.85 56.60 1x88 n ARG 234 Cb 0.63 -1.58 -0.02 0.00 -1.02 0.00 0.00 32.46 30.48 1x88 n ARG 234 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 1x88 s SER 235 N -4.33 6.40 -0.09 0.55 1.04 -0.54 -4.71 113.70 112.03 1x88 s SER 235 Ca -0.02 1.14 0.02 0.00 0.48 0.00 0.00 55.95 57.56 1x88 s SER 235 Cb 0.14 -2.33 -0.02 0.00 0.10 0.00 0.00 66.02 63.90 1x88 s SER 235 CO 0.86 -0.54 -0.14 -1.00 0.98 0.00 0.00 173.24 173.41 1x88 s HIS 236 N -2.63 2.75 -0.04 5.02 3.76 0.02 -3.05 115.29 121.12 1x88 s HIS 236 Ca 0.51 -0.38 0.06 0.00 -0.15 0.00 0.00 55.06 55.10 1x88 s HIS 236 Cb -0.10 -1.73 -0.01 0.00 1.11 0.00 0.00 32.58 31.85 1x88 s HIS 236 CO 0.39 0.00 -0.23 -1.54 -0.85 0.00 0.00 174.74 172.52 1x88 s SER 237 N -0.23 2.75 -0.28 1.40 1.04 -0.51 -0.16 113.70 117.71 1x88 s SER 237 Ca 0.01 -0.45 0.03 0.00 0.48 0.00 0.00 55.95 56.02 1x88 s SER 237 Cb -0.13 -0.63 0.07 0.00 0.10 0.00 0.00 66.02 65.43 1x88 s SER 237 CO 0.03 0.23 -0.05 -0.69 0.98 0.00 0.00 173.24 173.74 1x88 s VAL 238 N -0.22 2.11 -0.31 5.02 1.01 0.16 -1.30 120.40 126.86 1x88 s VAL 238 Ca -0.00 -1.79 -0.14 0.00 0.00 0.00 0.00 61.98 60.04 1x88 s VAL 238 Cb -0.12 -2.33 -0.02 0.00 0.00 0.00 0.00 36.38 33.90 1x88 s VAL 238 CO 0.02 -0.21 0.32 0.12 0.00 0.00 0.00 175.10 175.35 1x88 s PHE 239 N 1.08 3.22 -0.07 5.22 2.19 -0.33 -1.25 117.98 128.04 1x88 s PHE 239 Ca -0.03 0.08 0.01 0.00 0.33 0.00 0.00 56.93 57.33 1x88 s PHE 239 Cb -0.20 -2.58 -0.03 0.00 -1.31 0.00 0.00 43.02 38.91 1x88 s PHE 239 CO -0.06 -0.33 -0.10 -1.12 1.83 0.00 0.00 175.22 175.43 1x88 s SER 240 N 1.72 4.38 -0.14 6.13 0.01 0.01 -0.22 113.70 125.59 1x88 s SER 240 Ca 0.11 -0.12 0.01 0.00 1.31 0.00 0.00 55.95 57.27 1x88 s SER 240 Cb -0.16 -1.14 0.02 0.00 0.21 0.00 0.00 66.02 64.95 1x88 s SER 240 CO 0.11 0.33 -0.17 -0.69 0.41 0.00 0.00 173.24 173.22 1x88 s VAL 241 N -0.60 1.73 -0.12 3.43 1.01 0.06 -1.55 120.40 124.36 1x88 s VAL 241 Ca 0.09 -0.76 0.01 0.00 0.00 0.00 0.00 61.98 61.32 1x88 s VAL 241 Cb -0.12 -1.57 -0.01 0.00 0.00 0.00 0.00 36.38 34.68 1x88 s VAL 241 CO 0.02 0.49 -0.18 -0.89 0.00 0.00 0.00 175.10 174.54 1x88 s THR 242 N 1.12 2.61 -0.23 3.92 2.01 0.14 -0.62 115.64 124.59 1x88 s THR 242 Ca -0.02 -0.82 -0.00 0.00 0.31 0.00 0.00 61.69 61.16 1x88 s THR 242 Cb -0.14 -2.06 0.03 0.00 0.01 0.00 0.00 72.50 70.33 1x88 s THR 242 CO -0.06 0.54 -0.11 -0.63 -0.69 0.00 0.00 174.62 173.67 1x88 s ILE 243 N 0.42 2.52 -0.22 1.82 1.01 0.35 -1.38 121.20 125.73 1x88 s ILE 243 Ca -0.13 -1.09 -0.13 0.00 0.00 0.00 0.00 60.65 59.29 1x88 s ILE 243 Cb -0.17 -2.25 -0.04 0.00 0.01 0.00 0.00 42.46 40.01 1x88 s ILE 243 CO 0.06 0.27 0.29 -1.00 0.00 0.00 0.00 174.94 174.55 1x88 s HIS 244 N 1.28 3.35 0.06 3.97 3.76 -0.67 -1.34 115.29 125.70 1x88 s HIS 244 Ca 0.00 0.45 0.08 0.00 -0.15 0.00 0.00 55.06 55.44 1x88 s HIS 244 Cb -0.16 -2.41 -0.03 0.00 1.11 0.00 0.00 32.58 31.10 1x88 s HIS 244 CO -0.07 0.04 -0.21 -1.64 -0.85 0.00 0.00 174.74 172.01 1x88 s MET 245 N 1.15 1.28 -0.03 1.40 -1.94 0.16 -1.42 119.30 119.90 1x88 s MET 245 Ca 0.14 -1.02 -0.01 0.00 -1.71 0.00 0.00 55.69 53.09 1x88 s MET 245 Cb -0.14 -1.45 0.03 0.00 2.01 0.00 0.00 34.83 35.28 1x88 s MET 245 CO 0.06 0.36 0.04 0.21 -0.01 0.00 0.00 175.02 175.68 1x88 s LYS 246 N -1.44 -0.04 0.08 2.03 2.20 0.39 -2.04 119.74 120.92 1x88 s LYS 246 Ca 0.07 0.27 0.06 0.00 -0.36 0.00 0.00 55.97 56.01 1x88 s LYS 246 Cb -0.09 -0.38 -0.04 0.00 -1.51 0.00 0.00 37.83 35.81 1x88 s LYS 246 CO 0.03 -0.24 -0.10 -1.21 -0.36 0.00 0.00 175.35 173.47 1x88 s GLU 247 N 1.57 2.21 -0.16 4.03 2.02 0.80 -0.89 118.70 128.28 1x88 s GLU 247 Ca -0.03 -0.96 0.01 0.00 0.02 0.00 0.00 54.97 54.01 1x88 s GLU 247 Cb -0.13 -2.33 0.02 0.00 0.10 0.00 0.00 34.13 31.79 1x88 s GLU 247 CO -0.03 0.53 -0.19 0.99 0.02 0.00 0.00 175.26 176.58 1x88 s THR 248 N -1.15 1.93 1.03 3.63 2.01 -1.26 0.11 115.64 121.94 1x88 s THR 248 Ca 0.20 -0.87 -0.14 0.00 0.31 0.00 0.00 61.69 61.19 1x88 s THR 248 Cb -0.11 -1.74 0.20 0.00 0.01 0.00 0.00 72.50 70.86 1x88 s THR 248 CO 0.12 0.52 1.12 0.42 -0.69 0.00 0.00 174.62 176.11 1x88 s THR 249 N 1.20 1.90 -0.44 -0.82 -4.23 0.12 -4.87 115.64 108.50 1x88 s THR 249 Ca 0.01 0.00 0.21 0.00 -1.18 0.00 0.00 61.69 60.73 1x88 s THR 249 Cb -0.14 -2.60 0.21 0.00 1.34 0.00 0.00 72.50 71.32 1x88 s THR 249 CO -0.09 0.00 1.63 0.00 -0.54 0.00 0.00 174.62 175.62 1x88 n ILE 250 N -4.19 1.00 -0.55 2.99 3.06 -1.26 -1.34 119.36 119.07 1x88 n ILE 250 Ca 0.08 0.45 0.09 0.00 -2.50 0.00 0.00 62.75 60.86 1x88 n ILE 250 Cb 0.59 -1.40 0.30 0.00 0.54 0.00 0.00 39.64 39.67 1x88 n ILE 250 CO 0.00 0.00 0.00 0.47 -2.50 0.00 0.00 176.55 174.52 1x88 n ASP 251 N -2.15 4.22 0.00 9.51 10.43 -1.26 -4.95 116.55 132.35 1x88 n ASP 251 Ca 0.01 -2.37 0.00 0.00 2.57 0.00 0.00 54.79 55.00 1x88 n ASP 251 Cb 0.13 -0.50 0.00 0.00 1.84 0.00 0.00 41.12 42.60 1x88 n ASP 251 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 1x88 n GLY 252 N 0.89 1.26 3.76 0.44 0.00 -0.45 -5.03 105.19 106.07 1x88 n GLY 252 Ca 0.22 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.84 1x88 n GLY 252 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1x88 s GLU 253 N -0.14 4.60 -0.19 1.61 2.12 -1.26 -4.71 118.70 120.73 1x88 s GLU 253 Ca 0.00 1.81 -0.13 0.00 0.36 0.00 0.00 54.97 57.01 1x88 s GLU 253 Cb 0.00 -3.14 -0.05 0.00 0.26 0.00 0.00 34.13 31.20 1x88 s GLU 253 CO 0.00 0.17 0.25 -1.21 -0.54 0.00 0.00 175.26 173.93 1x88 s GLU 254 N -1.53 4.20 -0.19 4.30 2.02 -1.26 0.14 118.70 126.38 1x88 s GLU 254 Ca 0.45 -0.02 -0.04 0.00 0.02 0.00 0.00 54.97 55.38 1x88 s GLU 254 Cb -0.32 -3.46 -0.02 0.00 0.10 0.00 0.00 34.13 30.43 1x88 s GLU 254 CO 0.41 0.17 -0.02 -0.51 0.02 0.00 0.00 175.26 175.33 1x88 s LEU 255 N 0.70 3.19 -0.01 1.80 1.43 0.31 -4.93 118.68 121.16 1x88 s LEU 255 Ca 0.13 -0.21 0.03 0.00 -1.03 0.00 0.00 54.13 53.06 1x88 s LEU 255 Cb -0.13 -1.79 -0.03 0.00 0.03 0.00 0.00 46.19 44.27 1x88 s LEU 255 CO 0.03 0.09 -0.09 -0.69 0.23 0.00 0.00 176.35 175.92 1x88 s VAL 256 N 0.84 3.48 -0.11 -1.59 1.01 -1.26 -0.14 120.40 122.63 1x88 s VAL 256 Ca -0.00 -0.77 -0.13 0.00 0.00 0.00 0.00 61.98 61.08 1x88 s VAL 256 Cb -0.14 -2.48 0.03 0.00 0.00 0.00 0.00 36.38 33.79 1x88 s VAL 256 CO 0.02 0.44 0.36 -1.59 0.00 0.00 0.00 175.10 174.33 1x88 s LYS 257 N -1.24 0.49 -0.09 2.72 -2.85 -0.87 -5.02 119.74 112.89 1x88 s LYS 257 Ca 0.15 0.34 0.01 0.00 -1.00 0.00 0.00 55.97 55.47 1x88 s LYS 257 Cb -0.11 0.23 0.02 0.00 -2.06 0.00 0.00 37.83 35.91 1x88 s LYS 257 CO 0.05 -0.09 -0.11 0.42 0.10 0.00 0.00 175.35 175.73 1x88 s ILE 258 N -0.18 1.13 0.01 3.79 1.01 -1.26 -0.67 121.20 125.03 1x88 s ILE 258 Ca -0.03 -0.42 0.08 0.00 0.00 0.00 0.00 60.65 60.27 1x88 s ILE 258 Cb -0.03 -1.07 -0.03 0.00 0.01 0.00 0.00 42.46 41.34 1x88 s ILE 258 CO 0.02 0.37 -0.23 -0.83 0.00 0.00 0.00 174.94 174.26 1x88 s GLY 259 N 1.10 1.41 -0.01 6.18 0.00 -0.45 -4.07 107.32 111.47 1x88 s GLY 259 Ca -0.06 -1.18 0.03 0.00 0.00 0.00 0.00 44.72 43.51 1x88 s GLY 259 CO -0.02 -1.03 -0.09 1.25 0.00 0.00 0.00 173.10 173.21 1x88 s LYS 260 N -1.03 0.82 -0.10 2.90 2.20 -1.10 -0.49 119.74 122.95 1x88 s LYS 260 Ca 0.12 -0.32 0.01 0.00 -0.36 0.00 0.00 55.97 55.42 1x88 s LYS 260 Cb -0.10 -0.79 0.02 0.00 -1.51 0.00 0.00 37.83 35.45 1x88 s LYS 260 CO 0.02 0.17 -0.12 -1.17 -0.36 0.00 0.00 175.35 173.88 1x88 s LEU 261 N -0.06 1.56 -0.21 5.43 2.96 0.21 -0.59 118.68 127.97 1x88 s LEU 261 Ca 0.01 -0.36 -0.07 0.00 -0.22 0.00 0.00 54.13 53.49 1x88 s LEU 261 Cb -0.05 -0.95 -0.03 0.00 0.50 0.00 0.00 46.19 45.65 1x88 s LEU 261 CO -0.00 -0.02 0.06 0.20 -1.32 0.00 0.00 176.35 175.27 1x88 s ASN 262 N 1.12 5.30 -0.34 3.68 0.02 -0.09 -0.76 114.94 123.87 1x88 s ASN 262 Ca -0.05 -0.08 -0.01 0.00 -1.02 0.00 0.00 52.86 51.69 1x88 s ASN 262 Cb -0.14 -1.93 0.08 0.00 0.02 0.00 0.00 41.25 39.28 1x88 s ASN 262 CO -0.02 0.07 0.07 -0.76 0.02 0.00 0.00 177.10 176.48 1x88 s LEU 263 N 0.98 4.44 -0.22 0.60 1.43 0.69 -0.76 118.68 125.84 1x88 s LEU 263 Ca 0.04 -1.62 -0.06 0.00 -1.03 0.00 0.00 54.13 51.45 1x88 s LEU 263 Cb -0.14 -1.74 -0.03 0.00 0.03 0.00 0.00 46.19 44.31 1x88 s LEU 263 CO 0.03 -0.37 0.04 -0.69 0.23 0.00 0.00 176.35 175.59 1x88 s VAL 264 N 1.17 4.27 -0.51 -1.59 1.01 0.27 -1.19 120.40 123.84 1x88 s VAL 264 Ca 0.01 -0.20 -0.10 0.00 0.00 0.00 0.00 61.98 61.70 1x88 s VAL 264 Cb -0.21 -2.96 0.13 0.00 0.00 0.00 0.00 36.38 33.34 1x88 s VAL 264 CO -0.03 0.39 0.39 -0.62 0.00 0.00 0.00 175.10 175.23 1x88 s ASP 265 N 1.16 5.77 0.71 3.32 -1.08 -0.42 -0.62 116.67 125.51 1x88 s ASP 265 Ca 0.04 -2.01 -0.11 0.00 -0.52 0.00 0.00 52.55 49.94 1x88 s ASP 265 Cb -0.14 -2.03 0.02 0.00 -1.46 0.00 0.00 42.92 39.31 1x88 s ASP 265 CO 0.03 -0.68 1.07 -0.76 0.52 0.00 0.00 175.17 175.35 1x88 s LEU 266 N 1.22 3.16 0.72 -1.34 1.43 -1.04 -1.43 118.68 121.40 1x88 s LEU 266 Ca 0.07 1.73 -0.15 0.00 -1.03 0.00 0.00 54.13 54.75 1x88 s LEU 266 Cb -0.25 -4.51 0.03 0.00 0.03 0.00 0.00 46.19 41.49 1x88 s LEU 266 CO -0.01 -1.61 1.19 0.00 0.23 0.00 0.00 176.35 176.15 1x88 s ALA 267 N -2.89 2.17 0.35 4.21 0.00 -1.17 -4.88 121.76 119.55 1x88 s ALA 267 Ca 0.60 0.80 -0.28 0.00 0.00 0.00 0.00 51.96 53.08 1x88 s ALA 267 Cb -0.16 -3.44 -0.12 0.00 0.00 0.00 0.00 23.12 19.41 1x88 s ALA 267 CO 0.52 -1.78 1.40 0.41 0.00 0.00 0.00 175.76 176.31 1x88 n GLY 268 N 0.20 0.89 0.14 0.00 0.00 0.01 -4.72 105.19 101.71 1x88 n GLY 268 Ca 0.13 0.33 0.14 0.00 0.00 0.00 0.00 46.02 46.62 1x88 n GLY 268 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1x88 n SER 269 N 0.79 0.55 -4.73 1.61 3.41 -0.82 -4.85 113.62 109.57 1x88 n SER 269 Ca 0.04 -0.72 -0.36 0.00 -0.26 0.00 0.00 58.87 57.57 1x88 n SER 269 Cb 0.37 -0.05 0.07 0.00 -0.26 0.00 0.00 64.21 64.34 1x88 n SER 269 CO 0.00 0.00 0.00 -1.83 -0.16 0.00 0.00 175.04 173.05 1x88 s GLU 270 N -2.38 2.51 -0.70 4.33 1.03 -1.26 -4.91 118.70 117.32 1x88 s GLU 270 Ca 0.31 1.95 -0.24 0.00 0.03 0.00 0.00 54.97 57.02 1x88 s GLU 270 Cb 0.20 -1.85 0.05 0.00 -0.80 0.00 0.00 34.13 31.73 1x88 s GLU 270 CO 0.45 -1.60 1.09 -0.80 -1.33 0.00 0.00 175.26 173.08 1x88 s ASN 271 N -1.58 6.17 -0.09 0.83 0.02 -1.26 -5.07 114.94 113.96 1x88 s ASN 271 Ca 0.80 -0.78 -0.00 0.00 -1.02 0.00 0.00 52.86 51.85 1x88 s ASN 271 Cb -0.34 -2.48 0.02 0.00 0.02 0.00 0.00 41.25 38.48 1x88 s ASN 271 CO 0.40 -1.60 -0.06 0.21 0.02 0.00 0.00 177.10 176.07 1x88 s ASN 287 N 3.71 1.92 -0.24 -1.22 3.04 -1.26 -5.22 114.94 115.67 1x88 s ASN 287 Ca 0.27 -0.24 -0.07 0.00 0.04 0.00 0.00 52.86 52.87 1x88 s ASN 287 Cb -0.13 -0.72 0.01 0.00 -1.54 0.00 0.00 41.25 38.87 1x88 s ASN 287 CO 0.12 -0.12 0.26 -0.38 -3.04 0.00 0.00 177.10 173.94 1x88 n ILE 288 N 4.84 -7.79 -3.42 -5.21 2.08 -1.26 -4.97 119.36 103.63 1x88 n ILE 288 Ca -0.13 0.72 -0.44 0.00 0.56 0.00 0.00 62.75 63.47 1x88 n ILE 288 Cb 0.50 -5.97 -0.05 0.00 -0.75 0.00 0.00 39.64 33.37 1x88 n ILE 288 CO 0.00 0.00 0.00 0.21 0.56 0.00 0.00 176.55 177.32 1x88 s ASN 289 N -1.70 6.22 0.26 4.38 3.04 -1.26 -4.94 114.94 120.94 1x88 s ASN 289 Ca 0.11 -2.39 -0.01 0.00 0.04 0.00 0.00 52.86 50.61 1x88 s ASN 289 Cb -0.03 -2.12 0.53 0.00 -1.54 0.00 0.00 41.25 38.09 1x88 s ASN 289 CO 0.48 -0.62 1.77 -0.61 -3.04 0.00 0.00 177.10 175.07 1x88 h GLN 290 N 8.02 0.62 -0.48 0.43 5.75 -1.97 0.44 115.11 127.93 1x88 h GLN 290 Ca -0.06 -0.04 -0.13 0.00 -0.15 0.00 0.00 58.65 58.28 1x88 h GLN 290 Cb 1.05 -0.14 -0.01 0.00 1.07 0.00 0.00 27.48 29.44 1x88 h GLN 290 CO 0.83 0.41 -0.20 0.77 -2.65 0.00 0.00 178.83 177.99 1x88 h SER 291 N 0.64 0.98 -0.41 -0.69 0.02 -1.92 0.03 113.55 112.20 1x88 h SER 291 Ca 0.46 -0.36 -0.10 0.00 -0.84 0.00 0.00 61.79 60.95 1x88 h SER 291 Cb 0.65 -0.27 -0.01 0.00 0.14 0.00 0.00 62.40 62.90 1x88 h SER 291 CO -0.36 1.14 -0.13 0.25 -1.14 0.00 0.00 176.83 176.59 1x88 h LEU 292 N 0.83 0.83 -0.63 5.07 5.85 -1.78 0.08 115.31 125.56 1x88 h LEU 292 Ca 0.11 -0.38 -0.02 0.00 0.84 0.00 0.00 57.88 58.43 1x88 h LEU 292 Cb 0.76 -0.23 -0.03 0.00 0.37 0.00 0.00 40.66 41.54 1x88 h LEU 292 CO 0.06 1.02 0.30 -0.07 -0.34 0.00 0.00 178.44 179.41 1x88 h LEU 293 N 0.63 0.83 -0.62 2.25 3.38 -0.82 -2.64 115.31 118.33 1x88 h LEU 293 Ca 0.10 -0.13 -0.13 0.00 0.09 0.00 0.00 57.88 57.81 1x88 h LEU 293 Cb 0.67 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.20 1x88 h LEU 293 CO 0.05 0.73 -0.32 0.74 0.09 0.00 0.00 178.44 179.73 1x88 h THR 294 N 0.87 1.28 -0.55 0.22 2.02 -0.83 -2.16 112.91 113.76 1x88 h THR 294 Ca 0.22 -1.46 0.05 0.00 0.77 0.00 0.00 66.41 65.99 1x88 h THR 294 Cb 0.12 1.36 -0.05 0.00 -1.74 0.00 0.00 68.15 67.84 1x88 h THR 294 CO -0.03 0.48 0.28 0.25 0.37 0.00 0.00 175.52 176.87 1x88 h LEU 295 N 0.63 0.39 -0.79 2.58 5.85 -0.72 0.15 115.31 123.39 1x88 h LEU 295 Ca 0.07 0.04 -0.05 0.00 0.84 0.00 0.00 57.88 58.77 1x88 h LEU 295 Cb 0.84 -0.04 -0.03 0.00 0.37 0.00 0.00 40.66 41.80 1x88 h LEU 295 CO 0.07 0.26 0.29 1.23 -0.34 0.00 0.00 178.44 179.95 1x88 h GLY 296 N 0.53 1.27 1.82 3.75 0.00 -1.24 -1.25 103.07 107.96 1x88 h GLY 296 Ca 0.25 -0.71 -0.11 0.00 0.00 0.00 0.00 47.33 46.75 1x88 h GLY 296 CO -0.18 0.67 -0.47 3.21 0.00 0.00 0.00 176.54 179.77 1x88 h ARG 297 N 1.15 0.19 -0.25 4.80 3.08 -0.71 -1.23 114.38 121.40 1x88 h ARG 297 Ca 0.26 -0.10 -0.07 0.00 0.07 0.00 0.00 59.98 60.14 1x88 h ARG 297 Cb 0.25 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.29 1x88 h ARG 297 CO -0.02 0.63 -0.10 0.28 -1.07 0.00 0.00 179.97 179.69 1x88 h VAL 298 N 0.16 1.29 -0.61 2.04 2.07 -0.36 -0.83 116.25 120.00 1x88 h VAL 298 Ca 0.01 -1.15 -0.01 0.00 0.82 0.00 0.00 66.70 66.37 1x88 h VAL 298 Cb 0.89 1.51 -0.03 0.00 -1.52 0.00 0.00 31.29 32.15 1x88 h VAL 298 CO 0.07 0.36 0.33 0.40 0.02 0.00 0.00 177.57 178.75 1x88 h ILE 299 N 0.25 1.20 -0.48 4.57 2.04 -1.05 -0.56 117.51 123.48 1x88 h ILE 299 Ca 0.06 -0.51 -0.02 0.00 1.00 0.00 0.00 64.86 65.38 1x88 h ILE 299 Cb 0.59 0.42 -0.02 0.00 -0.74 0.00 0.00 36.82 37.07 1x88 h ILE 299 CO 0.03 0.22 0.21 0.74 0.00 0.00 0.00 178.15 179.35 1x88 h THR 300 N 0.83 1.20 -0.92 -0.27 2.02 -1.14 -0.96 112.91 113.67 1x88 h THR 300 Ca 0.21 -0.58 -0.01 0.00 0.77 0.00 0.00 66.41 66.80 1x88 h THR 300 Cb 0.06 0.70 -0.04 0.00 -1.74 0.00 0.00 68.15 67.12 1x88 h THR 300 CO -0.03 0.22 0.52 0.00 0.37 0.00 0.00 175.52 176.60 1x88 h ALA 301 N 1.06 1.18 -0.14 6.16 0.00 -0.80 -1.00 119.26 125.71 1x88 h ALA 301 Ca 0.16 -0.13 -0.04 0.00 0.00 0.00 0.00 54.91 54.91 1x88 h ALA 301 Cb 0.15 -0.37 -0.00 0.00 0.00 0.00 0.00 17.79 17.57 1x88 h ALA 301 CO -0.02 0.67 -0.06 -0.07 0.00 0.00 0.00 179.25 179.77 1x88 h LEU 302 N 1.28 0.30 -0.96 0.00 3.38 -0.78 0.33 115.31 118.86 1x88 h LEU 302 Ca 0.33 -0.40 -0.11 0.00 0.09 0.00 0.00 57.88 57.79 1x88 h LEU 302 Cb 0.00 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 40.66 1x88 h LEU 302 CO -0.05 0.64 -0.41 -0.37 0.09 0.00 0.00 178.44 178.33 1x88 h VAL 303 N -0.04 1.31 -0.16 1.22 -1.51 -1.07 -2.22 116.25 113.78 1x88 h VAL 303 Ca 0.03 -1.52 0.00 0.00 -1.23 0.00 0.00 66.70 63.98 1x88 h VAL 303 Cb 0.52 1.70 0.00 0.00 -2.13 0.00 0.00 31.29 31.38 1x88 h VAL 303 CO 0.02 0.45 0.00 -0.62 -1.23 0.00 0.00 177.57 176.19 1x88 n GLU 304 N -4.03 1.61 -3.18 5.19 1.02 -0.39 -4.91 120.64 115.96 1x88 n GLU 304 Ca -0.02 -0.93 -0.21 0.00 -0.02 0.00 0.00 57.16 55.98 1x88 n GLU 304 Cb 0.48 -1.35 0.00 0.00 -0.02 0.00 0.00 31.44 30.55 1x88 n GLU 304 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 1x88 n ARG 305 N 0.17 -3.49 -2.25 3.49 1.74 -0.81 -4.92 116.66 110.58 1x88 n ARG 305 Ca 0.15 0.56 -0.39 0.00 -0.77 0.00 0.00 57.85 57.40 1x88 n ARG 305 Cb 0.28 -5.28 -0.02 0.00 -1.02 0.00 0.00 32.46 26.42 1x88 n ARG 305 CO 0.00 0.00 0.00 0.95 -1.52 0.00 0.00 177.63 177.06 1x88 s THR 306 N -2.93 3.04 0.17 0.55 -4.23 0.04 -4.94 115.64 107.35 1x88 s THR 306 Ca 0.33 0.94 -0.17 0.00 -1.18 0.00 0.00 61.69 61.61 1x88 s THR 306 Cb -0.17 -3.55 0.11 0.00 1.34 0.00 0.00 72.50 70.23 1x88 s THR 306 CO 0.40 0.14 1.66 -0.65 -0.54 0.00 0.00 174.62 175.64 1x88 h PRO 307 N 2.95 -0.01 -5.49 3.99 0.11 -1.91 -3.41 132.00 128.24 1x88 h PRO 307 Ca -0.49 0.00 -0.59 0.00 0.11 0.00 0.00 66.00 65.03 1x88 h PRO 307 Cb 1.23 0.00 -0.10 0.00 0.11 0.00 0.00 31.00 32.24 1x88 h PRO 307 CO 0.64 -0.01 -0.29 -1.58 -0.21 0.00 0.00 178.00 176.55 1x88 s HIS 308 N -6.22 3.44 -0.24 0.65 5.65 -1.26 -5.06 115.29 112.26 1x88 s HIS 308 Ca -0.14 0.61 -0.02 0.00 0.25 0.00 0.00 55.06 55.76 1x88 s HIS 308 Cb 0.15 -2.40 0.01 0.00 -1.18 0.00 0.00 32.58 29.17 1x88 s HIS 308 CO 0.71 0.17 -0.06 0.08 -0.65 0.00 0.00 174.74 175.00 1x88 s VAL 309 N 0.67 3.03 0.00 0.89 1.01 -1.26 -4.90 120.40 119.84 1x88 s VAL 309 Ca 0.18 -0.82 -0.01 0.00 0.00 0.00 0.00 61.98 61.32 1x88 s VAL 309 Cb -0.14 -2.46 -0.06 0.00 0.00 0.00 0.00 36.38 33.72 1x88 s VAL 309 CO 0.05 0.30 1.42 -0.81 0.00 0.00 0.00 175.10 176.06 1x88 n PRO 310 N 4.72 0.68 -0.29 2.72 -0.04 -1.26 -4.59 135.00 136.94 1x88 n PRO 310 Ca -0.17 -0.23 0.04 0.00 -0.04 0.00 0.00 63.50 63.10 1x88 n PRO 310 Cb 0.49 -1.50 0.18 0.00 -0.04 0.00 0.00 33.50 32.63 1x88 n PRO 310 CO 0.00 0.00 0.00 1.88 -0.04 0.00 0.00 175.50 177.34 1x88 h TYR 311 N 3.64 0.83 0.00 0.54 0.05 -1.93 -2.03 116.97 118.06 1x88 h TYR 311 Ca 0.04 0.03 0.00 0.00 0.05 0.00 0.00 58.73 58.85 1x88 h TYR 311 Cb 0.57 -0.25 0.00 0.00 1.01 0.00 0.00 36.73 38.06 1x88 h TYR 311 CO 0.87 0.30 0.00 0.54 -1.05 0.00 0.00 178.16 178.82 1x88 n ARG 312 N -4.78 0.29 0.00 4.88 1.74 -1.26 -2.95 116.66 114.58 1x88 n ARG 312 Ca 0.15 0.10 0.14 0.00 -0.77 0.00 0.00 57.85 57.46 1x88 n ARG 312 Cb 0.32 -1.50 0.74 0.00 -1.02 0.00 0.00 32.46 31.00 1x88 n ARG 312 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 1x88 n GLU 313 N -1.26 0.55 -3.67 5.56 1.02 -0.76 -4.83 120.64 117.24 1x88 n GLU 313 Ca 0.09 0.02 -0.12 0.00 -0.02 0.00 0.00 57.16 57.13 1x88 n GLU 313 Cb 0.14 -1.50 -0.06 0.00 -0.02 0.00 0.00 31.44 30.00 1x88 n GLU 313 CO 0.00 0.00 0.00 -1.54 1.18 0.00 0.00 177.13 176.77 1x88 s SER 314 N -2.40 -0.26 0.18 1.62 1.04 -1.23 -4.88 113.70 107.78 1x88 s SER 314 Ca 0.31 -0.07 -0.07 0.00 0.48 0.00 0.00 55.95 56.60 1x88 s SER 314 Cb 0.19 0.42 0.09 0.00 0.10 0.00 0.00 66.02 66.82 1x88 s SER 314 CO 0.39 -0.69 1.56 0.11 0.98 0.00 0.00 173.24 175.59 1x88 h LYS 315 N 2.94 0.81 -0.26 4.02 1.57 -1.88 -2.41 116.57 121.35 1x88 h LYS 315 Ca -0.32 -0.38 0.01 0.00 -1.87 0.00 0.00 60.65 58.08 1x88 h LYS 315 Cb 1.21 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 33.50 1x88 h LYS 315 CO 0.44 1.02 0.17 1.25 -0.57 0.00 0.00 179.45 181.75 1x88 h LEU 316 N 0.68 0.28 -0.86 2.94 5.85 -1.92 -1.31 115.31 120.97 1x88 h LEU 316 Ca 0.07 -0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.77 1x88 h LEU 316 Cb 0.87 -0.07 -0.00 0.00 0.37 0.00 0.00 40.66 41.84 1x88 h LEU 316 CO 0.08 0.20 -0.07 0.71 -0.34 0.00 0.00 178.44 179.03 1x88 h THR 317 N 0.34 0.14 0.01 1.05 1.35 -1.77 -1.48 112.91 112.55 1x88 h THR 317 Ca 0.10 -0.87 -0.15 0.00 -0.55 0.00 0.00 66.41 64.94 1x88 h THR 317 Cb -0.03 1.76 0.01 0.00 -1.73 0.00 0.00 68.15 68.16 1x88 h THR 317 CO -0.03 0.07 -0.58 0.03 -0.25 0.00 0.00 175.52 174.75 1x88 h ARG 318 N 0.00 0.38 -0.66 4.72 3.08 -1.14 -1.24 114.38 119.52 1x88 h ARG 318 Ca -0.00 -0.42 -0.07 0.00 0.07 0.00 0.00 59.98 59.56 1x88 h ARG 318 Cb 0.75 0.12 -0.03 0.00 0.08 0.00 0.00 29.97 30.90 1x88 h ARG 318 CO 0.01 1.10 0.13 0.82 -1.07 0.00 0.00 179.97 180.96 1x88 h ILE 319 N -0.16 1.26 -0.46 2.04 2.04 -1.14 -3.16 117.51 117.93 1x88 h ILE 319 Ca -0.08 -0.98 -0.10 0.00 1.00 0.00 0.00 64.86 64.71 1x88 h ILE 319 Cb 1.31 0.61 -0.06 0.00 -0.74 0.00 0.00 36.82 37.94 1x88 h ILE 319 CO 0.11 0.37 0.08 0.18 0.00 0.00 0.00 178.15 178.89 1x88 n LEU 320 N -4.23 4.83 -0.31 1.44 4.77 -0.57 -4.73 117.00 118.21 1x88 n LEU 320 Ca 0.05 -3.20 0.11 0.00 -0.03 0.00 0.00 56.01 52.94 1x88 n LEU 320 Cb 0.27 -0.64 0.28 0.00 -2.33 0.00 0.00 43.42 41.00 1x88 n LEU 320 CO 0.42 0.81 1.08 -0.61 -1.33 0.00 0.00 177.39 177.76 1x88 h GLN 321 N 2.18 0.50 0.00 3.23 4.15 -1.18 0.26 115.11 124.25 1x88 h GLN 321 Ca 0.12 -0.03 0.00 0.00 0.77 0.00 0.00 58.65 59.51 1x88 h GLN 321 Cb 1.82 -0.11 0.00 0.00 0.21 0.00 0.00 27.48 29.40 1x88 h GLN 321 CO 0.44 0.33 0.00 -3.47 -1.93 0.00 0.00 178.83 174.21 1x88 n ASP 322 N -4.95 0.40 0.00 -0.69 2.03 -1.26 -1.94 116.55 110.14 1x88 n ASP 322 Ca 0.20 0.60 0.12 0.00 0.52 0.00 0.00 54.79 56.24 1x88 n ASP 322 Cb 0.57 -0.68 0.27 0.00 -0.72 0.00 0.00 41.12 40.56 1x88 n ASP 322 CO 0.00 0.00 0.00 -1.20 -1.92 0.00 0.00 177.20 174.08 1x88 n SER 323 N -1.94 0.47 -3.99 1.67 7.64 0.08 -2.35 113.62 115.19 1x88 n SER 323 Ca 0.03 -0.19 -0.32 0.00 1.01 0.00 0.00 58.87 59.40 1x88 n SER 323 Cb 0.20 0.20 -0.12 0.00 -1.01 0.00 0.00 64.21 63.48 1x88 n SER 323 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1x88 s LEU 324 N -3.02 4.77 -0.00 -3.43 1.43 -0.82 -4.64 118.68 112.97 1x88 s LEU 324 Ca 0.11 -3.22 0.00 0.00 -1.03 0.00 0.00 54.13 49.99 1x88 s LEU 324 Cb 0.18 -1.72 0.00 0.00 0.03 0.00 0.00 46.19 44.68 1x88 s LEU 324 CO 0.69 -0.23 0.00 0.61 0.23 0.00 0.00 176.35 177.65 1x88 n GLY 325 N 2.88 0.38 0.00 -3.19 0.00 -1.26 -4.98 105.19 99.03 1x88 n GLY 325 Ca 0.10 -1.05 0.00 0.00 0.00 0.00 0.00 46.02 45.07 1x88 n GLY 325 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1x88 n GLY 326 N -2.59 3.58 1.50 -0.02 0.00 -1.17 -4.80 105.19 101.70 1x88 n GLY 326 Ca -0.00 -1.85 0.10 0.00 0.00 0.00 0.00 46.02 44.27 1x88 n GLY 326 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1x88 n ARG 327 N 0.00 3.37 -3.79 1.61 1.74 -1.13 -0.37 116.66 118.09 1x88 n ARG 327 Ca 0.00 -2.74 -0.37 0.00 -0.77 0.00 0.00 57.85 53.97 1x88 n ARG 327 Cb 0.00 -1.79 -0.06 0.00 -1.02 0.00 0.00 32.46 29.59 1x88 n ARG 327 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 1x88 s THR 328 N -1.59 5.41 -0.23 0.55 2.01 -0.99 -1.65 115.64 119.15 1x88 s THR 328 Ca 0.50 0.32 -0.29 0.00 0.31 0.00 0.00 61.69 62.53 1x88 s THR 328 Cb 0.30 -3.47 0.00 0.00 0.01 0.00 0.00 72.50 69.35 1x88 s THR 328 CO 0.27 0.58 1.15 -0.60 -0.69 0.00 0.00 174.62 175.33 1x88 s ARG 329 N -0.81 4.18 0.04 4.92 3.52 -0.48 -4.74 118.95 125.57 1x88 s ARG 329 Ca 0.16 1.40 0.06 0.00 -0.13 0.00 0.00 55.73 57.22 1x88 s ARG 329 Cb -0.13 -3.73 -0.03 0.00 -1.56 0.00 0.00 34.95 29.50 1x88 s ARG 329 CO 0.05 -0.76 -0.15 0.99 -0.81 0.00 0.00 175.30 174.62 1x88 s THR 330 N 3.51 3.00 0.01 4.11 2.01 -1.26 -1.24 115.64 125.78 1x88 s THR 330 Ca 0.49 -1.14 0.02 0.00 0.31 0.00 0.00 61.69 61.38 1x88 s THR 330 Cb -0.17 -2.29 -0.01 0.00 0.01 0.00 0.00 72.50 70.04 1x88 s THR 330 CO 0.12 0.31 -0.07 -0.44 -0.69 0.00 0.00 174.62 173.86 1x88 s SER 331 N -1.54 0.76 -0.10 3.53 0.01 -0.10 -1.64 113.70 114.62 1x88 s SER 331 Ca 0.16 -0.23 0.03 0.00 1.31 0.00 0.00 55.95 57.22 1x88 s SER 331 Cb -0.11 -0.05 0.01 0.00 0.21 0.00 0.00 66.02 66.08 1x88 s SER 331 CO 0.07 0.00 -0.19 -0.63 0.41 0.00 0.00 173.24 172.90 1x88 s ILE 332 N -0.47 1.74 -0.38 1.44 1.01 0.86 -0.86 121.20 124.54 1x88 s ILE 332 Ca -0.01 -0.81 -0.09 0.00 0.00 0.00 0.00 60.65 59.73 1x88 s ILE 332 Cb -0.04 -1.55 0.05 0.00 0.01 0.00 0.00 42.46 40.93 1x88 s ILE 332 CO -0.00 0.49 0.20 -0.63 0.00 0.00 0.00 174.94 175.00 1x88 s ILE 333 N 0.66 4.27 -0.19 2.92 1.01 0.94 -0.97 121.20 129.84 1x88 s ILE 333 Ca -0.13 -1.12 -0.19 0.00 0.00 0.00 0.00 60.65 59.22 1x88 s ILE 333 Cb -0.16 -3.47 -0.03 0.00 0.01 0.00 0.00 42.46 38.80 1x88 s ILE 333 CO 0.03 -0.32 0.53 0.00 0.00 0.00 0.00 174.94 175.19 1x88 s ALA 334 N 1.47 3.53 -0.14 9.38 0.00 0.36 -0.96 121.76 135.41 1x88 s ALA 334 Ca 0.01 -0.35 -0.06 0.00 0.00 0.00 0.00 51.96 51.56 1x88 s ALA 334 Cb -0.21 -2.82 -0.04 0.00 0.00 0.00 0.00 23.12 20.05 1x88 s ALA 334 CO 0.04 -0.41 0.09 0.95 0.00 0.00 0.00 175.76 176.43 1x88 s THR 335 N 1.57 5.04 0.26 0.00 -4.23 0.73 -0.87 115.64 118.14 1x88 s THR 335 Ca 0.25 0.04 0.02 0.00 -1.18 0.00 0.00 61.69 60.82 1x88 s THR 335 Cb -0.15 -3.21 -0.05 0.00 1.34 0.00 0.00 72.50 70.42 1x88 s THR 335 CO 0.10 0.56 0.08 0.27 -0.54 0.00 0.00 174.62 175.09 1x88 s ILE 336 N -0.50 0.68 0.11 2.99 -4.36 -0.62 -4.21 121.20 115.29 1x88 s ILE 336 Ca 0.11 -2.00 0.06 0.00 -0.26 0.00 0.00 60.65 58.56 1x88 s ILE 336 Cb -0.12 -2.62 -0.04 0.00 1.25 0.00 0.00 42.46 40.94 1x88 s ILE 336 CO 0.02 -0.04 -0.03 -0.55 0.24 0.00 0.00 174.94 174.58 1x88 s SER 337 N -3.33 4.81 0.00 4.36 0.15 -1.26 -2.03 113.70 116.40 1x88 s SER 337 Ca 0.36 -0.28 0.25 0.00 0.70 0.00 0.00 55.95 56.99 1x88 s SER 337 Cb 0.08 -1.06 0.56 0.00 -1.71 0.00 0.00 66.02 63.89 1x88 s SER 337 CO 0.13 0.16 1.45 -0.81 1.20 0.00 0.00 173.24 175.37 1x88 n PRO 338 N 0.44 0.12 -2.50 5.44 -0.04 -1.26 -4.82 135.00 132.38 1x88 n PRO 338 Ca -0.11 -0.07 -0.41 0.00 -0.04 0.00 0.00 63.50 62.87 1x88 n PRO 338 Cb 0.53 -1.50 -0.04 0.00 -0.04 0.00 0.00 33.50 32.45 1x88 n PRO 338 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1x88 s ALA 339 N -2.92 3.38 0.49 0.55 0.00 -1.26 -1.42 121.76 120.58 1x88 s ALA 339 Ca 0.13 0.84 0.25 0.00 0.00 0.00 0.00 51.96 53.18 1x88 s ALA 339 Cb 0.18 -3.35 1.48 0.00 0.00 0.00 0.00 23.12 21.43 1x88 s ALA 339 CO 0.67 -0.20 2.13 0.66 0.00 0.00 0.00 175.76 179.01 1x88 h SER 340 N 4.81 0.00 0.09 0.00 4.64 -1.92 -1.72 113.55 119.45 1x88 h SER 340 Ca -0.45 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 60.86 1x88 h SER 340 Cb 1.21 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.30 1x88 h SER 340 CO 0.71 0.08 -0.06 0.25 -0.87 0.00 0.00 176.83 176.94 1x88 h LEU 341 N 0.00 0.00 -3.13 5.97 7.12 -1.99 -2.17 115.31 121.11 1x88 h LEU 341 Ca -0.00 0.00 0.00 0.00 0.13 0.00 0.00 57.88 58.01 1x88 h LEU 341 Cb 0.19 0.00 0.00 0.00 -0.53 0.00 0.00 40.66 40.32 1x88 h LEU 341 CO 0.01 0.06 0.00 0.59 -0.13 0.00 0.00 178.44 178.97 1x88 n ASN 342 N -4.20 4.83 -0.20 1.25 5.03 -0.65 -4.70 115.26 116.62 1x88 n ASN 342 Ca -0.03 -2.45 -0.05 0.00 0.87 0.00 0.00 54.58 52.93 1x88 n ASN 342 Cb 0.15 -0.59 0.02 0.00 -1.02 0.00 0.00 39.78 38.33 1x88 n ASN 342 CO 0.00 0.00 0.00 0.25 -1.83 0.00 0.00 177.26 175.68 1x88 h LEU 343 N 4.17 -1.07 -0.18 3.41 5.85 -1.45 -0.17 115.31 125.88 1x88 h LEU 343 Ca 0.00 0.22 0.01 0.00 0.84 0.00 0.00 57.88 58.95 1x88 h LEU 343 Cb 1.47 0.54 -0.02 0.00 0.37 0.00 0.00 40.66 43.03 1x88 h LEU 343 CO 0.24 -0.29 0.07 -0.08 -0.34 0.00 0.00 178.44 178.04 1x88 h GLU 344 N -0.14 0.16 -0.26 1.25 4.81 -1.85 -1.33 114.58 117.21 1x88 h GLU 344 Ca 0.24 -0.01 -0.09 0.00 -0.13 0.00 0.00 59.36 59.37 1x88 h GLU 344 Cb 0.54 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.87 1x88 h GLU 344 CO -0.67 0.10 -0.23 0.93 -0.73 0.00 0.00 179.01 178.41 1x88 h GLU 345 N 0.16 0.50 -0.35 1.92 4.39 -1.82 -1.60 114.58 117.77 1x88 h GLU 345 Ca 0.07 -0.18 -0.02 0.00 0.34 0.00 0.00 59.36 59.57 1x88 h GLU 345 Cb 0.03 -0.03 -0.02 0.00 -0.10 0.00 0.00 28.75 28.63 1x88 h GLU 345 CO -0.07 0.70 0.13 1.15 -1.16 0.00 0.00 179.01 179.76 1x88 h THR 346 N 0.44 1.20 -0.65 1.13 2.02 -0.72 0.44 112.91 116.77 1x88 h THR 346 Ca 0.07 -0.62 -0.06 0.00 0.77 0.00 0.00 66.41 66.58 1x88 h THR 346 Cb 0.64 0.94 -0.03 0.00 -1.74 0.00 0.00 68.15 67.96 1x88 h THR 346 CO 0.05 0.22 0.18 -0.07 0.37 0.00 0.00 175.52 176.27 1x88 h LEU 347 N 0.42 0.94 -0.44 2.58 3.38 -1.08 -0.54 115.31 120.57 1x88 h LEU 347 Ca 0.12 -0.18 -0.02 0.00 0.09 0.00 0.00 57.88 57.89 1x88 h LEU 347 Cb 0.21 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.69 1x88 h LEU 347 CO -0.01 0.90 0.18 -1.28 0.09 0.00 0.00 178.44 178.32 1x88 h SER 348 N 0.97 0.61 -0.44 -0.43 0.87 -0.94 -0.45 113.55 113.74 1x88 h SER 348 Ca 0.21 -0.16 -0.03 0.00 -1.23 0.00 0.00 61.79 60.58 1x88 h SER 348 Cb 0.30 -0.16 -0.02 0.00 -0.44 0.00 0.00 62.40 62.09 1x88 h SER 348 CO -0.00 0.60 0.18 0.74 -0.53 0.00 0.00 176.83 177.81 1x88 h THR 349 N 0.58 1.20 -0.69 2.23 2.02 -0.57 -0.87 112.91 116.80 1x88 h THR 349 Ca 0.15 -0.63 -0.05 0.00 0.77 0.00 0.00 66.41 66.65 1x88 h THR 349 Cb 0.18 0.79 -0.03 0.00 -1.74 0.00 0.00 68.15 67.35 1x88 h THR 349 CO -0.01 0.23 0.23 -0.07 0.37 0.00 0.00 175.52 176.27 1x88 h LEU 350 N 0.57 0.99 -0.72 2.58 3.38 -0.87 0.03 115.31 121.27 1x88 h LEU 350 Ca 0.15 -0.20 -0.10 0.00 0.09 0.00 0.00 57.88 57.82 1x88 h LEU 350 Cb 0.19 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.67 1x88 h LEU 350 CO -0.01 0.93 -0.06 -0.08 0.09 0.00 0.00 178.44 179.31 1x88 h GLU 351 N 1.00 0.91 -0.26 1.13 4.57 -0.93 0.41 114.58 121.42 1x88 h GLU 351 Ca 0.22 -0.30 -0.04 0.00 -1.18 0.00 0.00 59.36 58.07 1x88 h GLU 351 Cb 0.28 -0.08 -0.01 0.00 -0.16 0.00 0.00 28.75 28.78 1x88 h GLU 351 CO -0.01 0.95 0.01 -0.92 -1.18 0.00 0.00 179.01 177.86 1x88 h TYR 352 N 0.83 0.49 -0.36 0.92 5.03 -0.84 -2.47 116.97 120.57 1x88 h TYR 352 Ca 0.14 -0.08 -0.08 0.00 2.58 0.00 0.00 58.73 61.29 1x88 h TYR 352 Cb 0.58 -0.13 -0.01 0.00 1.55 0.00 0.00 36.73 38.72 1x88 h TYR 352 CO 0.03 0.60 -0.10 0.00 -1.32 0.00 0.00 178.16 177.37 1x88 h ALA 353 N 0.83 0.50 -0.56 1.82 0.00 -0.85 -2.56 119.26 118.44 1x88 h ALA 353 Ca 0.07 -0.31 -0.01 0.00 0.00 0.00 0.00 54.91 54.66 1x88 h ALA 353 Cb 0.40 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.03 1x88 h ALA 353 CO 0.01 0.36 0.30 1.25 0.00 0.00 0.00 179.25 181.17 1x88 h HIS 354 N 0.50 0.75 -0.42 0.00 -0.00 -0.90 -2.09 115.15 112.99 1x88 h HIS 354 Ca 0.09 -0.01 -0.15 0.00 -0.00 0.00 0.00 60.37 60.30 1x88 h HIS 354 Cb 0.61 -0.24 -0.01 0.00 -0.00 0.00 0.00 27.41 27.77 1x88 h HIS 354 CO 0.05 0.53 -0.31 0.00 -0.00 0.00 0.00 177.93 178.20 1x88 h ARG 355 N 0.77 0.95 0.00 5.26 3.08 -1.36 -2.95 114.38 120.13 1x88 h ARG 355 Ca 0.20 -0.46 -0.00 0.00 0.07 0.00 0.00 59.98 59.79 1x88 h ARG 355 Cb 0.03 -0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.08 1x88 h ARG 355 CO -0.03 1.12 -0.00 0.00 -1.07 0.00 0.00 179.97 179.99 1x88 h ALA 356 N 0.80 1.14 -0.08 0.04 0.00 -0.95 -2.14 119.26 118.08 1x88 h ALA 356 Ca 0.08 -0.00 0.02 0.00 0.00 0.00 0.00 54.91 55.01 1x88 h ALA 356 Cb 0.90 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.69 1x88 h ALA 356 CO 0.08 0.00 0.10 0.87 0.00 0.00 0.00 179.25 180.30 1x88 h LYS 357 N 0.00 0.00 0.00 0.00 1.57 -1.32 -1.79 116.57 115.03 1x88 h LYS 357 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1x88 h LYS 357 Cb 0.02 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.33 1x88 h LYS 357 CO 0.00 0.00 0.00 0.09 -0.57 0.00 0.00 179.45 178.97 1x88 n ASN 358 N -3.78 0.00 -4.72 0.86 3.02 -0.80 -4.34 115.26 105.49 1x88 n ASN 358 Ca -0.01 -0.52 -0.42 0.00 -0.03 0.00 0.00 54.58 53.60 1x88 n ASN 358 Cb 0.20 -0.15 -0.03 0.00 -0.61 0.00 0.00 39.78 39.18 1x88 n ASN 358 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1x88 s ILE 359 N -2.30 3.77 -0.20 2.41 1.01 -0.67 -4.81 121.20 120.40 1x88 s ILE 359 Ca 0.36 1.31 -0.06 0.00 0.00 0.00 0.00 60.65 62.26 1x88 s ILE 359 Cb 0.20 -3.84 -0.03 0.00 0.01 0.00 0.00 42.46 38.81 1x88 s ILE 359 CO 0.40 0.12 0.02 -0.76 0.00 0.00 0.00 174.94 174.73 1x88 s LEU 360 N 0.82 3.42 0.24 2.97 1.43 -1.26 -1.10 118.68 125.19 1x88 s LEU 360 Ca 0.59 -0.13 0.11 0.00 -1.03 0.00 0.00 54.13 53.66 1x88 s LEU 360 Cb -0.32 -1.87 -0.05 0.00 0.03 0.00 0.00 46.19 43.98 1x88 s LEU 360 CO 0.31 0.08 -0.13 0.20 0.23 0.00 0.00 176.35 177.03 1x88 s ASN 361 N 0.92 3.95 -0.58 2.29 -0.87 -1.26 -4.33 114.94 115.06 1x88 s ASN 361 Ca 0.02 -0.81 0.04 0.00 -1.57 0.00 0.00 52.86 50.55 1x88 s ASN 361 Cb -0.14 -0.52 0.16 0.00 -0.02 0.00 0.00 41.25 40.72 1x88 s ASN 361 CO 0.02 0.06 0.39 -0.54 -2.57 0.00 0.00 177.10 174.46 1x88 s LYS 362 N -3.26 1.94 0.06 -0.60 1.02 0.50 -4.66 119.74 114.74 1x88 s LYS 362 Ca 0.28 -2.81 -0.37 0.00 0.02 0.00 0.00 55.97 53.08 1x88 s LYS 362 Cb -0.07 -2.91 -0.19 0.00 -0.52 0.00 0.00 37.83 34.15 1x88 s LYS 362 CO 0.15 -1.25 1.07 -2.30 -0.92 0.00 0.00 175.35 172.10 1x88 n PRO 363 N 2.56 0.35 0.00 -1.68 -0.02 -1.25 -4.09 135.00 130.87 1x88 n PRO 363 Ca 0.17 0.13 0.00 0.00 -2.02 0.00 0.00 63.50 61.78 1x88 n PRO 363 Cb 0.36 -1.60 0.00 0.00 -0.02 0.00 0.00 33.50 32.25 1x88 n PRO 363 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57