#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x88 s ASN 18 N 0.00 5.37 0.28 3.14 0.01 -1.26 -1.68 114.94 120.79 1x88 s ASN 18 Ca 0.00 2.21 -0.30 0.00 -0.71 0.00 0.00 52.86 54.06 1x88 s ASN 18 Cb 0.00 -2.58 -0.11 0.00 0.41 0.00 0.00 41.25 38.97 1x88 s ASN 18 CO 0.00 -1.46 1.54 -0.63 -1.51 0.00 0.00 177.10 175.03 1x88 s ILE 19 N -1.85 2.27 -0.11 0.60 1.01 -0.01 -4.87 121.20 118.25 1x88 s ILE 19 Ca 0.73 0.23 -0.15 0.00 0.00 0.00 0.00 60.65 61.46 1x88 s ILE 19 Cb -0.25 -3.15 -0.05 0.00 0.01 0.00 0.00 42.46 39.02 1x88 s ILE 19 CO 0.32 0.04 0.37 -1.10 0.00 0.00 0.00 174.94 174.57 1x88 s GLN 20 N -0.53 4.16 -0.15 2.79 -0.21 -0.97 -4.61 119.66 120.15 1x88 s GLN 20 Ca 0.61 0.28 0.00 0.00 0.02 0.00 0.00 55.36 56.27 1x88 s GLN 20 Cb -0.46 -3.37 -0.01 0.00 1.00 0.00 0.00 33.01 30.18 1x88 s GLN 20 CO 0.47 0.35 -0.15 0.08 -2.12 0.00 0.00 175.29 173.92 1x88 s VAL 21 N 0.06 2.78 0.01 1.09 1.01 -1.26 -0.62 120.40 123.47 1x88 s VAL 21 Ca 0.21 -0.74 0.08 0.00 0.00 0.00 0.00 61.98 61.54 1x88 s VAL 21 Cb -0.15 -2.17 -0.02 0.00 0.00 0.00 0.00 36.38 34.04 1x88 s VAL 21 CO 0.08 0.52 -0.26 -0.69 0.00 0.00 0.00 175.10 174.75 1x88 s VAL 22 N 0.68 2.13 -0.08 2.92 1.01 0.74 -1.35 120.40 126.44 1x88 s VAL 22 Ca -0.07 -1.22 0.03 0.00 0.00 0.00 0.00 61.98 60.72 1x88 s VAL 22 Cb -0.16 -1.78 -0.02 0.00 0.00 0.00 0.00 36.38 34.43 1x88 s VAL 22 CO 0.02 0.49 -0.16 -0.69 0.00 0.00 0.00 175.10 174.76 1x88 s VAL 23 N -0.70 2.90 -0.11 2.92 1.01 -0.58 0.52 120.40 126.36 1x88 s VAL 23 Ca 0.11 -0.76 -0.00 0.00 0.00 0.00 0.00 61.98 61.33 1x88 s VAL 23 Cb -0.10 -2.15 0.02 0.00 0.00 0.00 0.00 36.38 34.15 1x88 s VAL 23 CO 0.00 0.57 -0.08 -0.60 0.00 0.00 0.00 175.10 174.99 1x88 s ARG 24 N -0.30 1.54 -0.13 2.72 3.52 0.04 -0.46 118.95 125.88 1x88 s ARG 24 Ca 0.02 -0.26 -0.13 0.00 -0.13 0.00 0.00 55.73 55.23 1x88 s ARG 24 Cb -0.13 -1.58 -0.05 0.00 -1.56 0.00 0.00 34.95 31.63 1x88 s ARG 24 CO 0.03 -0.25 0.29 0.00 -0.81 0.00 0.00 175.30 174.55 1x88 s ARG 26 N -0.03 3.67 0.68 0.00 1.70 -0.88 -3.17 118.95 120.91 1x88 s ARG 26 Ca 0.17 0.45 -0.08 0.00 -0.47 0.00 0.00 55.73 55.81 1x88 s ARG 26 Cb -0.13 -2.31 0.04 0.00 -0.57 0.00 0.00 34.95 31.98 1x88 s ARG 26 CO 0.05 -0.22 1.01 -1.25 -1.08 0.00 0.00 175.30 173.82 1x88 s PRO 27 N -4.45 2.51 0.48 3.89 0.04 -1.26 -4.29 135.00 131.91 1x88 s PRO 27 Ca 0.51 -0.01 -0.22 0.00 0.04 0.00 0.00 61.00 61.32 1x88 s PRO 27 Cb -0.10 -2.15 -0.07 0.00 0.04 0.00 0.00 34.50 32.22 1x88 s PRO 27 CO 0.41 -1.08 1.15 -0.06 0.04 0.00 0.00 177.00 177.46 1x88 s PHE 28 N -3.23 2.85 0.75 0.56 2.99 -1.26 -4.94 117.98 115.70 1x88 s PHE 28 Ca 0.58 1.54 -0.03 0.00 0.00 0.00 0.00 56.93 59.02 1x88 s PHE 28 Cb -0.11 -3.34 0.13 0.00 0.00 0.00 0.00 43.02 39.70 1x88 s PHE 28 CO 0.47 -1.47 1.04 0.54 -0.00 0.00 0.00 175.22 175.79 1x88 s ASN 29 N -1.47 4.21 0.25 1.36 2.20 -1.26 -4.85 114.94 115.38 1x88 s ASN 29 Ca 0.65 -0.24 -0.04 0.00 -0.94 0.00 0.00 52.86 52.30 1x88 s ASN 29 Cb -0.27 -0.11 0.42 0.00 -2.00 0.00 0.00 41.25 39.28 1x88 s ASN 29 CO 0.32 -1.96 1.80 0.17 -2.94 0.00 0.00 177.10 174.49 1x88 h LEU 30 N -0.67 0.64 -0.31 3.54 8.10 -1.99 -0.72 115.31 123.90 1x88 h LEU 30 Ca -0.38 0.06 -0.01 0.00 0.11 0.00 0.00 57.88 57.66 1x88 h LEU 30 Cb 1.26 -0.06 -0.01 0.00 -0.44 0.00 0.00 40.66 41.41 1x88 h LEU 30 CO 0.41 0.35 0.15 0.00 -4.11 0.00 0.00 178.44 175.24 1x88 h ALA 31 N 1.47 0.40 -0.17 0.17 0.00 -1.99 -1.35 119.26 117.79 1x88 h ALA 31 Ca 0.41 -0.09 -0.07 0.00 0.00 0.00 0.00 54.91 55.16 1x88 h ALA 31 Cb 0.42 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 1x88 h ALA 31 CO -0.27 -0.04 -0.21 0.93 0.00 0.00 0.00 179.25 179.66 1x88 h GLU 32 N 0.37 0.29 -0.15 0.00 5.08 -1.80 -2.21 114.58 116.16 1x88 h GLU 32 Ca 0.11 -0.09 -0.02 0.00 -1.00 0.00 0.00 59.36 58.36 1x88 h GLU 32 Cb 0.11 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.32 1x88 h GLU 32 CO -0.01 0.49 0.03 0.00 -1.00 0.00 0.00 179.01 178.51 1x88 h ARG 33 N 0.26 0.25 -0.14 2.33 2.47 -0.76 -1.87 114.38 116.93 1x88 h ARG 33 Ca 0.05 -0.07 -0.01 0.00 -1.26 0.00 0.00 59.98 58.69 1x88 h ARG 33 Cb 0.52 -0.03 -0.01 0.00 -1.65 0.00 0.00 29.97 28.80 1x88 h ARG 33 CO 0.03 0.43 0.02 0.87 0.56 0.00 0.00 179.97 181.88 1x88 h LYS 34 N 0.04 0.19 -0.06 0.04 1.79 -0.97 -0.86 116.57 116.73 1x88 h LYS 34 Ca 0.05 -0.02 0.00 0.00 -2.18 0.00 0.00 60.65 58.50 1x88 h LYS 34 Cb 0.30 -0.04 0.00 0.00 -1.58 0.00 0.00 32.23 30.91 1x88 h LYS 34 CO 0.00 0.20 0.00 0.00 -1.08 0.00 0.00 179.45 178.57 1x88 n ALA 35 N -2.51 2.57 -3.68 3.86 0.00 -0.86 -4.90 120.51 114.99 1x88 n ALA 35 Ca -0.01 -0.25 -0.23 0.00 0.00 0.00 0.00 53.44 52.95 1x88 n ALA 35 Cb 0.14 -1.21 0.05 0.00 0.00 0.00 0.00 19.45 18.43 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 -0.40 -2.99 -4.77 0.00 7.64 -0.33 -4.92 113.62 107.85 1x88 n SER 36 Ca 0.14 -0.73 -0.39 0.00 1.01 0.00 0.00 58.87 58.90 1x88 n SER 36 Cb 0.15 -4.37 -0.02 0.00 -1.01 0.00 0.00 64.21 58.95 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 -3.47 3.30 -0.20 -0.43 0.00 -0.72 -5.02 121.76 115.22 1x88 s ALA 37 Ca 0.25 1.06 -0.04 0.00 0.00 0.00 0.00 51.96 53.24 1x88 s ALA 37 Cb -0.12 -3.41 -0.02 0.00 0.00 0.00 0.00 23.12 19.57 1x88 s ALA 37 CO 0.79 -0.53 -0.04 -1.01 0.00 0.00 0.00 175.76 174.97 1x88 s HIS 38 N -1.28 2.97 0.29 0.00 3.76 -1.26 -4.95 115.29 114.82 1x88 s HIS 38 Ca 0.53 -0.66 -0.29 0.00 -0.15 0.00 0.00 55.06 54.49 1x88 s HIS 38 Cb -0.34 -2.05 -0.10 0.00 1.11 0.00 0.00 32.58 31.20 1x88 s HIS 38 CO 0.44 -0.34 1.39 0.45 -0.85 0.00 0.00 174.74 175.83 1x88 s SER 39 N 1.05 6.68 0.00 1.40 0.15 -1.26 -4.51 113.70 117.21 1x88 s SER 39 Ca 0.01 2.70 0.22 0.00 0.70 0.00 0.00 55.95 59.58 1x88 s SER 39 Cb -0.15 -2.64 0.48 0.00 -1.71 0.00 0.00 66.02 62.01 1x88 s SER 39 CO 0.00 -0.65 1.42 2.30 1.20 0.00 0.00 173.24 177.52 1x88 n ILE 40 N 1.60 0.66 -5.19 6.45 -5.35 -0.07 -4.90 119.36 112.56 1x88 n ILE 40 Ca 0.04 -0.83 -0.31 0.00 -0.27 0.00 0.00 62.75 61.37 1x88 n ILE 40 Cb 0.41 0.83 -0.17 0.00 -1.74 0.00 0.00 39.64 38.97 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 -1.30 1.98 -0.12 7.28 1.01 -1.26 -0.35 120.40 127.63 1x88 s VAL 41 Ca 0.41 -1.00 0.02 0.00 0.00 0.00 0.00 61.98 61.40 1x88 s VAL 41 Cb 0.23 -1.69 0.01 0.00 0.00 0.00 0.00 36.38 34.94 1x88 s VAL 41 CO 0.31 0.55 -0.17 -1.61 0.00 0.00 0.00 175.10 174.18 1x88 s GLU 42 N 0.04 2.39 -0.09 2.72 2.02 0.22 -4.98 118.70 121.02 1x88 s GLU 42 Ca -0.09 -0.62 -0.02 0.00 0.02 0.00 0.00 54.97 54.26 1x88 s GLU 42 Cb -0.15 -2.02 -0.03 0.00 0.10 0.00 0.00 34.13 32.03 1x88 s GLU 42 CO 0.05 -0.07 -0.00 0.00 0.02 0.00 0.00 175.26 175.26 1x88 s ASP 44 N -0.75 3.30 0.26 0.00 -1.08 -0.24 -4.91 116.67 113.24 1x88 s ASP 44 Ca 0.12 -2.84 -0.01 0.00 -0.52 0.00 0.00 52.55 49.30 1x88 s ASP 44 Cb -0.12 -0.93 0.55 0.00 -1.46 0.00 0.00 42.92 40.97 1x88 s ASP 44 CO 0.02 -0.23 1.71 -0.65 0.52 0.00 0.00 175.17 176.55 1x88 h PRO 45 N 6.36 0.41 -0.64 4.34 0.11 -1.81 0.27 132.00 141.04 1x88 h PRO 45 Ca 0.08 -0.02 0.02 0.00 0.11 0.00 0.00 66.00 66.18 1x88 h PRO 45 Cb 0.90 -0.09 -0.04 0.00 0.11 0.00 0.00 31.00 31.88 1x88 h PRO 45 CO 0.47 0.27 0.41 0.28 -0.21 0.00 0.00 178.00 179.21 1x88 h VAL 46 N 0.42 1.11 -0.01 3.15 2.07 -1.94 -1.34 116.25 119.71 1x88 h VAL 46 Ca 0.47 -0.28 0.00 0.00 0.82 0.00 0.00 66.70 67.71 1x88 h VAL 46 Cb 0.78 0.23 0.00 0.00 -1.52 0.00 0.00 31.29 30.78 1x88 h VAL 46 CO -0.46 0.15 -0.06 0.54 0.02 0.00 0.00 177.57 177.76 1x88 n ARG 47 N -4.68 1.22 -3.75 1.57 1.74 -0.63 -4.92 116.66 107.21 1x88 n ARG 47 Ca 0.06 -0.57 -0.29 0.00 -0.77 0.00 0.00 57.85 56.28 1x88 n ARG 47 Cb 0.06 -1.49 0.01 0.00 -1.02 0.00 0.00 32.46 30.02 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 -0.39 -4.49 -4.39 5.56 5.02 0.86 -4.86 118.16 115.46 1x88 n LYS 48 Ca 0.18 0.55 -0.25 0.00 -2.02 0.00 0.00 58.31 56.76 1x88 n LYS 48 Cb 0.29 -5.36 -0.12 0.00 -0.02 0.00 0.00 35.03 29.83 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 -6.44 1.43 -0.10 1.97 2.02 -0.85 -0.98 118.70 115.75 1x88 s GLU 49 Ca 0.58 -1.47 0.01 0.00 0.02 0.00 0.00 54.97 54.11 1x88 s GLU 49 Cb -0.30 -1.68 0.02 0.00 0.10 0.00 0.00 34.13 32.27 1x88 s GLU 49 CO 0.72 0.36 -0.11 0.08 0.02 0.00 0.00 175.26 176.33 1x88 s VAL 50 N -1.74 1.15 -0.11 2.63 1.01 -0.31 -1.08 120.40 121.94 1x88 s VAL 50 Ca 0.19 -0.42 0.01 0.00 0.00 0.00 0.00 61.98 61.76 1x88 s VAL 50 Cb -0.07 -1.10 -0.01 0.00 0.00 0.00 0.00 36.38 35.19 1x88 s VAL 50 CO 0.09 0.38 -0.15 -0.55 0.00 0.00 0.00 175.10 174.86 1x88 s SER 51 N 1.22 3.87 -0.12 3.32 0.15 0.15 -1.18 113.70 121.11 1x88 s SER 51 Ca -0.04 -0.35 0.03 0.00 0.70 0.00 0.00 55.95 56.29 1x88 s SER 51 Cb -0.14 -1.48 0.00 0.00 -1.71 0.00 0.00 66.02 62.70 1x88 s SER 51 CO -0.03 0.19 -0.22 -0.69 1.20 0.00 0.00 173.24 173.69 1x88 s VAL 52 N 0.21 2.19 -0.19 4.45 1.01 -0.14 -0.61 120.40 127.33 1x88 s VAL 52 Ca -0.09 -0.95 -0.29 0.00 0.00 0.00 0.00 61.98 60.64 1x88 s VAL 52 Cb -0.16 -1.87 -0.01 0.00 0.00 0.00 0.00 36.38 34.35 1x88 s VAL 52 CO 0.05 0.55 1.29 -0.60 0.00 0.00 0.00 175.10 176.40 1x88 s ARG 53 N 0.58 4.16 -0.03 2.72 3.52 0.52 -1.49 118.95 128.94 1x88 s ARG 53 Ca -0.12 1.61 0.21 0.00 -0.13 0.00 0.00 55.73 57.29 1x88 s ARG 53 Cb -0.17 -3.80 -0.32 0.00 -1.56 0.00 0.00 34.95 29.11 1x88 s ARG 53 CO 0.03 -0.80 0.48 0.25 -0.81 0.00 0.00 175.30 174.45 1x88 n THR 54 N 5.56 0.00 0.00 4.11 -2.24 -0.91 -4.95 114.28 115.84 1x88 n THR 54 Ca 0.14 -0.45 0.00 0.00 -2.27 0.00 0.00 64.05 61.48 1x88 n THR 54 Cb 0.45 0.09 0.00 0.00 -2.10 0.00 0.00 70.33 68.77 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 1.33 -0.07 0.07 3.38 0.00 -1.26 -4.98 105.19 103.68 1x88 n GLY 55 Ca -0.03 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 45.98 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 0.00 1.32 -0.02 0.00 -1.26 -4.86 105.19 100.36 1x88 n GLY 56 Ca 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.86 1x88 n GLY 56 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1x88 n LEU 57 N -0.35 -2.33 -0.73 0.99 4.32 -1.19 -2.64 117.00 115.08 1x88 n LEU 57 Ca 0.00 0.13 0.00 0.00 -0.02 0.00 0.00 56.01 56.12 1x88 n LEU 57 Cb 0.00 -0.34 0.00 0.00 -1.62 0.00 0.00 43.42 41.46 1x88 n LEU 57 CO 0.00 -2.46 0.00 0.00 -1.22 0.00 0.00 177.39 173.71 1x88 n ALA 58 N -0.96 -1.47 0.00 -1.18 0.00 -1.26 -4.53 120.51 111.11 1x88 n ALA 58 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1x88 n ALA 58 Cb 0.23 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.68 1x88 n ALA 58 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1x88 n ASP 59 N -0.05 0.00 -4.20 0.00 4.64 -1.26 -4.74 116.55 110.94 1x88 n ASP 59 Ca 0.00 0.00 -0.12 0.00 -1.38 0.00 0.00 54.79 53.29 1x88 n ASP 59 Cb 0.00 -0.17 -0.10 0.00 -1.04 0.00 0.00 41.12 39.81 1x88 n ASP 59 CO 0.00 0.00 0.00 -0.75 -0.82 0.00 0.00 177.20 175.63 1x88 s LYS 60 N 0.00 1.09 0.00 -0.67 2.20 -1.26 -5.18 119.74 115.92 1x88 s LYS 60 Ca 0.00 -1.55 0.00 0.00 -0.36 0.00 0.00 55.97 54.06 1x88 s LYS 60 Cb 0.00 0.07 0.00 0.00 -1.51 0.00 0.00 37.83 36.39 1x88 s LYS 60 CO 0.00 -0.27 0.00 -1.13 -0.36 0.00 0.00 175.35 173.59 1x88 n SER 61 N -0.22 0.00 -4.95 1.43 3.41 -1.08 -3.14 113.62 109.08 1x88 n SER 61 Ca -0.03 0.00 -0.23 0.00 -0.26 0.00 0.00 58.87 58.35 1x88 n SER 61 Cb 0.64 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.57 1x88 n SER 61 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1x88 s SER 62 N 0.00 6.26 0.12 4.04 1.04 -1.26 -4.82 113.70 119.08 1x88 s SER 62 Ca 0.00 0.08 -0.09 0.00 0.48 0.00 0.00 55.95 56.41 1x88 s SER 62 Cb 0.00 -1.84 -0.00 0.00 0.10 0.00 0.00 66.02 64.28 1x88 s SER 62 CO 0.00 -0.03 0.24 -0.13 0.98 0.00 0.00 173.24 174.30 1x88 s ARG 63 N -3.73 0.98 -0.09 4.02 0.52 -1.26 -2.15 118.95 117.24 1x88 s ARG 63 Ca 0.34 -1.02 0.02 0.00 -0.52 0.00 0.00 55.73 54.55 1x88 s ARG 63 Cb -0.10 0.37 0.01 0.00 0.52 0.00 0.00 34.95 35.75 1x88 s ARG 63 CO 0.28 -0.34 -0.16 0.15 0.02 0.00 0.00 175.30 175.26 1x88 s LYS 64 N -3.90 2.16 0.06 3.54 1.02 -0.55 -4.93 119.74 117.15 1x88 s LYS 64 Ca 0.09 -0.56 0.06 0.00 0.02 0.00 0.00 55.97 55.59 1x88 s LYS 64 Cb 0.04 -1.78 -0.04 0.00 -0.52 0.00 0.00 37.83 35.53 1x88 s LYS 64 CO -0.07 0.01 -0.12 0.95 -0.92 0.00 0.00 175.35 175.20 1x88 s THR 65 N 0.77 3.21 0.02 2.17 -4.23 -1.26 -0.97 115.64 115.36 1x88 s THR 65 Ca -0.11 -1.15 0.02 0.00 -1.18 0.00 0.00 61.69 59.27 1x88 s THR 65 Cb -0.16 -2.43 -0.02 0.00 1.34 0.00 0.00 72.50 71.24 1x88 s THR 65 CO 0.02 0.25 -0.07 -0.31 -0.54 0.00 0.00 174.62 173.97 1x88 s TYR 66 N -1.07 0.63 -0.10 3.99 1.51 -0.33 -4.98 117.35 117.00 1x88 s TYR 66 Ca 0.18 -0.33 0.00 0.00 -1.01 0.00 0.00 57.07 55.92 1x88 s TYR 66 Cb -0.11 -0.39 -0.02 0.00 -0.11 0.00 0.00 41.96 41.33 1x88 s TYR 66 CO 0.09 -0.04 -0.10 0.99 -1.11 0.00 0.00 175.55 175.37 1x88 s THR 67 N -0.84 3.34 0.29 -0.71 2.01 -1.26 -1.16 115.64 117.31 1x88 s THR 67 Ca -0.04 -0.58 0.02 0.00 0.31 0.00 0.00 61.69 61.39 1x88 s THR 67 Cb -0.07 -2.39 -0.01 0.00 0.01 0.00 0.00 72.50 70.05 1x88 s THR 67 CO 0.00 0.55 0.07 0.49 -0.69 0.00 0.00 174.62 175.04 1x88 n PHE 68 N 3.01 0.27 0.08 4.92 3.01 -0.15 -4.99 117.46 123.61 1x88 n PHE 68 Ca -0.18 -1.73 -0.07 0.00 1.01 0.00 0.00 57.45 56.49 1x88 n PHE 68 Cb 0.53 -0.06 0.06 0.00 -0.01 0.00 0.00 39.48 40.00 1x88 n PHE 68 CO 0.00 0.00 0.00 -0.44 1.01 0.00 0.00 176.76 177.33 1x88 h ASP 69 N 1.01 0.28 -4.42 4.37 3.32 -1.51 -3.46 116.42 116.01 1x88 h ASP 69 Ca -0.23 -0.19 -0.09 0.00 0.02 0.00 0.00 57.03 56.54 1x88 h ASP 69 Cb 0.82 -0.08 -0.21 0.00 0.22 0.00 0.00 39.33 40.07 1x88 h ASP 69 CO 0.37 0.91 -0.08 -0.04 -1.72 0.00 0.00 179.24 178.67 1x88 s MET 70 N -3.53 0.72 -0.05 3.56 -1.94 -1.18 -5.00 119.30 111.89 1x88 s MET 70 Ca -0.04 0.40 0.02 0.00 -1.71 0.00 0.00 55.69 54.36 1x88 s MET 70 Cb 0.11 0.34 0.02 0.00 2.01 0.00 0.00 34.83 37.31 1x88 s MET 70 CO 0.81 -0.16 -0.08 0.08 -0.01 0.00 0.00 175.02 175.66 1x88 s VAL 71 N -0.44 0.82 -0.14 -6.03 1.01 -1.26 -1.53 120.40 112.83 1x88 s VAL 71 Ca -0.06 -0.31 0.02 0.00 0.00 0.00 0.00 61.98 61.63 1x88 s VAL 71 Cb -0.03 -0.77 0.02 0.00 0.00 0.00 0.00 36.38 35.59 1x88 s VAL 71 CO 0.04 0.28 -0.18 -0.36 0.00 0.00 0.00 175.10 174.88 1x88 s PHE 72 N 0.67 2.39 0.65 5.22 0.08 0.39 -4.25 117.98 123.13 1x88 s PHE 72 Ca -0.11 -1.26 -0.08 0.00 0.12 0.00 0.00 56.93 55.60 1x88 s PHE 72 Cb -0.14 -1.68 0.14 0.00 -0.57 0.00 0.00 43.02 40.77 1x88 s PHE 72 CO 0.02 -0.63 0.88 0.41 -0.10 0.00 0.00 175.22 175.80 1x88 n GLY 73 N 4.37 -0.64 0.37 4.36 0.00 -1.26 -1.08 105.19 111.31 1x88 n GLY 73 Ca -0.19 -1.81 0.20 0.00 0.00 0.00 0.00 46.02 44.21 1x88 n GLY 73 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1x88 h ALA 74 N -1.38 2.38 0.00 4.61 0.00 -1.82 -1.70 119.26 121.36 1x88 h ALA 74 Ca -0.29 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.61 1x88 h ALA 74 Cb 0.87 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.70 1x88 h ALA 74 CO 0.24 -0.60 0.00 -1.13 0.00 0.00 0.00 179.25 177.75 1x88 n SER 75 N -4.26 0.00 -4.70 0.00 3.41 -1.26 -4.29 113.62 102.53 1x88 n SER 75 Ca 0.08 -0.37 -0.42 0.00 -0.26 0.00 0.00 58.87 57.90 1x88 n SER 75 Cb 0.57 -0.21 -0.03 0.00 -0.26 0.00 0.00 64.21 64.28 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 -2.42 3.06 0.41 6.66 2.01 -0.64 -5.01 115.64 119.71 1x88 s THR 76 Ca 0.34 0.59 0.05 0.00 0.31 0.00 0.00 61.69 62.98 1x88 s THR 76 Cb 0.21 -3.38 0.00 0.00 0.01 0.00 0.00 72.50 69.34 1x88 s THR 76 CO 0.44 0.01 0.57 -0.54 -0.69 0.00 0.00 174.62 174.41 1x88 s LYS 77 N 2.21 2.95 0.23 4.92 -0.14 -1.26 -4.99 119.74 123.67 1x88 s LYS 77 Ca 0.71 -0.97 -0.06 0.00 -1.36 0.00 0.00 55.97 54.29 1x88 s LYS 77 Cb -0.39 -2.72 0.34 0.00 -1.68 0.00 0.00 37.83 33.38 1x88 s LYS 77 CO 0.31 -0.19 1.82 1.96 -0.76 0.00 0.00 175.35 178.49 1x88 h GLN 78 N 0.64 0.77 -0.04 1.68 1.08 -1.88 -1.31 115.11 116.05 1x88 h GLN 78 Ca -0.44 -0.05 -0.04 0.00 -1.45 0.00 0.00 58.65 56.67 1x88 h GLN 78 Cb 1.27 -0.17 -0.01 0.00 -0.05 0.00 0.00 27.48 28.52 1x88 h GLN 78 CO 0.51 0.51 -0.18 0.97 -0.95 0.00 0.00 178.83 179.69 1x88 h ILE 79 N 0.79 1.15 -0.33 2.54 2.10 -1.87 -1.35 117.51 120.54 1x88 h ILE 79 Ca 0.36 -0.70 -0.05 0.00 1.08 0.00 0.00 64.86 65.56 1x88 h ILE 79 Cb 0.28 1.33 -0.01 0.00 -1.09 0.00 0.00 36.82 37.32 1x88 h ILE 79 CO -0.22 0.21 0.02 0.44 -1.08 0.00 0.00 178.15 177.52 1x88 h ASP 80 N 0.06 0.54 -0.50 2.19 3.32 -1.63 -1.28 116.42 119.11 1x88 h ASP 80 Ca 0.01 -0.29 -0.03 0.00 0.02 0.00 0.00 57.03 56.74 1x88 h ASP 80 Cb 0.35 -0.15 -0.02 0.00 0.22 0.00 0.00 39.33 39.74 1x88 h ASP 80 CO 0.02 0.70 0.20 0.58 -1.72 0.00 0.00 179.24 179.02 1x88 h VAL 81 N 0.37 1.21 -0.12 -1.35 2.07 -1.12 -2.67 116.25 114.65 1x88 h VAL 81 Ca 0.10 -0.67 -0.01 0.00 0.82 0.00 0.00 66.70 66.94 1x88 h VAL 81 Cb 0.40 0.71 -0.00 0.00 -1.52 0.00 0.00 31.29 30.88 1x88 h VAL 81 CO 0.01 0.25 0.03 0.22 0.02 0.00 0.00 177.57 178.10 1x88 h TYR 82 N 0.67 0.19 -0.93 1.57 5.03 -1.12 -0.81 116.97 121.58 1x88 h TYR 82 Ca 0.17 -0.02 -0.01 0.00 2.58 0.00 0.00 58.73 61.45 1x88 h TYR 82 Cb 0.20 -0.05 -0.04 0.00 1.55 0.00 0.00 36.73 38.38 1x88 h TYR 82 CO 0.01 0.34 0.55 0.00 -1.32 0.00 0.00 178.16 177.74 1x88 h ARG 83 N -0.01 1.26 0.00 1.82 3.08 -1.22 0.14 114.38 119.45 1x88 h ARG 83 Ca 0.04 -0.12 -0.28 0.00 0.07 0.00 0.00 59.98 59.69 1x88 h ARG 83 Cb 0.24 -0.26 -0.05 0.00 0.08 0.00 0.00 29.97 29.98 1x88 h ARG 83 CO -0.00 0.88 -1.63 0.77 -1.07 0.00 0.00 179.97 178.92 1x88 h SER 84 N 1.28 0.00 0.00 7.04 0.02 -1.47 -3.40 113.55 117.01 1x88 h SER 84 Ca 0.33 0.00 -0.24 0.00 -0.84 0.00 0.00 61.79 61.04 1x88 h SER 84 Cb -0.05 0.00 -0.04 0.00 0.14 0.00 0.00 62.40 62.46 1x88 h SER 84 CO -0.06 0.99 -1.73 0.52 -1.14 0.00 0.00 176.83 175.41 1x88 n VAL 85 N -3.07 1.04 -0.02 2.27 0.31 -0.31 -4.76 118.33 113.79 1x88 n VAL 85 Ca -0.15 -0.16 -0.16 0.00 -0.01 0.00 0.00 64.34 63.87 1x88 n VAL 85 Cb 1.04 -1.80 -0.11 0.00 -0.91 0.00 0.00 33.84 32.06 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 -0.63 1.48 -0.53 2.52 2.07 -1.39 -3.28 116.25 116.48 1x88 h VAL 86 Ca -0.36 -1.92 0.11 0.00 0.82 0.00 0.00 66.70 65.34 1x88 h VAL 86 Cb 1.25 2.60 -0.10 0.00 -1.52 0.00 0.00 31.29 33.51 1x88 h VAL 86 CO -0.22 0.54 -0.16 0.00 0.02 0.00 0.00 177.57 177.75 1x88 h PRO 88 N -0.03 1.12 -0.46 0.00 0.11 -1.82 -1.16 132.00 129.77 1x88 h PRO 88 Ca 0.25 -0.07 -0.08 0.00 0.11 0.00 0.00 66.00 66.22 1x88 h PRO 88 Cb 0.42 -0.25 -0.02 0.00 0.11 0.00 0.00 31.00 31.26 1x88 h PRO 88 CO -0.56 0.74 -0.01 0.82 -0.21 0.00 0.00 178.00 178.78 1x88 h ILE 89 N 1.16 1.26 -0.47 4.15 2.04 -1.23 -2.57 117.51 121.85 1x88 h ILE 89 Ca 0.32 -1.07 -0.05 0.00 1.00 0.00 0.00 64.86 65.05 1x88 h ILE 89 Cb -0.12 1.04 -0.02 0.00 -0.74 0.00 0.00 36.82 36.98 1x88 h ILE 89 CO -0.07 0.37 0.06 0.25 0.00 0.00 0.00 178.15 178.76 1x88 h LEU 90 N 0.67 0.68 -1.11 1.44 5.85 -0.15 -1.47 115.31 121.22 1x88 h LEU 90 Ca 0.13 -0.13 -0.02 0.00 0.84 0.00 0.00 57.88 58.70 1x88 h LEU 90 Cb 0.52 -0.18 -0.03 0.00 0.37 0.00 0.00 40.66 41.34 1x88 h LEU 90 CO 0.03 0.71 0.34 0.44 -0.34 0.00 0.00 178.44 179.62 1x88 h ASP 91 N 0.70 0.86 -0.26 1.25 3.32 -0.98 0.12 116.42 121.43 1x88 h ASP 91 Ca 0.15 -0.08 -0.11 0.00 0.02 0.00 0.00 57.03 57.00 1x88 h ASP 91 Cb 0.34 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.65 1x88 h ASP 91 CO 0.01 0.72 -0.23 -0.08 -1.72 0.00 0.00 179.24 177.93 1x88 h GLU 92 N 0.96 0.74 -0.60 3.56 4.81 -0.96 -1.88 114.58 121.20 1x88 h GLU 92 Ca 0.24 -0.30 -0.05 0.00 -0.13 0.00 0.00 59.36 59.11 1x88 h GLU 92 Cb 0.08 -0.03 -0.03 0.00 0.63 0.00 0.00 28.75 29.40 1x88 h GLU 92 CO -0.03 0.90 0.17 0.28 -0.73 0.00 0.00 179.01 179.60 1x88 h VAL 93 N 0.64 1.25 0.00 0.32 2.07 -0.54 -2.09 116.25 117.91 1x88 h VAL 93 Ca 0.09 -0.87 -0.01 0.00 0.82 0.00 0.00 66.70 66.73 1x88 h VAL 93 Cb 0.74 0.67 -0.00 0.00 -1.52 0.00 0.00 31.29 31.17 1x88 h VAL 93 CO 0.06 0.33 -0.04 0.40 0.02 0.00 0.00 177.57 178.34 1x88 h ILE 94 N 0.87 0.14 0.00 4.57 2.04 -0.67 -0.27 117.51 124.19 1x88 h ILE 94 Ca 0.19 -0.43 0.00 0.00 1.00 0.00 0.00 64.86 65.62 1x88 h ILE 94 Cb 0.32 1.37 0.00 0.00 -0.74 0.00 0.00 36.82 37.78 1x88 h ILE 94 CO -0.00 0.04 0.00 0.23 0.00 0.00 0.00 178.15 178.42 1x88 n MET 95 N -3.20 0.13 0.00 2.37 2.81 -0.74 -4.88 117.12 113.61 1x88 n MET 95 Ca -0.01 0.04 0.00 0.00 -1.81 0.00 0.00 57.70 55.92 1x88 n MET 95 Cb 0.24 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.25 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 1.15 1.94 3.79 3.03 0.00 -0.12 -4.89 105.19 110.10 1x88 n GLY 96 Ca 0.08 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.86 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 2.42 -0.10 1.61 2.02 -1.07 -1.65 117.35 118.59 1x88 s TYR 97 Ca 0.00 -0.63 -0.01 0.00 -0.37 0.00 0.00 57.07 56.06 1x88 s TYR 97 Cb 0.00 -1.97 -0.03 0.00 -0.40 0.00 0.00 41.96 39.56 1x88 s TYR 97 CO 0.00 0.02 -0.06 -0.80 -1.57 0.00 0.00 175.55 173.15 1x88 s ASN 98 N -4.00 4.69 0.05 2.29 0.01 -1.26 -2.03 114.94 114.70 1x88 s ASN 98 Ca 0.39 -0.07 0.02 0.00 -0.71 0.00 0.00 52.86 52.49 1x88 s ASN 98 Cb 0.02 -1.42 -0.03 0.00 0.41 0.00 0.00 41.25 40.22 1x88 s ASN 98 CO 0.22 0.29 -0.07 0.00 -1.51 0.00 0.00 177.10 176.03 1x88 s THR 100 N -2.08 0.16 -0.10 0.00 2.01 -0.07 -0.93 115.64 114.62 1x88 s THR 100 Ca -0.05 -0.08 0.00 0.00 0.31 0.00 0.00 61.69 61.88 1x88 s THR 100 Cb -0.05 -0.15 0.02 0.00 0.01 0.00 0.00 72.50 72.33 1x88 s THR 100 CO -0.02 0.05 -0.09 -0.63 -0.69 0.00 0.00 174.62 173.24 1x88 s ILE 101 N -0.00 1.08 0.04 1.82 1.01 -0.03 -0.99 121.20 124.13 1x88 s ILE 101 Ca 0.00 -0.35 0.01 0.00 0.00 0.00 0.00 60.65 60.31 1x88 s ILE 101 Cb -0.01 -1.06 -0.04 0.00 0.01 0.00 0.00 42.46 41.36 1x88 s ILE 101 CO -0.00 0.37 0.13 -0.36 0.00 0.00 0.00 174.94 175.08 1x88 s PHE 102 N 1.42 3.36 -0.18 3.97 0.08 -0.23 -0.74 117.98 125.66 1x88 s PHE 102 Ca -0.00 0.20 -0.00 0.00 0.12 0.00 0.00 56.93 57.24 1x88 s PHE 102 Cb -0.13 -1.72 0.01 0.00 -0.57 0.00 0.00 43.02 40.61 1x88 s PHE 102 CO -0.05 0.57 -0.15 0.00 -0.10 0.00 0.00 175.22 175.48 1x88 s ALA 103 N -1.38 2.47 -0.01 5.36 0.00 -0.03 -0.06 121.76 128.11 1x88 s ALA 103 Ca 0.29 -1.15 0.04 0.00 0.00 0.00 0.00 51.96 51.14 1x88 s ALA 103 Cb -0.12 -1.29 -0.01 0.00 0.00 0.00 0.00 23.12 21.69 1x88 s ALA 103 CO 0.22 -0.26 -0.12 -0.47 0.00 0.00 0.00 175.76 175.12 1x88 s TYR 104 N 1.17 1.11 0.00 0.00 6.14 -0.28 -2.53 117.35 122.97 1x88 s TYR 104 Ca 0.02 -0.21 0.00 0.00 0.64 0.00 0.00 57.07 57.52 1x88 s TYR 104 Cb -0.14 -0.72 0.00 0.00 0.42 0.00 0.00 41.96 41.52 1x88 s TYR 104 CO -0.07 -0.02 0.00 0.41 0.64 0.00 0.00 175.55 176.51 1x88 n GLY 105 N 2.77 2.21 3.76 8.97 0.00 -1.26 -0.44 105.19 121.20 1x88 n GLY 105 Ca -0.14 -1.29 -0.37 0.00 0.00 0.00 0.00 46.02 44.23 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 -1.98 3.24 0.24 1.61 0.74 -1.26 -2.07 119.66 120.17 1x88 s GLN 106 Ca 0.00 1.87 -0.31 0.00 0.05 0.00 0.00 55.36 56.96 1x88 s GLN 106 Cb 0.00 -2.12 -0.13 0.00 1.10 0.00 0.00 33.01 31.87 1x88 s GLN 106 CO 0.00 -1.00 1.52 2.41 -0.55 0.00 0.00 175.29 177.67 1x88 n THR 107 N -1.18 0.72 -0.26 -0.34 -1.04 -1.26 -2.35 114.28 108.57 1x88 n THR 107 Ca 0.11 -0.18 0.00 0.00 -2.04 0.00 0.00 64.05 61.94 1x88 n THR 107 Cb 0.48 -1.68 0.00 0.00 -1.82 0.00 0.00 70.33 67.32 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 2.54 0.71 0.03 3.41 0.00 -1.26 -4.96 105.19 105.66 1x88 n GLY 108 Ca 0.12 0.00 0.10 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 -2.09 0.00 0.00 2.61 -2.24 -0.99 -4.99 114.28 106.58 1x88 n THR 109 Ca 0.00 -0.01 0.00 0.00 -2.27 0.00 0.00 64.05 61.77 1x88 n THR 109 Cb 0.00 0.87 0.00 0.00 -2.10 0.00 0.00 70.33 69.10 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 1.49 1.79 0.10 3.38 0.00 -1.26 -4.39 105.19 106.31 1x88 n GLY 110 Ca 0.05 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.94 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 0.06 -0.15 -0.40 1.61 1.57 -1.93 -0.02 116.57 117.31 1x88 h LYS 111 Ca 0.00 0.01 -0.14 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 0.03 -0.31 1.15 -0.57 0.00 0.00 179.45 179.75 1x88 h THR 112 N -0.31 1.27 -0.87 -0.16 2.02 -1.96 -0.20 112.91 112.71 1x88 h THR 112 Ca -0.02 -1.47 0.04 0.00 0.77 0.00 0.00 66.41 65.73 1x88 h THR 112 Cb 0.25 1.30 -0.05 0.00 -1.74 0.00 0.00 68.15 67.90 1x88 h THR 112 CO 0.03 0.49 0.55 0.15 0.37 0.00 0.00 175.52 177.11 1x88 h PHE 113 N 0.74 1.04 -0.03 3.16 3.57 -1.84 0.33 116.94 123.91 1x88 h PHE 113 Ca 0.08 0.03 -0.04 0.00 3.53 0.00 0.00 57.97 61.56 1x88 h PHE 113 Cb 0.87 -0.34 0.00 0.00 2.79 0.00 0.00 35.95 39.27 1x88 h PHE 113 CO 0.05 0.58 -0.15 1.15 -2.23 0.00 0.00 178.31 177.71 1x88 h THR 114 N 1.06 1.50 -0.04 4.41 2.02 -0.76 -0.86 112.91 120.24 1x88 h THR 114 Ca 0.35 -1.69 -0.18 0.00 0.77 0.00 0.00 66.41 65.66 1x88 h THR 114 Cb 0.05 2.54 -0.01 0.00 -1.74 0.00 0.00 68.15 68.99 1x88 h THR 114 CO -0.13 0.46 -0.76 0.24 0.37 0.00 0.00 175.52 175.70 1x88 h MET 115 N -0.46 0.28 0.00 6.66 2.86 -0.90 -1.99 114.93 121.38 1x88 h MET 115 Ca -0.01 -0.25 -0.12 0.00 -2.06 0.00 0.00 59.70 57.25 1x88 h MET 115 Cb 0.83 0.06 -0.02 0.00 0.06 0.00 0.00 31.60 32.53 1x88 h MET 115 CO 0.03 0.92 -1.45 0.39 1.06 0.00 0.00 176.91 177.86 1x88 n GLU 116 N -3.78 0.19 0.00 1.72 1.02 0.11 -1.08 120.64 118.82 1x88 n GLU 116 Ca -0.04 0.06 0.00 0.00 -0.02 0.00 0.00 57.16 57.16 1x88 n GLU 116 Cb 0.73 -1.03 0.00 0.00 -0.02 0.00 0.00 31.44 31.11 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 2.92 -2.38 3.27 0.62 0.00 -0.33 -1.12 105.19 108.17 1x88 n GLY 117 Ca -0.14 -1.63 -0.19 0.00 0.00 0.00 0.00 46.02 44.06 1x88 n GLY 117 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1x88 n GLU 118 N -0.37 0.48 -3.92 1.61 1.02 -0.68 -4.73 120.64 114.05 1x88 n GLU 118 Ca 0.00 -3.24 -0.36 0.00 -0.02 0.00 0.00 57.16 53.55 1x88 n GLU 118 Cb 0.00 2.75 -0.06 0.00 -0.02 0.00 0.00 31.44 34.11 1x88 n GLU 118 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 1x88 s ARG 119 N -3.24 3.41 0.43 3.49 1.81 -1.26 -3.63 118.95 119.96 1x88 s ARG 119 Ca 0.38 -0.20 -0.24 0.00 -1.72 0.00 0.00 55.73 53.94 1x88 s ARG 119 Cb 0.01 -3.14 -0.08 0.00 -0.45 0.00 0.00 34.95 31.30 1x88 s ARG 119 CO 0.27 0.75 1.18 -1.12 -0.68 0.00 0.00 175.30 175.69 1x88 s SER 120 N -1.28 6.31 0.88 0.23 0.01 -1.26 -4.97 113.70 113.62 1x88 s SER 120 Ca 0.18 2.35 -0.11 0.00 1.31 0.00 0.00 55.95 59.69 1x88 s SER 120 Cb -0.12 -2.61 0.13 0.00 0.21 0.00 0.00 66.02 63.63 1x88 s SER 120 CO 0.08 -0.82 1.16 -2.65 0.41 0.00 0.00 173.24 171.42 1x88 n PRO 121 N -0.23 -0.26 -2.80 12.44 -0.02 -1.26 -3.95 135.00 138.93 1x88 n PRO 121 Ca 0.06 -0.00 -0.21 0.00 -2.02 0.00 0.00 63.50 61.33 1x88 n PRO 121 Cb 0.47 -2.39 0.01 0.00 -0.02 0.00 0.00 33.50 31.57 1x88 n PRO 121 CO 0.00 0.00 0.00 -1.71 1.98 0.00 0.00 175.50 175.77 1x88 n ASN 122 N -3.92 -5.46 -3.78 2.55 5.15 -1.26 -2.83 115.26 105.71 1x88 n ASN 122 Ca 0.12 -0.15 -0.29 0.00 -0.60 0.00 0.00 54.58 53.66 1x88 n ASN 122 Cb 0.51 -4.49 -0.00 0.00 -0.53 0.00 0.00 39.78 35.27 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 -3.52 -3.83 -0.06 1.20 1.02 -1.25 -4.85 120.64 109.34 1x88 n GLU 123 Ca -0.15 0.47 -0.02 0.00 -0.02 0.00 0.00 57.16 57.44 1x88 n GLU 123 Cb 0.63 -5.23 0.23 0.00 -0.02 0.00 0.00 31.44 27.05 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 -1.41 0.67 -5.38 3.49 4.81 -1.71 -3.45 114.58 111.60 1x88 h GLU 124 Ca -0.52 -0.15 -0.43 0.00 -0.13 0.00 0.00 59.36 58.12 1x88 h GLU 124 Cb 1.34 -0.09 -0.14 0.00 0.63 0.00 0.00 28.75 30.49 1x88 h GLU 124 CO 0.65 0.67 -0.70 0.71 -0.73 0.00 0.00 179.01 179.62 1x88 s TYR 125 N -5.02 1.70 0.55 0.92 1.51 -1.26 -5.11 117.35 110.64 1x88 s TYR 125 Ca -0.09 -0.71 -0.07 0.00 -1.01 0.00 0.00 57.07 55.19 1x88 s TYR 125 Cb 0.15 -0.90 -0.03 0.00 -0.11 0.00 0.00 41.96 41.07 1x88 s TYR 125 CO 0.79 0.22 0.89 0.95 -1.11 0.00 0.00 175.55 177.29 1x88 s THR 126 N -3.12 4.63 0.45 -0.71 -4.23 -1.26 -4.87 115.64 106.52 1x88 s THR 126 Ca 0.25 0.41 0.10 0.00 -1.18 0.00 0.00 61.69 61.28 1x88 s THR 126 Cb 0.02 -3.80 0.27 0.00 1.34 0.00 0.00 72.50 70.34 1x88 s THR 126 CO 0.08 -0.89 2.08 4.11 -0.54 0.00 0.00 174.62 179.46 1x88 h TRP 127 N -0.04 0.35 0.00 3.99 5.08 -2.01 -2.10 115.95 121.22 1x88 h TRP 127 Ca -0.46 0.01 -0.03 0.00 1.08 0.00 0.00 58.89 59.49 1x88 h TRP 127 Cb 1.21 -0.12 -0.00 0.00 -3.00 0.00 0.00 29.16 27.24 1x88 h TRP 127 CO 0.59 0.22 -0.15 0.93 -1.28 0.00 0.00 178.44 178.75 1x88 h GLU 128 N 0.38 0.00 0.00 0.12 3.07 -1.97 -3.18 114.58 113.00 1x88 h GLU 128 Ca 0.12 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.98 1x88 h GLU 128 Cb 0.01 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.92 1x88 h GLU 128 CO -0.03 0.15 -0.01 -0.85 -1.40 0.00 0.00 179.01 176.87 1x88 n GLU 129 N -3.45 2.36 -2.16 2.33 0.28 -0.95 -5.02 120.64 114.03 1x88 n GLU 129 Ca -0.01 -1.73 -0.42 0.00 -0.16 0.00 0.00 57.16 54.84 1x88 n GLU 129 Cb 0.32 -1.10 -0.03 0.00 1.43 0.00 0.00 31.44 32.06 1x88 n GLU 129 CO 0.00 0.00 0.00 0.34 -0.16 0.00 0.00 177.13 177.31 1x88 s ASP 130 N -1.44 6.77 0.58 -1.84 -1.08 -0.83 -4.86 116.67 113.96 1x88 s ASP 130 Ca 0.08 2.04 0.39 0.00 -0.52 0.00 0.00 52.55 54.54 1x88 s ASP 130 Cb 0.07 -2.54 2.06 0.00 -1.46 0.00 0.00 42.92 41.05 1x88 s ASP 130 CO 0.01 -0.86 2.18 1.55 0.52 0.00 0.00 175.17 178.57 1x88 h PRO 131 N 8.96 0.00 -0.01 4.34 0.13 -1.93 -1.79 132.00 141.70 1x88 h PRO 131 Ca -0.35 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.78 1x88 h PRO 131 Cb 1.15 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.28 1x88 h PRO 131 CO 0.96 0.00 -0.14 1.28 -0.23 0.00 0.00 178.00 179.86 1x88 n LEU 132 N -2.88 1.25 -4.76 1.56 4.77 -1.26 -4.37 117.00 111.31 1x88 n LEU 132 Ca -0.02 -0.37 -0.40 0.00 -0.03 0.00 0.00 56.01 55.19 1x88 n LEU 132 Cb 0.08 -0.07 0.02 0.00 -2.33 0.00 0.00 43.42 41.13 1x88 n LEU 132 CO 0.18 0.22 1.06 0.00 -1.33 0.00 0.00 177.39 177.52 1x88 s ALA 133 N -2.28 3.17 0.00 -1.18 0.00 -0.68 -1.69 121.76 119.11 1x88 s ALA 133 Ca 0.30 1.45 0.00 0.00 0.00 0.00 0.00 51.96 53.71 1x88 s ALA 133 Cb 0.20 -3.59 0.00 0.00 0.00 0.00 0.00 23.12 19.73 1x88 s ALA 133 CO 0.44 -1.23 0.00 0.41 0.00 0.00 0.00 175.76 175.38 1x88 n GLY 134 N 0.60 2.01 0.11 0.00 0.00 -0.27 -4.78 105.19 102.86 1x88 n GLY 134 Ca 0.06 -2.06 -0.08 0.00 0.00 0.00 0.00 46.02 43.94 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 0.85 0.36 -0.61 2.04 -1.19 -2.79 117.51 116.17 1x88 h ILE 135 Ca 0.00 -0.02 -0.00 0.00 1.00 0.00 0.00 64.86 65.84 1x88 h ILE 135 Cb 0.00 0.79 -0.02 0.00 -0.74 0.00 0.00 36.82 36.85 1x88 h ILE 135 CO 0.00 0.01 -0.32 0.40 0.00 0.00 0.00 178.15 178.24 1x88 h ILE 136 N 0.06 0.34 -0.61 -0.67 2.04 -1.38 -0.04 117.51 117.25 1x88 h ILE 136 Ca 0.10 0.00 -0.06 0.00 1.00 0.00 0.00 64.86 65.90 1x88 h ILE 136 Cb 0.12 0.34 -0.03 0.00 -0.74 0.00 0.00 36.82 36.52 1x88 h ILE 136 CO -0.17 0.00 0.15 1.55 0.00 0.00 0.00 178.15 179.68 1x88 h PRO 137 N -0.69 0.95 -0.72 2.37 0.13 -1.81 -1.81 132.00 130.42 1x88 h PRO 137 Ca -0.03 -0.21 -0.05 0.00 -0.87 0.00 0.00 66.00 64.84 1x88 h PRO 137 Cb 0.61 -0.14 -0.03 0.00 0.13 0.00 0.00 31.00 31.58 1x88 h PRO 137 CO -0.04 0.85 0.24 0.00 -0.23 0.00 0.00 178.00 178.82 1x88 h ARG 138 N 0.91 1.11 -0.22 0.86 3.08 -1.38 -1.28 114.38 117.47 1x88 h ARG 138 Ca 0.20 -0.23 -0.02 0.00 0.07 0.00 0.00 59.98 59.99 1x88 h ARG 138 Cb 0.33 -0.16 -0.01 0.00 0.08 0.00 0.00 29.97 30.21 1x88 h ARG 138 CO 0.00 0.94 0.04 1.15 -1.07 0.00 0.00 179.97 181.04 1x88 h THR 139 N 1.06 1.22 -0.68 2.04 2.02 -0.75 -0.70 112.91 117.12 1x88 h THR 139 Ca 0.23 -0.71 -0.02 0.00 0.77 0.00 0.00 66.41 66.69 1x88 h THR 139 Cb 0.29 1.27 -0.03 0.00 -1.74 0.00 0.00 68.15 67.93 1x88 h THR 139 CO -0.01 0.22 0.36 -0.07 0.37 0.00 0.00 175.52 176.39 1x88 h LEU 140 N 0.16 0.85 -0.52 2.58 3.38 -1.20 -0.98 115.31 119.58 1x88 h LEU 140 Ca 0.07 -0.10 -0.03 0.00 0.09 0.00 0.00 57.88 57.90 1x88 h LEU 140 Cb 0.29 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.80 1x88 h LEU 140 CO 0.00 0.71 0.21 -0.74 0.09 0.00 0.00 178.44 178.71 1x88 h HIS 141 N 0.93 0.80 -0.02 1.13 2.76 -1.10 -2.95 115.15 116.70 1x88 h HIS 141 Ca 0.24 -0.06 -0.09 0.00 -2.20 0.00 0.00 60.37 58.26 1x88 h HIS 141 Cb 0.06 -0.24 -0.01 0.00 1.55 0.00 0.00 27.41 28.76 1x88 h HIS 141 CO -0.00 0.66 -0.41 1.96 -1.30 0.00 0.00 177.93 178.84 1x88 h GLN 142 N 0.71 0.04 -0.33 5.26 1.08 -0.77 -1.64 115.11 119.46 1x88 h GLN 142 Ca 0.17 -0.02 -0.00 0.00 -1.45 0.00 0.00 58.65 57.36 1x88 h GLN 142 Cb 0.20 -0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 27.62 1x88 h GLN 142 CO -0.01 0.44 0.20 0.82 -0.95 0.00 0.00 178.83 179.33 1x88 h ILE 143 N 0.03 1.11 -0.40 2.54 2.04 -1.01 0.11 117.51 121.93 1x88 h ILE 143 Ca 0.00 -0.24 -0.15 0.00 1.00 0.00 0.00 64.86 65.47 1x88 h ILE 143 Cb 0.74 0.67 -0.01 0.00 -0.74 0.00 0.00 36.82 37.48 1x88 h ILE 143 CO 0.05 0.11 -0.35 -0.26 0.00 0.00 0.00 178.15 177.70 1x88 h PHE 144 N 0.43 1.12 -0.74 1.37 0.04 -1.47 -1.64 116.94 116.04 1x88 h PHE 144 Ca 0.12 -0.33 -0.02 0.00 2.80 0.00 0.00 57.97 60.54 1x88 h PHE 144 Cb -0.00 -0.24 -0.03 0.00 2.20 0.00 0.00 35.95 37.87 1x88 h PHE 144 CO -0.04 1.16 0.38 1.49 -0.60 0.00 0.00 178.31 180.70 1x88 h GLU 145 N 0.77 1.06 0.06 1.51 4.57 -1.02 -1.21 114.58 120.31 1x88 h GLU 145 Ca 0.07 -0.14 -0.24 0.00 -1.18 0.00 0.00 59.36 57.87 1x88 h GLU 145 Cb 0.95 -0.20 -0.00 0.00 -0.16 0.00 0.00 28.75 29.33 1x88 h GLU 145 CO 0.09 0.81 -1.07 0.87 -1.18 0.00 0.00 179.01 178.52 1x88 h LYS 146 N 1.04 0.26 0.00 1.92 1.57 -0.73 -3.38 116.57 117.25 1x88 h LYS 146 Ca 0.26 -0.36 -0.21 0.00 -1.87 0.00 0.00 60.65 58.47 1x88 h LYS 146 Cb 0.08 0.12 -0.04 0.00 0.08 0.00 0.00 32.23 32.47 1x88 h LYS 146 CO -0.04 1.12 -1.89 1.28 -0.57 0.00 0.00 179.45 179.34 1x88 n LEU 147 N -3.59 0.39 -4.72 2.94 4.77 -0.62 -4.78 117.00 111.38 1x88 n LEU 147 Ca -0.06 0.17 -0.42 0.00 -0.03 0.00 0.00 56.01 55.67 1x88 n LEU 147 Cb 0.93 0.21 -0.03 0.00 -2.33 0.00 0.00 43.42 42.20 1x88 n LEU 147 CO 0.51 0.26 1.23 -0.89 -1.33 0.00 0.00 177.39 177.17 1x88 s THR 148 N -2.87 2.63 -1.49 -5.08 2.01 -0.46 -2.94 115.64 107.44 1x88 s THR 148 Ca -0.07 0.45 -0.12 0.00 0.31 0.00 0.00 61.69 62.26 1x88 s THR 148 Cb 0.09 -3.29 0.08 0.00 0.01 0.00 0.00 72.50 69.39 1x88 s THR 148 CO 0.84 0.04 0.82 0.47 -0.69 0.00 0.00 174.62 176.09 1x88 n ASP 149 N 3.96 -4.63 -0.86 3.53 9.92 -1.26 -4.87 116.55 122.33 1x88 n ASP 149 Ca 0.14 -0.64 0.05 0.00 -0.53 0.00 0.00 54.79 53.81 1x88 n ASP 149 Cb 0.39 -3.73 0.12 0.00 -0.64 0.00 0.00 41.12 37.25 1x88 n ASP 149 CO 0.00 0.00 0.00 0.59 0.13 0.00 0.00 177.20 177.92 1x88 n ASN 150 N -2.66 1.39 0.00 -2.24 3.02 -1.15 -4.97 115.26 108.65 1x88 n ASN 150 Ca 0.02 -2.99 0.00 0.00 -0.03 0.00 0.00 54.58 51.57 1x88 n ASN 150 Cb 0.54 -0.41 0.00 0.00 -0.61 0.00 0.00 39.78 39.29 1x88 n ASN 150 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1x88 n GLY 151 N -0.49 0.57 3.02 7.41 0.00 -1.26 -4.99 105.19 109.45 1x88 n GLY 151 Ca 0.13 -0.04 -0.29 0.00 0.00 0.00 0.00 46.02 45.81 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 -2.00 1.49 -0.06 2.61 2.01 -1.26 -1.33 115.64 117.10 1x88 s THR 152 Ca 0.00 -0.60 -0.25 0.00 0.31 0.00 0.00 61.69 61.15 1x88 s THR 152 Cb 0.00 -1.40 -0.03 0.00 0.01 0.00 0.00 72.50 71.08 1x88 s THR 152 CO 0.00 0.44 0.76 -1.61 -0.69 0.00 0.00 174.62 173.52 1x88 s GLU 153 N 1.37 4.45 0.10 4.92 2.02 -0.13 -4.77 118.70 126.67 1x88 s GLU 153 Ca 0.02 0.99 -0.12 0.00 0.02 0.00 0.00 54.97 55.87 1x88 s GLU 153 Cb -0.13 -3.46 0.02 0.00 0.10 0.00 0.00 34.13 30.65 1x88 s GLU 153 CO -0.08 0.01 0.29 -0.59 0.02 0.00 0.00 175.26 174.91 1x88 s PHE 154 N 0.95 -0.02 0.00 1.61 -0.12 -1.26 -0.40 117.98 118.74 1x88 s PHE 154 Ca 0.40 -0.34 0.02 0.00 -0.05 0.00 0.00 56.93 56.96 1x88 s PHE 154 Cb -0.18 0.09 -0.01 0.00 -0.63 0.00 0.00 43.02 42.29 1x88 s PHE 154 CO 0.19 -0.61 -0.08 -1.54 -0.05 0.00 0.00 175.22 173.14 1x88 s SER 155 N -2.79 0.89 -0.08 1.98 1.04 -0.46 -4.98 113.70 109.30 1x88 s SER 155 Ca 0.03 -0.20 0.05 0.00 0.48 0.00 0.00 55.95 56.31 1x88 s SER 155 Cb 0.03 -0.08 -0.01 0.00 0.10 0.00 0.00 66.02 66.07 1x88 s SER 155 CO -0.11 0.05 -0.24 -0.69 0.98 0.00 0.00 173.24 173.23 1x88 s VAL 156 N -0.35 2.13 -0.01 5.02 1.01 -1.26 -1.64 120.40 125.30 1x88 s VAL 156 Ca 0.01 -1.02 0.04 0.00 0.00 0.00 0.00 61.98 61.01 1x88 s VAL 156 Cb -0.04 -1.80 -0.01 0.00 0.00 0.00 0.00 36.38 34.54 1x88 s VAL 156 CO -0.00 0.56 -0.12 -0.54 0.00 0.00 0.00 175.10 175.01 1x88 s LYS 157 N 0.07 0.97 0.11 2.72 1.02 -0.61 -0.64 119.74 123.38 1x88 s LYS 157 Ca -0.10 -0.42 0.05 0.00 0.02 0.00 0.00 55.97 55.52 1x88 s LYS 157 Cb -0.16 -0.93 -0.04 0.00 -0.52 0.00 0.00 37.83 36.18 1x88 s LYS 157 CO 0.06 0.25 -0.13 0.14 -0.92 0.00 0.00 175.35 174.74 1x88 s VAL 158 N -0.24 1.24 0.02 3.17 -7.23 -0.08 -0.86 120.40 116.42 1x88 s VAL 158 Ca 0.04 -1.68 -0.10 0.00 -1.81 0.00 0.00 61.98 58.43 1x88 s VAL 158 Cb -0.05 -1.47 0.01 0.00 0.56 0.00 0.00 36.38 35.43 1x88 s VAL 158 CO -0.00 -0.44 0.20 -0.94 -0.31 0.00 0.00 175.10 173.61 1x88 s SER 159 N -2.42 -0.00 -0.28 4.85 1.04 -0.63 -0.42 113.70 115.84 1x88 s SER 159 Ca 0.08 -0.26 -0.02 0.00 0.48 0.00 0.00 55.95 56.22 1x88 s SER 159 Cb -0.05 0.28 0.09 0.00 0.10 0.00 0.00 66.02 66.44 1x88 s SER 159 CO 0.02 -0.50 0.09 -0.22 0.98 0.00 0.00 173.24 173.61 1x88 s LEU 160 N -1.83 1.72 -0.20 2.42 2.96 -1.26 -0.96 118.68 121.54 1x88 s LEU 160 Ca -0.08 -1.42 -0.08 0.00 -0.22 0.00 0.00 54.13 52.33 1x88 s LEU 160 Cb -0.03 -0.72 -0.04 0.00 0.50 0.00 0.00 46.19 45.90 1x88 s LEU 160 CO -0.01 -0.40 0.07 -0.22 -1.32 0.00 0.00 176.35 174.47 1x88 s LEU 161 N 1.75 3.79 0.07 -0.68 2.96 -0.55 -1.69 118.68 124.34 1x88 s LEU 161 Ca 0.08 0.04 0.08 0.00 -0.22 0.00 0.00 54.13 54.11 1x88 s LEU 161 Cb -0.17 -1.97 -0.03 0.00 0.50 0.00 0.00 46.19 44.52 1x88 s LEU 161 CO -0.24 0.13 -0.23 -1.61 -1.32 0.00 0.00 176.35 173.08 1x88 s GLU 162 N 0.61 1.40 -0.14 1.98 2.02 -0.04 0.00 118.70 124.54 1x88 s GLU 162 Ca 0.04 -1.08 0.02 0.00 0.02 0.00 0.00 54.97 53.97 1x88 s GLU 162 Cb -0.13 -1.61 0.01 0.00 0.10 0.00 0.00 34.13 32.50 1x88 s GLU 162 CO 0.01 0.40 -0.20 0.42 0.02 0.00 0.00 175.26 175.91 1x88 s ILE 163 N -0.92 2.23 -0.04 -1.63 1.01 0.42 -0.56 121.20 121.70 1x88 s ILE 163 Ca 0.09 -0.93 -0.02 0.00 0.00 0.00 0.00 60.65 59.79 1x88 s ILE 163 Cb -0.09 -1.90 0.03 0.00 0.01 0.00 0.00 42.46 40.51 1x88 s ILE 163 CO 0.03 0.54 0.06 -0.47 0.00 0.00 0.00 174.94 175.11 1x88 s TYR 164 N 0.73 0.03 -1.46 3.97 6.14 -0.53 -0.95 117.35 125.29 1x88 s TYR 164 Ca -0.08 0.27 -0.10 0.00 0.64 0.00 0.00 57.07 57.80 1x88 s TYR 164 Cb -0.16 -0.41 0.05 0.00 0.42 0.00 0.00 41.96 41.86 1x88 s TYR 164 CO 0.00 -0.18 0.80 -1.71 0.64 0.00 0.00 175.55 175.11 1x88 n ASN 165 N 5.08 -5.22 -1.47 4.32 4.05 -1.26 -1.11 115.26 119.65 1x88 n ASN 165 Ca -0.08 -0.51 -0.17 0.00 0.45 0.00 0.00 54.58 54.26 1x88 n ASN 165 Cb 0.50 -4.19 -0.06 0.00 1.23 0.00 0.00 39.78 37.26 1x88 n ASN 165 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 177.26 173.59 1x88 n GLU 166 N -4.35 -1.24 -4.22 1.20 -0.58 -1.26 -5.00 120.64 105.19 1x88 n GLU 166 Ca -0.02 1.06 -0.29 0.00 -0.42 0.00 0.00 57.16 57.49 1x88 n GLU 166 Cb 0.56 -5.34 -0.09 0.00 -0.57 0.00 0.00 31.44 26.00 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 -3.76 2.18 -0.10 3.49 2.02 -0.27 -4.95 118.70 117.32 1x88 s GLU 167 Ca 0.00 -1.04 -0.03 0.00 0.02 0.00 0.00 54.97 53.92 1x88 s GLU 167 Cb 0.00 -2.31 -0.03 0.00 0.10 0.00 0.00 34.13 31.88 1x88 s GLU 167 CO 0.00 0.50 0.02 -0.51 0.02 0.00 0.00 175.26 175.28 1x88 s LEU 168 N -2.37 3.66 0.02 1.80 1.43 -1.26 -1.45 118.68 120.52 1x88 s LEU 168 Ca 0.23 0.16 0.03 0.00 -1.03 0.00 0.00 54.13 53.51 1x88 s LEU 168 Cb -0.11 -1.85 -0.02 0.00 0.03 0.00 0.00 46.19 44.25 1x88 s LEU 168 CO 0.15 0.35 -0.09 -0.36 0.23 0.00 0.00 176.35 176.63 1x88 s PHE 169 N -0.73 0.79 -0.40 0.29 0.40 0.27 -1.18 117.98 117.42 1x88 s PHE 169 Ca 0.12 -0.32 -0.11 0.00 -0.60 0.00 0.00 56.93 56.02 1x88 s PHE 169 Cb -0.12 -0.48 0.05 0.00 0.51 0.00 0.00 43.02 42.98 1x88 s PHE 169 CO 0.02 -0.02 0.25 0.34 0.70 0.00 0.00 175.22 176.51 1x88 s ASP 170 N -0.95 5.76 0.00 1.36 -1.08 -1.26 -0.86 116.67 119.64 1x88 s ASP 170 Ca -0.02 -1.23 0.26 0.00 -0.52 0.00 0.00 52.55 51.04 1x88 s ASP 170 Cb -0.07 -2.03 1.12 0.00 -1.46 0.00 0.00 42.92 40.48 1x88 s ASP 170 CO 0.00 -0.48 1.77 0.18 0.52 0.00 0.00 175.17 177.17 1x88 n LEU 171 N 5.00 1.21 -0.01 -1.34 7.99 -0.68 -3.99 117.00 125.17 1x88 n LEU 171 Ca -0.11 -0.44 0.06 0.00 -0.01 0.00 0.00 56.01 55.51 1x88 n LEU 171 Cb 0.44 -0.03 -0.10 0.00 -0.11 0.00 0.00 43.42 43.63 1x88 n LEU 171 CO 0.39 0.22 -0.67 0.18 -1.51 0.00 0.00 177.39 176.00 1x88 n LEU 172 N -0.04 0.00 -4.56 2.23 4.77 -1.26 -3.95 117.00 114.19 1x88 n LEU 172 Ca 0.19 0.00 -0.42 0.00 -0.03 0.00 0.00 56.01 55.75 1x88 n LEU 172 Cb 0.29 0.01 -0.04 0.00 -2.33 0.00 0.00 43.42 41.36 1x88 n LEU 172 CO 0.15 0.01 1.92 -3.20 -1.33 0.00 0.00 177.39 174.94 1x88 n ASN 173 N -1.98 2.72 0.28 -1.43 2.85 -1.26 -4.84 115.26 111.61 1x88 n ASN 173 Ca -0.03 -0.00 0.15 0.00 -0.11 0.00 0.00 54.58 54.59 1x88 n ASN 173 Cb 0.37 -1.51 0.81 0.00 1.24 0.00 0.00 39.78 40.69 1x88 n ASN 173 CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 1x88 h PRO 174 N 16.10 0.00 -0.38 1.20 0.11 -1.94 -2.96 132.00 144.13 1x88 h PRO 174 Ca -0.33 0.00 -0.10 0.00 0.11 0.00 0.00 66.00 65.68 1x88 h PRO 174 Cb 1.26 0.00 -0.06 0.00 0.11 0.00 0.00 31.00 32.31 1x88 h PRO 174 CO 1.04 0.08 0.04 -1.13 -0.21 0.00 0.00 178.00 177.82 1x88 n SER 175 N -3.44 3.63 -4.28 -2.05 3.41 -1.26 -4.99 113.62 104.64 1x88 n SER 175 Ca -0.02 -3.28 -0.23 0.00 -0.26 0.00 0.00 58.87 55.08 1x88 n SER 175 Cb 0.22 -0.61 -0.12 0.00 -0.26 0.00 0.00 64.21 63.43 1x88 n SER 175 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1x88 s SER 176 N -1.96 2.47 0.10 4.04 0.15 -1.12 -5.15 113.70 112.24 1x88 s SER 176 Ca 0.45 -0.69 0.01 0.00 0.70 0.00 0.00 55.95 56.43 1x88 s SER 176 Cb 0.38 -0.13 -0.04 0.00 -1.71 0.00 0.00 66.02 64.52 1x88 s SER 176 CO 0.07 0.04 0.24 -0.62 1.20 0.00 0.00 173.24 174.17 1x88 s ASP 177 N -1.93 6.29 0.11 5.45 2.15 -1.26 -4.95 116.67 122.53 1x88 s ASP 177 Ca 0.06 0.20 0.14 0.00 0.43 0.00 0.00 52.55 53.38 1x88 s ASP 177 Cb -0.10 -1.90 0.62 0.00 -0.30 0.00 0.00 42.92 41.24 1x88 s ASP 177 CO 0.04 0.11 1.42 0.52 -0.17 0.00 0.00 175.17 177.10 1x88 n VAL 178 N -0.10 1.24 0.69 1.11 0.31 -1.26 -1.46 118.33 118.86 1x88 n VAL 178 Ca -0.06 0.39 0.13 0.00 -0.01 0.00 0.00 64.34 64.79 1x88 n VAL 178 Cb 0.52 -1.29 0.38 0.00 -0.91 0.00 0.00 33.84 32.54 1x88 n VAL 178 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 1x88 n SER 179 N -1.78 0.65 -4.56 4.52 3.41 -1.26 -4.70 113.62 109.90 1x88 n SER 179 Ca 0.01 0.43 -0.43 0.00 -0.26 0.00 0.00 58.87 58.62 1x88 n SER 179 Cb 0.11 -0.49 -0.05 0.00 -0.26 0.00 0.00 64.21 63.52 1x88 n SER 179 CO 0.00 0.00 0.00 -0.70 -0.16 0.00 0.00 175.04 174.18 1x88 s GLU 180 N -3.09 3.56 0.22 4.33 -6.30 -0.53 -5.04 118.70 111.85 1x88 s GLU 180 Ca 0.10 0.10 -0.06 0.00 -2.50 0.00 0.00 54.97 52.60 1x88 s GLU 180 Cb 0.14 -3.88 -0.06 0.00 0.00 0.00 0.00 34.13 30.32 1x88 s GLU 180 CO 0.62 -1.02 0.49 1.03 0.02 0.00 0.00 175.26 176.40 1x88 s ARG 181 N 3.27 3.68 0.27 4.30 0.52 -1.26 -4.68 118.95 125.06 1x88 s ARG 181 Ca 0.31 0.06 0.03 0.00 -0.52 0.00 0.00 55.73 55.61 1x88 s ARG 181 Cb -0.12 -2.71 -0.03 0.00 0.52 0.00 0.00 34.95 32.60 1x88 s ARG 181 CO 0.21 0.33 0.43 -0.51 0.02 0.00 0.00 175.30 175.78 1x88 s LEU 182 N -3.03 4.20 -0.06 2.53 1.43 -0.32 -5.00 118.68 118.44 1x88 s LEU 182 Ca 0.44 0.23 0.01 0.00 -1.03 0.00 0.00 54.13 53.78 1x88 s LEU 182 Cb -0.11 -3.05 -0.03 0.00 0.03 0.00 0.00 46.19 43.03 1x88 s LEU 182 CO 0.25 -0.14 -0.06 -1.10 0.23 0.00 0.00 176.35 175.53 1x88 s GLN 183 N -4.02 2.75 -0.09 1.70 -0.21 -1.25 -4.37 119.66 114.16 1x88 s GLN 183 Ca 0.36 -0.56 -0.01 0.00 0.02 0.00 0.00 55.36 55.18 1x88 s GLN 183 Cb -0.09 -2.61 -0.03 0.00 1.00 0.00 0.00 33.01 31.28 1x88 s GLN 183 CO 0.31 0.66 -0.04 1.41 -2.12 0.00 0.00 175.29 175.52 1x88 s MET 184 N -0.94 3.05 0.07 2.91 -2.45 -1.26 -1.43 119.30 119.26 1x88 s MET 184 Ca 0.13 -0.49 0.02 0.00 -1.25 0.00 0.00 55.69 54.11 1x88 s MET 184 Cb -0.11 -2.74 -0.03 0.00 1.25 0.00 0.00 34.83 33.19 1x88 s MET 184 CO 0.03 0.58 -0.08 -0.06 1.05 0.00 0.00 175.02 176.54 1x88 s PHE 185 N -0.56 0.85 0.30 4.11 0.40 0.11 -4.96 117.98 118.23 1x88 s PHE 185 Ca 0.09 -0.68 -0.29 0.00 -0.60 0.00 0.00 56.93 55.45 1x88 s PHE 185 Cb -0.12 -0.49 -0.09 0.00 0.51 0.00 0.00 43.02 42.83 1x88 s PHE 185 CO 0.02 -0.09 1.09 -0.51 0.70 0.00 0.00 175.22 176.43 1x88 s ASP 186 N -2.30 7.20 -0.21 1.36 1.01 -1.26 0.11 116.67 122.58 1x88 s ASP 186 Ca 0.01 2.23 -0.29 0.00 0.71 0.00 0.00 52.55 55.22 1x88 s ASP 186 Cb -0.03 -2.62 -0.01 0.00 1.01 0.00 0.00 42.92 41.27 1x88 s ASP 186 CO -0.01 -0.19 1.23 -0.62 0.21 0.00 0.00 175.17 175.79 1x88 s ASP 187 N -0.98 6.91 0.59 0.27 -1.08 -0.98 -4.65 116.67 116.74 1x88 s ASP 187 Ca 0.46 1.52 0.28 0.00 -0.52 0.00 0.00 52.55 54.30 1x88 s ASP 187 Cb -0.30 -2.54 1.56 0.00 -1.46 0.00 0.00 42.92 40.17 1x88 s ASP 187 CO 0.39 -0.82 2.00 -0.65 0.52 0.00 0.00 175.17 176.61 1x88 h PRO 188 N 8.32 0.00 0.00 4.34 0.11 -1.93 -3.00 132.00 139.84 1x88 h PRO 188 Ca -0.25 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.86 1x88 h PRO 188 Cb 1.09 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.20 1x88 h PRO 188 CO 0.99 0.00 -0.05 0.00 -0.21 0.00 0.00 178.00 178.73 1x88 h ARG 189 N 0.00 0.00 -5.55 1.05 3.08 -1.98 -3.45 114.38 107.53 1x88 h ARG 189 Ca 0.15 0.00 -0.60 0.00 0.07 0.00 0.00 59.98 59.60 1x88 h ARG 189 Cb 0.83 0.00 -0.11 0.00 0.08 0.00 0.00 29.97 30.77 1x88 h ARG 189 CO -0.00 0.00 0.10 1.21 -1.07 0.00 0.00 179.97 180.21 1x88 s ASN 190 N -4.52 6.60 0.19 7.04 3.04 -1.13 -4.97 114.94 121.18 1x88 s ASN 190 Ca -0.01 0.72 -0.11 0.00 0.04 0.00 0.00 52.86 53.50 1x88 s ASN 190 Cb 0.00 -2.33 0.12 0.00 -1.54 0.00 0.00 41.25 37.50 1x88 s ASN 190 CO 0.02 -0.30 1.83 0.11 -3.04 0.00 0.00 177.10 175.72 1x88 h LYS 191 N 7.70 0.92 -1.00 0.43 1.57 -1.88 -2.58 116.57 121.72 1x88 h LYS 191 Ca -0.30 -0.09 -0.51 0.00 -1.87 0.00 0.00 60.65 57.89 1x88 h LYS 191 Cb 1.14 -0.19 -0.30 0.00 0.08 0.00 0.00 32.23 32.96 1x88 h LYS 191 CO 0.76 0.66 0.65 2.89 -0.57 0.00 0.00 179.45 183.84 1x88 n ARG 192 N -4.56 2.24 -4.58 3.15 1.85 -1.26 -4.85 116.66 108.64 1x88 n ARG 192 Ca 0.05 -2.91 -0.26 0.00 -1.00 0.00 0.00 57.85 53.73 1x88 n ARG 192 Cb 0.06 -2.14 -0.11 0.00 -1.05 0.00 0.00 32.46 29.22 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 -1.25 2.42 0.13 2.89 0.00 -0.97 -4.72 107.32 105.82 1x88 s GLY 193 Ca 0.55 -2.07 -0.05 0.00 0.00 0.00 0.00 44.72 43.15 1x88 s GLY 193 CO 0.10 -2.02 0.14 -1.34 0.00 0.00 0.00 173.10 169.98 1x88 s VAL 194 N -2.90 0.11 -0.13 1.40 -7.23 -1.26 -2.32 120.40 108.06 1x88 s VAL 194 Ca 0.33 -1.64 0.02 0.00 -1.81 0.00 0.00 61.98 58.88 1x88 s VAL 194 Cb 0.09 -1.85 0.01 0.00 0.56 0.00 0.00 36.38 35.20 1x88 s VAL 194 CO 0.16 -0.48 -0.19 -0.63 -0.31 0.00 0.00 175.10 173.65 1x88 s ILE 195 N -3.99 1.80 -0.72 -0.62 -1.09 0.30 -4.65 121.20 112.22 1x88 s ILE 195 Ca 0.18 -0.82 -0.14 0.00 -2.23 0.00 0.00 60.65 57.64 1x88 s ILE 195 Cb 0.06 -1.61 0.19 0.00 -1.58 0.00 0.00 42.46 39.51 1x88 s ILE 195 CO -0.01 0.50 0.66 -0.63 -1.23 0.00 0.00 174.94 174.22 1x88 s ILE 196 N 0.93 5.34 0.04 2.92 -1.09 -1.26 -0.71 121.20 127.37 1x88 s ILE 196 Ca -0.06 -2.21 -0.30 0.00 -2.23 0.00 0.00 60.65 55.85 1x88 s ILE 196 Cb -0.15 -4.35 -0.08 0.00 -1.58 0.00 0.00 42.46 36.30 1x88 s ILE 196 CO -0.02 -0.97 1.82 -0.75 -1.23 0.00 0.00 174.94 173.79 1x88 s LYS 197 N 0.59 4.16 0.00 2.79 2.20 -0.51 -2.43 119.74 126.53 1x88 s LYS 197 Ca 0.13 2.48 0.00 0.00 -0.36 0.00 0.00 55.97 58.22 1x88 s LYS 197 Cb -0.17 -3.90 0.00 0.00 -1.51 0.00 0.00 37.83 32.25 1x88 s LYS 197 CO -0.05 -0.87 0.00 0.41 -0.36 0.00 0.00 175.35 174.48 1x88 n GLY 198 N 4.30 1.21 3.69 5.54 0.00 -1.26 -3.84 105.19 114.83 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 4.36 -0.04 0.99 2.96 -1.02 -4.97 118.68 120.96 1x88 s LEU 199 Ca 0.00 2.48 -0.18 0.00 -0.22 0.00 0.00 54.13 56.22 1x88 s LEU 199 Cb 0.00 -3.57 -0.05 0.00 0.50 0.00 0.00 46.19 43.07 1x88 s LEU 199 CO 0.00 -0.88 0.49 -1.61 -1.32 0.00 0.00 176.35 173.04 1x88 s GLU 200 N 2.51 4.21 -0.26 1.98 2.02 -1.26 -5.06 118.70 122.85 1x88 s GLU 200 Ca 0.73 0.53 -0.06 0.00 0.02 0.00 0.00 54.97 56.19 1x88 s GLU 200 Cb -0.40 -3.34 -0.01 0.00 0.10 0.00 0.00 34.13 30.48 1x88 s GLU 200 CO 0.32 0.39 0.05 -1.21 0.02 0.00 0.00 175.26 174.83 1x88 s GLU 201 N -0.17 3.41 -0.14 1.61 2.02 -1.26 -4.55 118.70 119.62 1x88 s GLU 201 Ca 0.27 -0.63 -0.17 0.00 0.02 0.00 0.00 54.97 54.46 1x88 s GLU 201 Cb -0.17 -3.27 -0.04 0.00 0.10 0.00 0.00 34.13 30.75 1x88 s GLU 201 CO 0.13 -0.27 0.42 0.42 0.02 0.00 0.00 175.26 175.98 1x88 s ILE 202 N 1.55 5.22 -0.03 -1.63 -1.09 0.44 -4.84 121.20 120.82 1x88 s ILE 202 Ca 0.05 0.81 -0.29 0.00 -2.23 0.00 0.00 60.65 59.00 1x88 s ILE 202 Cb -0.16 -3.76 -0.03 0.00 -1.58 0.00 0.00 42.46 36.94 1x88 s ILE 202 CO 0.02 0.33 0.94 -0.89 -1.23 0.00 0.00 174.94 174.10 1x88 s THR 203 N 0.71 4.88 -0.55 2.92 2.01 -1.26 -0.90 115.64 123.45 1x88 s THR 203 Ca 0.22 1.96 -0.11 0.00 0.31 0.00 0.00 61.69 64.07 1x88 s THR 203 Cb -0.14 -4.27 0.14 0.00 0.01 0.00 0.00 72.50 68.23 1x88 s THR 203 CO 0.08 0.15 0.45 -0.69 -0.69 0.00 0.00 174.62 173.92 1x88 s VAL 204 N 1.14 4.60 0.39 3.82 1.01 0.19 -4.95 120.40 126.60 1x88 s VAL 204 Ca 0.49 -1.91 0.10 0.00 0.00 0.00 0.00 61.98 60.66 1x88 s VAL 204 Cb -0.20 -3.98 0.16 0.00 0.00 0.00 0.00 36.38 32.36 1x88 s VAL 204 CO 0.25 -0.84 1.92 0.45 0.00 0.00 0.00 175.10 176.87 1x88 h HIS 205 N 8.35 0.21 -2.88 5.22 3.86 -1.94 -3.37 115.15 124.60 1x88 h HIS 205 Ca -0.17 -0.02 0.07 0.00 -1.16 0.00 0.00 60.37 59.09 1x88 h HIS 205 Cb 1.06 -0.06 -0.07 0.00 1.06 0.00 0.00 27.41 29.40 1x88 h HIS 205 CO 0.72 0.35 0.27 0.54 0.86 0.00 0.00 177.93 180.68 1x88 s ASN 206 N -6.89 -0.30 0.61 2.45 2.20 -1.26 -5.01 114.94 106.73 1x88 s ASN 206 Ca -0.05 -0.46 0.31 0.00 -0.94 0.00 0.00 52.86 51.72 1x88 s ASN 206 Cb 0.15 0.66 1.77 0.00 -2.00 0.00 0.00 41.25 41.84 1x88 s ASN 206 CO 0.73 -1.19 2.14 0.07 -2.94 0.00 0.00 177.10 175.90 1x88 h LYS 207 N 2.00 0.00 0.00 3.55 2.10 -1.93 -1.19 116.57 121.10 1x88 h LYS 207 Ca -0.22 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.43 1x88 h LYS 207 Cb 1.26 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.59 1x88 h LYS 207 CO 0.26 0.00 0.00 -0.25 -2.00 0.00 0.00 179.45 177.46 1x88 n ASP 208 N -3.63 0.00 -0.12 7.07 8.00 -1.26 -2.65 116.55 123.96 1x88 n ASP 208 Ca 0.00 -1.49 0.04 0.00 0.71 0.00 0.00 54.79 54.06 1x88 n ASP 208 Cb 0.27 0.00 -0.02 0.00 -0.02 0.00 0.00 41.12 41.35 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 -0.73 2.97 0.42 -1.24 1.02 -0.45 -4.76 120.64 117.87 1x88 n GLU 209 Ca 0.11 -0.33 -0.18 0.00 -0.02 0.00 0.00 57.16 56.74 1x88 n GLU 209 Cb 0.05 -1.00 -0.09 0.00 -0.02 0.00 0.00 31.44 30.38 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 0.59 0.14 -0.68 2.62 2.07 -1.60 -3.15 116.25 116.25 1x88 h VAL 210 Ca 0.00 -0.13 0.06 0.00 0.82 0.00 0.00 66.70 67.45 1x88 h VAL 210 Cb 0.27 0.16 -0.06 0.00 -1.52 0.00 0.00 31.29 30.15 1x88 h VAL 210 CO 0.00 0.01 0.37 0.22 0.02 0.00 0.00 177.57 178.19 1x88 h TYR 211 N -1.17 0.68 -0.80 1.57 -0.00 -1.86 -1.85 116.97 113.54 1x88 h TYR 211 Ca -0.11 0.03 0.03 0.00 -0.00 0.00 0.00 58.73 58.68 1x88 h TYR 211 Cb 0.83 -0.20 -0.04 0.00 -0.00 0.00 0.00 36.73 37.31 1x88 h TYR 211 CO -0.01 0.31 0.53 0.37 -0.00 0.00 0.00 178.16 179.36 1x88 h GLN 212 N 0.68 0.97 -0.34 1.82 4.15 -1.88 0.17 115.11 120.69 1x88 h GLN 212 Ca 0.31 -0.06 -0.06 0.00 0.77 0.00 0.00 58.65 59.60 1x88 h GLN 212 Cb 0.21 -0.22 -0.01 0.00 0.21 0.00 0.00 27.48 27.67 1x88 h GLN 212 CO -0.19 0.64 -0.04 0.82 -1.93 0.00 0.00 178.83 178.13 1x88 h ILE 213 N 1.00 1.27 -0.64 2.39 2.04 -1.32 -1.41 117.51 120.85 1x88 h ILE 213 Ca 0.31 -1.05 -0.08 0.00 1.00 0.00 0.00 64.86 65.04 1x88 h ILE 213 Cb 0.01 1.28 -0.03 0.00 -0.74 0.00 0.00 36.82 37.34 1x88 h ILE 213 CO -0.09 0.34 0.08 -0.07 0.00 0.00 0.00 178.15 178.42 1x88 h LEU 214 N 0.42 1.02 -0.94 1.44 3.38 -0.67 -2.69 115.31 117.26 1x88 h LEU 214 Ca 0.09 -0.25 -0.05 0.00 0.09 0.00 0.00 57.88 57.76 1x88 h LEU 214 Cb 0.52 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.97 1x88 h LEU 214 CO 0.03 1.03 0.18 -0.33 0.09 0.00 0.00 178.44 179.44 1x88 h GLU 215 N 0.99 0.96 -0.63 1.13 5.08 -0.52 -1.96 114.58 119.62 1x88 h GLU 215 Ca 0.19 -0.19 -0.01 0.00 -1.00 0.00 0.00 59.36 58.35 1x88 h GLU 215 Cb 0.46 -0.15 -0.03 0.00 0.50 0.00 0.00 28.75 29.54 1x88 h GLU 215 CO 0.02 0.83 0.34 -0.22 -1.00 0.00 0.00 179.01 178.98 1x88 h LYS 216 N 0.92 0.89 -0.65 2.33 1.63 -0.97 -0.63 116.57 120.10 1x88 h LYS 216 Ca 0.20 -0.11 -0.05 0.00 -0.85 0.00 0.00 60.65 59.85 1x88 h LYS 216 Cb 0.28 -0.17 -0.03 0.00 -0.60 0.00 0.00 32.23 31.71 1x88 h LYS 216 CO -0.01 0.67 0.20 0.78 -3.45 0.00 0.00 179.45 177.65 1x88 h GLY 217 N 0.86 1.06 1.04 5.01 0.00 -1.17 -1.50 103.07 108.37 1x88 h GLY 217 Ca 0.22 -0.60 -0.07 0.00 0.00 0.00 0.00 47.33 46.88 1x88 h GLY 217 CO -0.04 0.57 0.13 0.00 0.00 0.00 0.00 176.54 177.20 1x88 h ALA 218 N 1.26 0.83 -0.53 3.60 0.00 -0.77 -1.19 119.26 122.46 1x88 h ALA 218 Ca 0.21 -0.25 -0.05 0.00 0.00 0.00 0.00 54.91 54.82 1x88 h ALA 218 Cb 0.27 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 1x88 h ALA 218 CO -0.01 0.57 0.12 0.00 0.00 0.00 0.00 179.25 179.93 1x88 h ALA 219 N 1.04 0.70 -0.17 0.00 0.00 -0.77 -2.42 119.26 117.64 1x88 h ALA 219 Ca 0.20 -0.22 -0.09 0.00 0.00 0.00 0.00 54.91 54.80 1x88 h ALA 219 Cb 0.39 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 1x88 h ALA 219 CO 0.01 0.40 -0.27 -0.22 0.00 0.00 0.00 179.25 179.17 1x88 h LYS 220 N 0.75 0.32 -0.06 0.00 3.64 -1.10 -2.36 116.57 117.77 1x88 h LYS 220 Ca 0.17 -0.12 -0.06 0.00 -1.27 0.00 0.00 60.65 59.37 1x88 h LYS 220 Cb 0.35 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 32.14 1x88 h LYS 220 CO 0.00 0.57 -0.22 0.00 -2.27 0.00 0.00 179.45 177.53 1x88 h ARG 221 N 0.29 0.10 -0.73 1.90 3.08 -0.84 -1.58 114.38 116.59 1x88 h ARG 221 Ca 0.04 -0.03 -0.06 0.00 0.07 0.00 0.00 59.98 60.01 1x88 h ARG 221 Cb 0.63 -0.01 -0.03 0.00 0.08 0.00 0.00 29.97 30.64 1x88 h ARG 221 CO 0.05 0.32 0.21 1.15 -1.07 0.00 0.00 179.97 180.63 1x88 h THR 222 N 0.09 1.26 -0.30 2.04 2.02 -0.95 -0.67 112.91 116.40 1x88 h THR 222 Ca 0.02 -0.93 -0.12 0.00 0.77 0.00 0.00 66.41 66.14 1x88 h THR 222 Cb 0.45 0.47 -0.01 0.00 -1.74 0.00 0.00 68.15 67.32 1x88 h THR 222 CO 0.03 0.36 -0.32 0.71 0.37 0.00 0.00 175.52 176.68 1x88 h THR 223 N 1.10 1.28 -0.82 3.16 1.35 -1.30 -2.52 112.91 115.16 1x88 h THR 223 Ca 0.23 -1.44 -0.04 0.00 -0.55 0.00 0.00 66.41 64.62 1x88 h THR 223 Cb 0.33 1.40 -0.04 0.00 -1.73 0.00 0.00 68.15 68.11 1x88 h THR 223 CO -0.00 0.46 0.35 0.00 -0.25 0.00 0.00 175.52 176.08 1x88 h ALA 224 N 1.12 1.07 -0.26 6.62 0.00 -0.81 -2.34 119.26 124.66 1x88 h ALA 224 Ca 0.06 -0.19 -0.04 0.00 0.00 0.00 0.00 54.91 54.75 1x88 h ALA 224 Cb 0.81 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 18.26 1x88 h ALA 224 CO 0.07 0.67 -0.02 0.00 0.00 0.00 0.00 179.25 179.97 1x88 h ALA 225 N 1.19 1.50 -0.26 0.00 0.00 -0.80 0.23 119.26 121.11 1x88 h ALA 225 Ca 0.28 -0.17 -0.17 0.00 0.00 0.00 0.00 54.91 54.84 1x88 h ALA 225 Cb 0.18 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 17.85 1x88 h ALA 225 CO -0.03 0.36 -0.53 1.15 0.00 0.00 0.00 179.25 180.20 1x88 h THR 226 N 0.38 1.29 0.03 0.00 2.02 -1.05 -3.31 112.91 112.26 1x88 h THR 226 Ca 0.08 -1.74 -0.25 0.00 0.77 0.00 0.00 66.41 65.28 1x88 h THR 226 Cb 0.28 1.66 -0.03 0.00 -1.74 0.00 0.00 68.15 68.32 1x88 h THR 226 CO 0.01 0.56 -1.26 -0.07 0.37 0.00 0.00 175.52 175.13 1x88 h LEU 227 N 0.59 0.10 -8.35 2.58 -0.00 -0.91 -3.46 115.31 105.87 1x88 h LEU 227 Ca 0.02 -0.13 -0.68 0.00 -0.00 0.00 0.00 57.88 57.09 1x88 h LEU 227 Cb 1.12 -0.03 -0.32 0.00 -0.00 0.00 0.00 40.66 41.42 1x88 h LEU 227 CO 0.11 1.10 -0.87 -0.04 -0.00 0.00 0.00 178.44 178.75 1x88 s MET 228 N -2.67 3.08 0.23 1.13 -1.94 0.75 -5.10 119.30 114.79 1x88 s MET 228 Ca -0.02 -0.85 -0.31 0.00 -1.71 0.00 0.00 55.69 52.79 1x88 s MET 228 Cb 0.09 -2.36 -0.12 0.00 2.01 0.00 0.00 34.83 34.45 1x88 s MET 228 CO 0.83 0.15 1.69 -0.80 -0.01 0.00 0.00 175.02 176.88 1x88 s ASN 229 N 0.43 6.38 -1.66 3.03 0.01 -1.26 -2.60 114.94 119.26 1x88 s ASN 229 Ca -0.16 2.88 -0.16 0.00 -0.71 0.00 0.00 52.86 54.71 1x88 s ASN 229 Cb -0.17 -2.61 0.14 0.00 0.41 0.00 0.00 41.25 39.01 1x88 s ASN 229 CO 0.07 -0.96 0.77 0.00 -1.51 0.00 0.00 177.10 175.47 1x88 n ALA 230 N 3.54 -1.34 -0.20 0.60 0.00 -1.26 -4.82 120.51 117.03 1x88 n ALA 230 Ca 0.14 -0.02 0.00 0.00 0.00 0.00 0.00 53.44 53.57 1x88 n ALA 230 Cb 0.36 -3.38 0.11 0.00 0.00 0.00 0.00 19.45 16.54 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 -1.59 0.26 0.00 0.00 5.03 -1.78 -0.11 116.97 118.77 1x88 h TYR 231 Ca -0.59 0.03 -0.01 0.00 2.58 0.00 0.00 58.73 60.74 1x88 h TYR 231 Cb 1.38 -0.02 -0.00 0.00 1.55 0.00 0.00 36.73 39.64 1x88 h TYR 231 CO 0.61 0.00 -0.06 0.66 -1.32 0.00 0.00 178.16 178.06 1x88 h SER 232 N 0.30 0.00 0.06 -2.11 4.64 -1.89 -1.57 113.55 112.98 1x88 h SER 232 Ca 0.31 0.00 -0.36 0.00 -0.47 0.00 0.00 61.79 61.27 1x88 h SER 232 Cb 0.44 0.00 -0.07 0.00 -0.31 0.00 0.00 62.40 62.47 1x88 h SER 232 CO -0.37 0.06 -2.32 -1.20 -0.87 0.00 0.00 176.83 172.12 1x88 n SER 233 N -3.61 0.47 0.02 4.97 7.64 -0.70 -4.58 113.62 117.82 1x88 n SER 233 Ca -0.02 0.03 0.11 0.00 1.01 0.00 0.00 58.87 59.99 1x88 n SER 233 Cb 0.16 0.61 -0.06 0.00 -1.01 0.00 0.00 64.21 63.91 1x88 n SER 233 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 1x88 n ARG 234 N -2.88 0.39 -2.55 1.43 1.74 -0.13 -0.62 116.66 114.04 1x88 n ARG 234 Ca -0.33 -0.05 -0.28 0.00 -0.77 0.00 0.00 57.85 56.42 1x88 n ARG 234 Cb 1.12 -1.58 0.00 0.00 -1.02 0.00 0.00 32.46 30.98 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 -4.10 6.22 -0.06 0.55 1.04 -0.60 -4.71 113.70 112.04 1x88 s SER 235 Ca 0.00 0.96 0.05 0.00 0.48 0.00 0.00 55.95 57.44 1x88 s SER 235 Cb 0.14 -2.23 -0.02 0.00 0.10 0.00 0.00 66.02 64.01 1x88 s SER 235 CO 0.85 -0.64 -0.19 -1.00 0.98 0.00 0.00 173.24 173.24 1x88 s HIS 236 N -2.80 2.58 -0.03 5.02 3.76 -0.12 -2.95 115.29 120.74 1x88 s HIS 236 Ca 0.49 -0.44 0.06 0.00 -0.15 0.00 0.00 55.06 55.02 1x88 s HIS 236 Cb -0.10 -1.63 -0.01 0.00 1.11 0.00 0.00 32.58 31.94 1x88 s HIS 236 CO 0.46 -0.02 -0.21 -1.54 -0.85 0.00 0.00 174.74 172.58 1x88 s SER 237 N -0.39 2.48 -0.27 1.40 1.04 -0.48 -0.44 113.70 117.03 1x88 s SER 237 Ca 0.04 -0.39 0.03 0.00 0.48 0.00 0.00 55.95 56.10 1x88 s SER 237 Cb -0.12 -0.46 0.07 0.00 0.10 0.00 0.00 66.02 65.60 1x88 s SER 237 CO 0.02 0.23 -0.07 -0.69 0.98 0.00 0.00 173.24 173.70 1x88 s VAL 238 N -0.28 2.07 -0.33 5.02 1.01 0.10 -1.40 120.40 126.59 1x88 s VAL 238 Ca 0.03 -1.69 -0.13 0.00 0.00 0.00 0.00 61.98 60.18 1x88 s VAL 238 Cb -0.10 -2.27 -0.02 0.00 0.00 0.00 0.00 36.38 33.99 1x88 s VAL 238 CO 0.01 -0.15 0.28 0.12 0.00 0.00 0.00 175.10 175.36 1x88 s PHE 239 N 1.12 3.22 -0.08 5.22 2.19 -0.09 -1.48 117.98 128.08 1x88 s PHE 239 Ca -0.05 -0.07 0.01 0.00 0.33 0.00 0.00 56.93 57.16 1x88 s PHE 239 Cb -0.20 -2.53 -0.03 0.00 -1.31 0.00 0.00 43.02 38.96 1x88 s PHE 239 CO -0.06 -0.34 -0.10 -1.12 1.83 0.00 0.00 175.22 175.42 1x88 s SER 240 N 1.73 4.34 -0.10 6.13 0.01 -0.13 -0.00 113.70 125.67 1x88 s SER 240 Ca 0.08 -0.14 0.03 0.00 1.31 0.00 0.00 55.95 57.23 1x88 s SER 240 Cb -0.17 -1.19 0.01 0.00 0.21 0.00 0.00 66.02 64.88 1x88 s SER 240 CO 0.11 0.31 -0.19 -0.69 0.41 0.00 0.00 173.24 173.18 1x88 s VAL 241 N -0.48 1.77 -0.09 3.43 1.01 0.26 -1.60 120.40 124.70 1x88 s VAL 241 Ca 0.07 -0.83 0.04 0.00 0.00 0.00 0.00 61.98 61.26 1x88 s VAL 241 Cb -0.12 -1.56 -0.00 0.00 0.00 0.00 0.00 36.38 34.70 1x88 s VAL 241 CO 0.02 0.49 -0.24 -0.89 0.00 0.00 0.00 175.10 174.49 1x88 s THR 242 N 0.64 2.01 -0.16 3.92 2.01 -0.04 -0.69 115.64 123.33 1x88 s THR 242 Ca -0.13 -1.00 0.02 0.00 0.31 0.00 0.00 61.69 60.88 1x88 s THR 242 Cb -0.16 -1.73 0.02 0.00 0.01 0.00 0.00 72.50 70.64 1x88 s THR 242 CO 0.04 0.55 -0.20 -0.63 -0.69 0.00 0.00 174.62 173.68 1x88 s ILE 243 N 0.22 1.99 -0.23 1.82 1.01 0.60 -1.58 121.20 125.02 1x88 s ILE 243 Ca -0.15 -0.92 -0.09 0.00 0.00 0.00 0.00 60.65 59.50 1x88 s ILE 243 Cb -0.17 -1.78 -0.04 0.00 0.01 0.00 0.00 42.46 40.48 1x88 s ILE 243 CO 0.07 0.53 0.11 -1.00 0.00 0.00 0.00 174.94 174.66 1x88 s HIS 244 N 1.07 3.22 0.04 3.97 3.76 -0.65 -1.13 115.29 125.57 1x88 s HIS 244 Ca -0.01 -0.01 0.06 0.00 -0.15 0.00 0.00 55.06 54.95 1x88 s HIS 244 Cb -0.14 -2.22 -0.02 0.00 1.11 0.00 0.00 32.58 31.30 1x88 s HIS 244 CO -0.07 -0.06 -0.17 -1.64 -0.85 0.00 0.00 174.74 171.95 1x88 s MET 245 N 1.13 1.12 -0.33 1.40 -1.94 0.44 -1.36 119.30 119.76 1x88 s MET 245 Ca 0.06 -0.85 -0.02 0.00 -1.71 0.00 0.00 55.69 53.17 1x88 s MET 245 Cb -0.14 -1.18 0.11 0.00 2.01 0.00 0.00 34.83 35.63 1x88 s MET 245 CO 0.04 0.30 0.15 0.21 -0.01 0.00 0.00 175.02 175.71 1x88 s LYS 246 N -1.20 0.54 -0.08 2.03 2.20 0.46 -0.64 119.74 123.05 1x88 s LYS 246 Ca 0.04 -1.03 -0.10 0.00 -0.36 0.00 0.00 55.97 54.52 1x88 s LYS 246 Cb -0.08 -1.57 -0.05 0.00 -1.51 0.00 0.00 37.83 34.62 1x88 s LYS 246 CO 0.02 -1.07 0.25 -1.83 -0.36 0.00 0.00 175.35 172.36 1x88 s GLU 247 N 1.54 3.68 -0.31 4.03 -1.05 -0.02 -0.95 118.70 125.63 1x88 s GLU 247 Ca 0.12 0.08 -0.01 0.00 -0.15 0.00 0.00 54.97 55.01 1x88 s GLU 247 Cb -0.19 -3.22 0.06 0.00 -0.44 0.00 0.00 34.13 30.34 1x88 s GLU 247 CO -0.21 0.71 0.01 0.99 0.95 0.00 0.00 175.26 177.70 1x88 s THR 248 N -0.94 2.94 1.09 1.83 2.01 -0.45 0.49 115.64 122.61 1x88 s THR 248 Ca 0.18 -1.47 -0.12 0.00 0.31 0.00 0.00 61.69 60.60 1x88 s THR 248 Cb -0.14 -2.72 0.24 0.00 0.01 0.00 0.00 72.50 69.89 1x88 s THR 248 CO 0.07 -0.15 1.07 0.42 -0.69 0.00 0.00 174.62 175.34 1x88 s THR 249 N 1.23 2.04 -1.07 -0.82 -4.23 0.41 -4.81 115.64 108.38 1x88 s THR 249 Ca -0.04 0.01 0.12 0.00 -1.18 0.00 0.00 61.69 60.60 1x88 s THR 249 Cb -0.20 -2.05 0.12 0.00 1.34 0.00 0.00 72.50 71.70 1x88 s THR 249 CO -0.02 -0.02 1.36 2.30 -0.54 0.00 0.00 174.62 177.71 1x88 n ILE 250 N -4.71 1.10 0.86 2.99 -5.35 -1.26 -1.13 119.36 111.86 1x88 n ILE 250 Ca 0.06 0.28 0.12 0.00 -0.27 0.00 0.00 62.75 62.93 1x88 n ILE 250 Cb 0.53 -1.07 0.24 0.00 -1.74 0.00 0.00 39.64 37.61 1x88 n ILE 250 CO 0.00 0.00 0.00 0.47 -1.76 0.00 0.00 176.55 175.26 1x88 n ASP 251 N -1.46 2.74 0.00 7.28 10.43 -1.26 -4.96 116.55 129.32 1x88 n ASP 251 Ca 0.03 -1.88 0.00 0.00 2.57 0.00 0.00 54.79 55.51 1x88 n ASP 251 Cb 0.13 -0.11 0.00 0.00 1.84 0.00 0.00 41.12 42.99 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 1.35 0.76 3.73 0.44 0.00 -0.28 -5.05 105.19 106.14 1x88 n GLY 252 Ca 0.17 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.79 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 -0.45 4.52 -0.22 1.61 2.12 -1.26 -4.79 118.70 120.24 1x88 s GLU 253 Ca 0.00 1.13 -0.10 0.00 0.36 0.00 0.00 54.97 56.36 1x88 s GLU 253 Cb 0.00 -3.39 -0.05 0.00 0.26 0.00 0.00 34.13 30.95 1x88 s GLU 253 CO 0.00 0.20 0.15 -1.21 -0.54 0.00 0.00 175.26 173.86 1x88 s GLU 254 N 0.21 4.14 -0.18 4.30 2.02 -1.26 -0.44 118.70 127.49 1x88 s GLU 254 Ca 0.41 -0.24 0.01 0.00 0.02 0.00 0.00 54.97 55.17 1x88 s GLU 254 Cb -0.21 -3.47 0.03 0.00 0.10 0.00 0.00 34.13 30.58 1x88 s GLU 254 CO 0.24 0.19 -0.16 -0.51 0.02 0.00 0.00 175.26 175.04 1x88 s LEU 255 N 0.68 2.07 -0.14 1.80 1.43 0.18 -4.95 118.68 119.75 1x88 s LEU 255 Ca 0.08 -0.67 -0.17 0.00 -1.03 0.00 0.00 54.13 52.33 1x88 s LEU 255 Cb -0.12 -1.33 -0.04 0.00 0.03 0.00 0.00 46.19 44.73 1x88 s LEU 255 CO 0.01 -0.06 0.44 -0.69 0.23 0.00 0.00 176.35 176.28 1x88 s VAL 256 N 1.37 5.21 0.05 -1.59 1.01 -1.26 -0.84 120.40 124.34 1x88 s VAL 256 Ca 0.03 0.86 0.00 0.00 0.00 0.00 0.00 61.98 62.87 1x88 s VAL 256 Cb -0.14 -3.78 -0.03 0.00 0.00 0.00 0.00 36.38 32.44 1x88 s VAL 256 CO -0.11 0.33 -0.05 -0.54 0.00 0.00 0.00 175.10 174.73 1x88 s LYS 257 N 0.69 0.54 -0.06 2.72 1.02 0.19 -5.00 119.74 119.83 1x88 s LYS 257 Ca 0.23 -0.95 -0.01 0.00 0.02 0.00 0.00 55.97 55.27 1x88 s LYS 257 Cb -0.15 -0.00 0.03 0.00 -0.52 0.00 0.00 37.83 37.19 1x88 s LYS 257 CO 0.09 -0.04 -0.01 0.42 -0.92 0.00 0.00 175.35 174.89 1x88 s ILE 258 N -2.54 0.41 0.06 2.17 1.01 -1.26 -0.42 121.20 120.63 1x88 s ILE 258 Ca -0.03 0.05 0.08 0.00 0.00 0.00 0.00 60.65 60.74 1x88 s ILE 258 Cb -0.02 -0.53 -0.03 0.00 0.01 0.00 0.00 42.46 41.89 1x88 s ILE 258 CO -0.04 0.24 -0.21 -0.83 0.00 0.00 0.00 174.94 174.11 1x88 s GLY 259 N 1.63 1.15 -0.00 6.18 0.00 -0.28 -3.82 107.32 112.17 1x88 s GLY 259 Ca -0.00 -1.11 0.01 0.00 0.00 0.00 0.00 44.72 43.61 1x88 s GLY 259 CO -0.04 -1.07 -0.03 1.25 0.00 0.00 0.00 173.10 173.21 1x88 s LYS 260 N -1.43 0.26 -0.06 2.90 2.20 -0.86 -0.29 119.74 122.46 1x88 s LYS 260 Ca 0.07 -0.15 0.01 0.00 -0.36 0.00 0.00 55.97 55.54 1x88 s LYS 260 Cb -0.09 -0.24 0.02 0.00 -1.51 0.00 0.00 37.83 36.01 1x88 s LYS 260 CO 0.03 0.06 -0.07 -1.17 -0.36 0.00 0.00 175.35 173.84 1x88 s LEU 261 N -0.17 1.38 -0.20 5.43 2.96 0.13 -0.70 118.68 127.51 1x88 s LEU 261 Ca 0.00 -0.21 -0.05 0.00 -0.22 0.00 0.00 54.13 53.66 1x88 s LEU 261 Cb -0.02 -0.64 -0.02 0.00 0.50 0.00 0.00 46.19 46.01 1x88 s LEU 261 CO -0.00 -0.04 -0.01 0.20 -1.32 0.00 0.00 176.35 175.18 1x88 s ASN 262 N 1.00 4.75 -0.31 3.68 0.02 -0.10 -0.58 114.94 123.40 1x88 s ASN 262 Ca -0.09 -0.22 -0.01 0.00 -1.02 0.00 0.00 52.86 51.51 1x88 s ASN 262 Cb -0.14 -1.81 0.06 0.00 0.02 0.00 0.00 41.25 39.38 1x88 s ASN 262 CO -0.00 0.06 0.02 -0.76 0.02 0.00 0.00 177.10 176.44 1x88 s LEU 263 N 1.00 4.08 -0.19 0.60 1.43 1.00 -0.85 118.68 125.74 1x88 s LEU 263 Ca 0.01 -1.42 -0.05 0.00 -1.03 0.00 0.00 54.13 51.65 1x88 s LEU 263 Cb -0.14 -1.71 -0.03 0.00 0.03 0.00 0.00 46.19 44.34 1x88 s LEU 263 CO 0.01 -0.30 -0.00 -0.69 0.23 0.00 0.00 176.35 175.61 1x88 s VAL 264 N 1.21 3.98 -0.45 -1.59 1.01 0.08 -0.91 120.40 123.72 1x88 s VAL 264 Ca -0.03 -0.31 -0.08 0.00 0.00 0.00 0.00 61.98 61.56 1x88 s VAL 264 Cb -0.20 -2.79 0.11 0.00 0.00 0.00 0.00 36.38 33.50 1x88 s VAL 264 CO -0.02 0.44 0.30 -0.62 0.00 0.00 0.00 175.10 175.20 1x88 s ASP 265 N 0.91 5.62 0.69 3.32 -1.08 -0.49 -0.85 116.67 124.78 1x88 s ASP 265 Ca 0.01 -1.84 -0.11 0.00 -0.52 0.00 0.00 52.55 50.09 1x88 s ASP 265 Cb -0.14 -1.98 0.00 0.00 -1.46 0.00 0.00 42.92 39.34 1x88 s ASP 265 CO 0.02 -0.64 1.06 -0.76 0.52 0.00 0.00 175.17 175.37 1x88 s LEU 266 N 1.34 3.14 0.66 -1.34 1.43 -1.05 -1.39 118.68 121.48 1x88 s LEU 266 Ca 0.05 1.59 -0.17 0.00 -1.03 0.00 0.00 54.13 54.58 1x88 s LEU 266 Cb -0.25 -4.49 0.00 0.00 0.03 0.00 0.00 46.19 41.48 1x88 s LEU 266 CO -0.01 -1.38 1.21 0.00 0.23 0.00 0.00 176.35 176.40 1x88 s ALA 267 N -3.06 2.34 0.31 4.21 0.00 -1.15 -4.88 121.76 119.52 1x88 s ALA 267 Ca 0.58 0.93 -0.29 0.00 0.00 0.00 0.00 51.96 53.18 1x88 s ALA 267 Cb -0.14 -3.46 -0.12 0.00 0.00 0.00 0.00 23.12 19.40 1x88 s ALA 267 CO 0.55 -1.53 1.38 0.41 0.00 0.00 0.00 175.76 176.57 1x88 n GLY 268 N 0.40 0.78 0.20 0.00 0.00 0.21 -4.74 105.19 102.03 1x88 n GLY 268 Ca 0.13 0.39 0.15 0.00 0.00 0.00 0.00 46.02 46.69 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 1.34 0.65 -4.75 1.61 3.41 -0.88 -4.86 113.62 110.15 1x88 n SER 269 Ca 0.07 -1.00 -0.37 0.00 -0.26 0.00 0.00 58.87 57.31 1x88 n SER 269 Cb 0.35 -0.02 0.04 0.00 -0.26 0.00 0.00 64.21 64.32 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 -2.18 2.96 -0.29 4.33 1.03 -1.26 -4.91 118.70 118.38 1x88 s GLU 270 Ca 0.38 2.03 -0.29 0.00 0.03 0.00 0.00 54.97 57.11 1x88 s GLU 270 Cb 0.21 -2.05 -0.00 0.00 -0.80 0.00 0.00 34.13 31.49 1x88 s GLU 270 CO 0.40 -1.27 1.38 -0.80 -1.33 0.00 0.00 175.26 173.64 1x88 s ASN 271 N -1.30 6.58 -0.17 0.83 0.02 -1.26 -5.07 114.94 114.56 1x88 s ASN 271 Ca 0.76 1.26 -0.04 0.00 -1.02 0.00 0.00 52.86 53.82 1x88 s ASN 271 Cb -0.36 -2.54 -0.03 0.00 0.02 0.00 0.00 41.25 38.35 1x88 s ASN 271 CO 0.40 -1.15 -0.02 -0.63 0.02 0.00 0.00 177.10 175.72 1x88 s ILE 288 N 4.66 3.98 -0.71 0.60 -1.09 -1.26 -5.29 121.20 122.09 1x88 s ILE 288 Ca 0.60 -0.32 -0.09 0.00 -2.23 0.00 0.00 60.65 58.61 1x88 s ILE 288 Cb -0.18 -2.77 0.19 0.00 -1.58 0.00 0.00 42.46 38.11 1x88 s ILE 288 CO 0.25 0.47 0.59 0.21 -1.23 0.00 0.00 174.94 175.23 1x88 s ASN 289 N 0.59 6.03 0.29 3.58 3.04 -1.26 -4.93 114.94 122.29 1x88 s ASN 289 Ca -0.01 -2.68 0.02 0.00 0.04 0.00 0.00 52.86 50.22 1x88 s ASN 289 Cb -0.14 -2.05 0.56 0.00 -1.54 0.00 0.00 41.25 38.08 1x88 s ASN 289 CO 0.02 -0.50 1.87 -0.61 -3.04 0.00 0.00 177.10 174.84 1x88 h GLN 290 N 7.54 0.97 -0.41 0.43 5.75 -1.98 -0.01 115.11 127.40 1x88 h GLN 290 Ca 0.02 -0.06 -0.14 0.00 -0.15 0.00 0.00 58.65 58.33 1x88 h GLN 290 Cb 1.01 -0.22 -0.01 0.00 1.07 0.00 0.00 27.48 29.33 1x88 h GLN 290 CO 0.75 0.64 -0.27 0.77 -2.65 0.00 0.00 178.83 178.07 1x88 h SER 291 N 1.00 0.95 -0.36 -0.69 0.02 -1.92 -0.19 113.55 112.36 1x88 h SER 291 Ca 0.45 -0.43 -0.10 0.00 -0.84 0.00 0.00 61.79 60.88 1x88 h SER 291 Cb 0.39 -0.26 -0.01 0.00 0.14 0.00 0.00 62.40 62.65 1x88 h SER 291 CO -0.21 1.18 -0.15 0.25 -1.14 0.00 0.00 176.83 176.76 1x88 h LEU 292 N 0.73 0.76 -0.58 5.07 5.85 -1.85 -0.36 115.31 124.94 1x88 h LEU 292 Ca 0.08 -0.39 0.00 0.00 0.84 0.00 0.00 57.88 58.41 1x88 h LEU 292 Cb 0.85 -0.21 -0.03 0.00 0.37 0.00 0.00 40.66 41.65 1x88 h LEU 292 CO 0.08 0.98 0.37 -0.07 -0.34 0.00 0.00 178.44 179.46 1x88 h LEU 293 N 0.53 0.67 -0.64 2.25 3.38 -0.93 -2.53 115.31 118.05 1x88 h LEU 293 Ca 0.08 -0.03 -0.13 0.00 0.09 0.00 0.00 57.88 57.89 1x88 h LEU 293 Cb 0.68 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 41.25 1x88 h LEU 293 CO 0.05 0.51 -0.36 0.74 0.09 0.00 0.00 178.44 179.46 1x88 h THR 294 N 0.78 1.29 -0.66 0.22 2.02 -0.92 -2.49 112.91 113.15 1x88 h THR 294 Ca 0.21 -1.51 0.06 0.00 0.77 0.00 0.00 66.41 65.94 1x88 h THR 294 Cb -0.06 1.45 -0.05 0.00 -1.74 0.00 0.00 68.15 67.74 1x88 h THR 294 CO -0.04 0.49 0.36 0.25 0.37 0.00 0.00 175.52 176.94 1x88 h LEU 295 N 0.55 0.53 -0.86 2.58 5.85 -0.76 0.17 115.31 123.38 1x88 h LEU 295 Ca 0.05 0.03 -0.07 0.00 0.84 0.00 0.00 57.88 58.74 1x88 h LEU 295 Cb 0.87 -0.07 -0.03 0.00 0.37 0.00 0.00 40.66 41.81 1x88 h LEU 295 CO 0.08 0.34 0.09 1.23 -0.34 0.00 0.00 178.44 179.84 1x88 h GLY 296 N 0.67 1.02 1.79 3.75 0.00 -1.25 -1.50 103.07 107.55 1x88 h GLY 296 Ca 0.29 -0.65 -0.14 0.00 0.00 0.00 0.00 47.33 46.84 1x88 h GLY 296 CO -0.18 0.60 -0.59 3.21 0.00 0.00 0.00 176.54 179.58 1x88 h ARG 297 N 0.89 0.21 -0.19 4.80 3.08 -0.89 -1.75 114.38 120.54 1x88 h ARG 297 Ca 0.18 -0.14 -0.05 0.00 0.07 0.00 0.00 59.98 60.04 1x88 h ARG 297 Cb 0.39 0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.46 1x88 h ARG 297 CO 0.01 0.74 -0.07 0.28 -1.07 0.00 0.00 179.97 179.86 1x88 h VAL 298 N 0.16 1.30 -0.59 2.04 2.07 -0.45 -1.36 116.25 119.42 1x88 h VAL 298 Ca -0.00 -1.09 0.02 0.00 0.82 0.00 0.00 66.70 66.45 1x88 h VAL 298 Cb 1.08 1.62 -0.03 0.00 -1.52 0.00 0.00 31.29 32.43 1x88 h VAL 298 CO 0.09 0.33 0.37 0.40 0.02 0.00 0.00 177.57 178.78 1x88 h ILE 299 N 0.08 1.11 -0.29 4.57 2.04 -1.17 -0.76 117.51 123.09 1x88 h ILE 299 Ca 0.05 -0.26 0.00 0.00 1.00 0.00 0.00 64.86 65.65 1x88 h ILE 299 Cb 0.53 0.29 -0.01 0.00 -0.74 0.00 0.00 36.82 36.89 1x88 h ILE 299 CO 0.02 0.14 0.18 0.74 0.00 0.00 0.00 178.15 179.23 1x88 h THR 300 N 0.75 1.09 -0.59 -0.27 2.02 -1.23 0.03 112.91 114.71 1x88 h THR 300 Ca 0.23 -0.20 -0.02 0.00 0.77 0.00 0.00 66.41 67.19 1x88 h THR 300 Cb -0.03 0.70 -0.03 0.00 -1.74 0.00 0.00 68.15 67.05 1x88 h THR 300 CO -0.08 0.09 0.28 0.00 0.37 0.00 0.00 175.52 176.18 1x88 h ALA 301 N 1.08 1.38 -0.22 6.16 0.00 -0.88 0.65 119.26 127.43 1x88 h ALA 301 Ca 0.10 -0.13 -0.13 0.00 0.00 0.00 0.00 54.91 54.76 1x88 h ALA 301 Cb -0.01 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 17.54 1x88 h ALA 301 CO -0.02 0.49 -0.37 -0.07 0.00 0.00 0.00 179.25 179.27 1x88 h LEU 302 N 0.84 0.71 -0.64 0.00 3.38 -0.75 0.24 115.31 119.09 1x88 h LEU 302 Ca 0.21 -0.53 -0.15 0.00 0.09 0.00 0.00 57.88 57.50 1x88 h LEU 302 Cb 0.10 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.63 1x88 h LEU 302 CO -0.03 1.11 -0.55 0.58 0.09 0.00 0.00 178.44 179.64 1x88 h VAL 303 N 0.35 1.35 -0.04 1.22 2.07 -0.71 -2.67 116.25 117.81 1x88 h VAL 303 Ca 0.02 -1.84 0.00 0.00 0.82 0.00 0.00 66.70 65.70 1x88 h VAL 303 Cb 0.96 1.86 0.00 0.00 -1.52 0.00 0.00 31.29 32.59 1x88 h VAL 303 CO 0.08 0.56 0.00 -0.62 0.02 0.00 0.00 177.57 177.61 1x88 n GLU 304 N -3.93 1.66 -3.87 1.57 1.02 0.20 -4.94 120.64 112.35 1x88 n GLU 304 Ca -0.03 -0.96 -0.29 0.00 -0.02 0.00 0.00 57.16 55.87 1x88 n GLU 304 Cb 0.59 -1.46 0.03 0.00 -0.02 0.00 0.00 31.44 30.58 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 0.16 -5.61 -2.31 3.49 1.74 -0.30 -4.94 116.66 108.90 1x88 n ARG 305 Ca 0.19 0.61 -0.41 0.00 -0.77 0.00 0.00 57.85 57.47 1x88 n ARG 305 Cb 0.34 -5.47 -0.03 0.00 -1.02 0.00 0.00 32.46 26.28 1x88 n ARG 305 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 1x88 s THR 306 N -3.35 3.40 0.27 0.55 2.01 0.70 -4.93 115.64 114.29 1x88 s THR 306 Ca 0.58 1.19 0.00 0.00 0.31 0.00 0.00 61.69 63.76 1x88 s THR 306 Cb -0.29 -3.76 0.26 0.00 0.01 0.00 0.00 72.50 68.73 1x88 s THR 306 CO 0.82 0.19 1.71 1.55 -0.69 0.00 0.00 174.62 178.21 1x88 h PRO 307 N 5.13 0.40 -5.10 4.92 0.13 -1.92 -3.39 132.00 132.17 1x88 h PRO 307 Ca -0.45 -0.02 -0.62 0.00 -0.87 0.00 0.00 66.00 64.03 1x88 h PRO 307 Cb 1.21 -0.09 -0.16 0.00 0.13 0.00 0.00 31.00 32.10 1x88 h PRO 307 CO 0.75 0.27 -0.53 -1.58 -0.23 0.00 0.00 178.00 176.68 1x88 s HIS 308 N -5.95 3.28 -0.24 1.56 5.65 -1.26 -5.07 115.29 113.26 1x88 s HIS 308 Ca -0.12 0.13 -0.04 0.00 0.25 0.00 0.00 55.06 55.28 1x88 s HIS 308 Cb 0.23 -2.23 0.00 0.00 -1.18 0.00 0.00 32.58 29.40 1x88 s HIS 308 CO 0.77 0.03 -0.02 0.08 -0.65 0.00 0.00 174.74 174.95 1x88 s VAL 309 N 1.01 3.35 0.00 0.89 1.01 -1.26 -4.93 120.40 120.47 1x88 s VAL 309 Ca 0.07 -0.68 -0.01 0.00 0.00 0.00 0.00 61.98 61.36 1x88 s VAL 309 Cb -0.14 -2.62 -0.04 0.00 0.00 0.00 0.00 36.38 33.59 1x88 s VAL 309 CO 0.04 0.29 1.14 -0.81 0.00 0.00 0.00 175.10 175.76 1x88 n PRO 310 N 4.78 0.53 -0.23 2.72 -0.04 -1.26 -4.59 135.00 136.90 1x88 n PRO 310 Ca -0.17 -0.16 0.02 0.00 -0.04 0.00 0.00 63.50 63.15 1x88 n PRO 310 Cb 0.49 -1.47 0.14 0.00 -0.04 0.00 0.00 33.50 32.62 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 3.74 0.49 0.00 0.54 0.05 -1.94 -1.97 116.97 117.89 1x88 h TYR 311 Ca 0.03 0.03 0.00 0.00 0.05 0.00 0.00 58.73 58.84 1x88 h TYR 311 Cb 0.46 -0.12 0.00 0.00 1.01 0.00 0.00 36.73 38.08 1x88 h TYR 311 CO 0.78 0.12 0.00 0.54 -1.05 0.00 0.00 178.16 178.55 1x88 n ARG 312 N -4.97 0.06 0.00 4.88 1.74 -1.26 -3.16 116.66 113.95 1x88 n ARG 312 Ca 0.11 0.27 0.13 0.00 -0.77 0.00 0.00 57.85 57.59 1x88 n ARG 312 Cb 0.32 -1.50 0.72 0.00 -1.02 0.00 0.00 32.46 30.99 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 -1.42 0.66 -3.58 5.56 1.02 -0.74 -4.82 120.64 117.33 1x88 n GLU 313 Ca 0.03 0.02 -0.14 0.00 -0.02 0.00 0.00 57.16 57.05 1x88 n GLU 313 Cb 0.10 -1.50 -0.05 0.00 -0.02 0.00 0.00 31.44 29.97 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 -2.19 -0.43 0.22 1.62 1.04 -1.21 -4.88 113.70 107.87 1x88 s SER 314 Ca 0.34 0.16 -0.03 0.00 0.48 0.00 0.00 55.95 56.91 1x88 s SER 314 Cb 0.17 0.49 0.22 0.00 0.10 0.00 0.00 66.02 67.01 1x88 s SER 314 CO 0.33 -0.72 1.63 0.11 0.98 0.00 0.00 173.24 175.57 1x88 h LYS 315 N 2.79 0.68 -0.07 4.02 1.57 -1.87 -2.42 116.57 121.26 1x88 h LYS 315 Ca -0.31 -0.29 -0.00 0.00 -1.87 0.00 0.00 60.65 58.18 1x88 h LYS 315 Cb 1.21 -0.02 -0.00 0.00 0.08 0.00 0.00 32.23 33.50 1x88 h LYS 315 CO 0.41 0.88 0.04 1.25 -0.57 0.00 0.00 179.45 181.46 1x88 h LEU 316 N 0.58 0.08 -1.20 2.94 5.85 -1.92 -0.99 115.31 120.65 1x88 h LEU 316 Ca 0.07 -0.07 -0.01 0.00 0.84 0.00 0.00 57.88 58.71 1x88 h LEU 316 Cb 0.78 -0.02 -0.00 0.00 0.37 0.00 0.00 40.66 41.78 1x88 h LEU 316 CO 0.06 0.13 -0.05 0.71 -0.34 0.00 0.00 178.44 178.96 1x88 h THR 317 N 0.03 0.11 0.06 1.05 1.35 -1.78 -0.87 112.91 112.86 1x88 h THR 317 Ca 0.02 -0.70 -0.19 0.00 -0.55 0.00 0.00 66.41 65.00 1x88 h THR 317 Cb 0.07 1.63 0.02 0.00 -1.73 0.00 0.00 68.15 68.13 1x88 h THR 317 CO -0.00 0.05 -0.76 0.03 -0.25 0.00 0.00 175.52 174.58 1x88 h ARG 318 N 0.00 0.42 -0.52 4.72 3.08 -1.13 -1.88 114.38 119.06 1x88 h ARG 318 Ca -0.00 -0.52 -0.10 0.00 0.07 0.00 0.00 59.98 59.43 1x88 h ARG 318 Cb 0.62 0.17 -0.02 0.00 0.08 0.00 0.00 29.97 30.82 1x88 h ARG 318 CO 0.01 1.19 -0.06 0.82 -1.07 0.00 0.00 179.97 180.85 1x88 h ILE 319 N -0.12 1.26 -0.52 2.04 2.04 -1.01 -3.15 117.51 118.05 1x88 h ILE 319 Ca -0.11 -1.18 -0.12 0.00 1.00 0.00 0.00 64.86 64.45 1x88 h ILE 319 Cb 1.50 0.93 -0.07 0.00 -0.74 0.00 0.00 36.82 38.43 1x88 h ILE 319 CO 0.15 0.42 0.11 0.18 0.00 0.00 0.00 178.15 179.00 1x88 n LEU 320 N -4.17 5.12 -0.33 1.44 4.77 -0.35 -4.70 117.00 118.79 1x88 n LEU 320 Ca 0.02 -3.20 0.11 0.00 -0.03 0.00 0.00 56.01 52.91 1x88 n LEU 320 Cb 0.36 -0.66 0.29 0.00 -2.33 0.00 0.00 43.42 41.08 1x88 n LEU 320 CO 0.44 0.80 1.15 -0.61 -1.33 0.00 0.00 177.39 177.84 1x88 h GLN 321 N 2.35 0.66 0.00 3.23 4.15 -1.29 0.10 115.11 124.30 1x88 h GLN 321 Ca 0.15 -0.04 0.00 0.00 0.77 0.00 0.00 58.65 59.53 1x88 h GLN 321 Cb 1.93 -0.15 0.00 0.00 0.21 0.00 0.00 27.48 29.48 1x88 h GLN 321 CO 0.51 0.43 0.00 -3.47 -1.93 0.00 0.00 178.83 174.37 1x88 n ASP 322 N -4.83 0.70 0.00 -0.69 2.03 -1.26 -2.15 116.55 110.34 1x88 n ASP 322 Ca 0.22 0.66 0.12 0.00 0.52 0.00 0.00 54.79 56.31 1x88 n ASP 322 Cb 0.55 -0.81 0.33 0.00 -0.72 0.00 0.00 41.12 40.47 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 -2.25 0.40 -3.96 1.67 7.64 0.02 -2.60 113.62 114.53 1x88 n SER 323 Ca 0.02 -0.07 -0.31 0.00 1.01 0.00 0.00 58.87 59.52 1x88 n SER 323 Cb 0.25 0.08 -0.12 0.00 -1.01 0.00 0.00 64.21 63.41 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 -3.03 4.64 0.00 -3.43 1.43 -0.92 -4.63 118.68 112.75 1x88 s LEU 324 Ca 0.12 -3.27 0.00 0.00 -1.03 0.00 0.00 54.13 49.95 1x88 s LEU 324 Cb 0.18 -1.68 0.00 0.00 0.03 0.00 0.00 46.19 44.71 1x88 s LEU 324 CO 0.66 -0.20 0.00 0.61 0.23 0.00 0.00 176.35 177.65 1x88 n GLY 325 N 2.80 0.60 0.00 -3.19 0.00 -1.26 -4.96 105.19 99.17 1x88 n GLY 325 Ca 0.10 -0.36 0.00 0.00 0.00 0.00 0.00 46.02 45.76 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 -2.73 3.10 1.38 -0.02 0.00 -1.07 -4.77 105.19 101.08 1x88 n GLY 326 Ca 0.00 -1.95 0.06 0.00 0.00 0.00 0.00 46.02 44.13 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 3.43 -4.16 1.61 1.74 -1.16 -0.30 116.66 117.82 1x88 n ARG 327 Ca 0.00 -2.21 -0.35 0.00 -0.77 0.00 0.00 57.85 54.52 1x88 n ARG 327 Cb 0.00 -1.89 -0.08 0.00 -1.02 0.00 0.00 32.46 29.47 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 -2.01 4.81 -0.28 0.55 2.01 -1.09 -2.63 115.64 117.00 1x88 s THR 328 Ca 0.39 -0.11 -0.27 0.00 0.31 0.00 0.00 61.69 62.01 1x88 s THR 328 Cb 0.27 -3.08 0.01 0.00 0.01 0.00 0.00 72.50 69.72 1x88 s THR 328 CO 0.15 0.57 0.98 -0.60 -0.69 0.00 0.00 174.62 175.03 1x88 s ARG 329 N -1.07 4.13 -0.01 4.92 3.52 -0.66 -4.61 118.95 125.17 1x88 s ARG 329 Ca 0.15 1.07 0.06 0.00 -0.13 0.00 0.00 55.73 56.88 1x88 s ARG 329 Cb -0.12 -3.69 -0.03 0.00 -1.56 0.00 0.00 34.95 29.56 1x88 s ARG 329 CO 0.05 -0.72 -0.18 0.99 -0.81 0.00 0.00 175.30 174.63 1x88 s THR 330 N 3.27 2.76 0.05 4.11 2.01 -1.26 -0.90 115.64 125.69 1x88 s THR 330 Ca 0.41 -0.96 0.04 0.00 0.31 0.00 0.00 61.69 61.50 1x88 s THR 330 Cb -0.14 -2.09 -0.02 0.00 0.01 0.00 0.00 72.50 70.26 1x88 s THR 330 CO 0.11 0.50 -0.13 -0.44 -0.69 0.00 0.00 174.62 173.97 1x88 s SER 331 N -0.94 1.47 -0.09 3.53 0.01 -0.16 -2.29 113.70 115.23 1x88 s SER 331 Ca 0.12 -0.51 0.03 0.00 1.31 0.00 0.00 55.95 56.90 1x88 s SER 331 Cb -0.10 -0.06 0.01 0.00 0.21 0.00 0.00 66.02 66.08 1x88 s SER 331 CO 0.02 -0.04 -0.16 -0.63 0.41 0.00 0.00 173.24 172.83 1x88 s ILE 332 N -1.04 1.49 -0.37 1.44 1.01 0.21 -1.07 121.20 122.87 1x88 s ILE 332 Ca -0.02 -0.67 -0.08 0.00 0.00 0.00 0.00 60.65 59.88 1x88 s ILE 332 Cb -0.09 -1.33 0.05 0.00 0.01 0.00 0.00 42.46 41.10 1x88 s ILE 332 CO 0.01 0.43 0.18 -0.63 0.00 0.00 0.00 174.94 174.94 1x88 s ILE 333 N 0.68 4.13 -0.24 2.92 1.01 0.91 -0.19 121.20 130.43 1x88 s ILE 333 Ca -0.13 -1.15 -0.17 0.00 0.00 0.00 0.00 60.65 59.20 1x88 s ILE 333 Cb -0.16 -3.39 -0.03 0.00 0.01 0.00 0.00 42.46 38.88 1x88 s ILE 333 CO 0.03 -0.30 0.48 0.00 0.00 0.00 0.00 174.94 175.15 1x88 s ALA 334 N 1.45 3.57 -0.13 9.38 0.00 0.19 -1.13 121.76 135.08 1x88 s ALA 334 Ca 0.01 -0.57 -0.09 0.00 0.00 0.00 0.00 51.96 51.31 1x88 s ALA 334 Cb -0.20 -2.80 -0.04 0.00 0.00 0.00 0.00 23.12 20.07 1x88 s ALA 334 CO 0.04 -0.58 0.18 0.95 0.00 0.00 0.00 175.76 176.35 1x88 s THR 335 N 1.93 5.42 0.20 0.00 -4.23 0.42 -0.78 115.64 118.60 1x88 s THR 335 Ca 0.21 0.30 0.02 0.00 -1.18 0.00 0.00 61.69 61.03 1x88 s THR 335 Cb -0.15 -3.47 -0.05 0.00 1.34 0.00 0.00 72.50 70.17 1x88 s THR 335 CO 0.09 0.56 0.03 0.27 -0.54 0.00 0.00 174.62 175.03 1x88 s ILE 336 N -0.60 0.66 0.06 2.99 -4.36 -0.67 -4.28 121.20 115.00 1x88 s ILE 336 Ca 0.14 -1.99 0.03 0.00 -0.26 0.00 0.00 60.65 58.58 1x88 s ILE 336 Cb -0.12 -2.28 -0.04 0.00 1.25 0.00 0.00 42.46 41.27 1x88 s ILE 336 CO 0.04 -0.33 0.02 -0.55 0.24 0.00 0.00 174.94 174.36 1x88 s SER 337 N -3.22 5.20 0.00 4.36 0.15 -1.26 -2.08 113.70 116.84 1x88 s SER 337 Ca 0.28 -0.08 0.27 0.00 0.70 0.00 0.00 55.95 57.12 1x88 s SER 337 Cb 0.06 -1.32 0.80 0.00 -1.71 0.00 0.00 66.02 63.86 1x88 s SER 337 CO 0.07 0.21 1.60 -0.81 1.20 0.00 0.00 173.24 175.50 1x88 n PRO 338 N 0.80 1.17 -2.53 5.44 -0.04 -1.26 -4.84 135.00 133.73 1x88 n PRO 338 Ca -0.11 -0.71 -0.41 0.00 -0.04 0.00 0.00 63.50 62.23 1x88 n PRO 338 Cb 0.52 -1.49 -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 -2.32 3.37 0.53 0.55 0.00 -1.26 -0.89 121.76 121.74 1x88 s ALA 339 Ca 0.29 0.80 0.18 0.00 0.00 0.00 0.00 51.96 53.23 1x88 s ALA 339 Cb 0.20 -3.34 1.37 0.00 0.00 0.00 0.00 23.12 21.35 1x88 s ALA 339 CO 0.45 -0.17 2.17 0.66 0.00 0.00 0.00 175.76 178.88 1x88 h SER 340 N 4.87 0.00 0.18 0.00 4.64 -1.92 -1.80 113.55 119.52 1x88 h SER 340 Ca -0.45 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 60.85 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 0.00 -0.11 0.25 -0.87 0.00 0.00 176.83 176.81 1x88 h LEU 341 N 0.00 0.00 -3.25 5.97 5.85 -1.97 -2.59 115.31 119.32 1x88 h LEU 341 Ca 0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 1x88 h LEU 341 Cb 0.01 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.04 1x88 h LEU 341 CO -0.00 0.11 0.00 0.59 -0.34 0.00 0.00 178.44 178.80 1x88 n ASN 342 N -4.06 5.09 -0.17 1.25 3.02 -0.68 -4.70 115.26 115.01 1x88 n ASN 342 Ca -0.02 -2.60 -0.09 0.00 -0.03 0.00 0.00 54.58 51.84 1x88 n ASN 342 Cb 0.19 -0.62 -0.04 0.00 -0.61 0.00 0.00 39.78 38.70 1x88 n ASN 342 CO 0.00 0.00 0.00 0.25 -2.62 0.00 0.00 177.26 174.89 1x88 h LEU 343 N 4.09 -1.47 -0.63 3.41 5.85 -1.53 0.80 115.31 125.82 1x88 h LEU 343 Ca 0.00 0.23 0.05 0.00 0.84 0.00 0.00 57.88 59.01 1x88 h LEU 343 Cb 1.63 0.66 -0.05 0.00 0.37 0.00 0.00 40.66 43.26 1x88 h LEU 343 CO 0.32 -0.35 0.34 -0.33 -0.34 0.00 0.00 178.44 178.08 1x88 h GLU 344 N -0.28 0.63 -0.10 1.25 4.39 -1.86 -0.45 114.58 118.16 1x88 h GLU 344 Ca 0.16 -0.04 -0.16 0.00 0.34 0.00 0.00 59.36 59.66 1x88 h GLU 344 Cb 0.57 -0.14 -0.01 0.00 -0.10 0.00 0.00 28.75 29.07 1x88 h GLU 344 CO -0.63 0.41 -0.62 0.93 -1.16 0.00 0.00 179.01 177.94 1x88 h GLU 345 N 0.64 0.34 -0.32 2.33 4.39 -1.81 -1.76 114.58 118.40 1x88 h GLU 345 Ca 0.28 -0.24 -0.03 0.00 0.34 0.00 0.00 59.36 59.71 1x88 h GLU 345 Cb 0.16 0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 28.84 1x88 h GLU 345 CO -0.17 0.86 0.09 1.15 -1.16 0.00 0.00 179.01 179.78 1x88 h THR 346 N 0.25 1.21 -0.77 1.13 2.02 -0.34 0.12 112.91 116.53 1x88 h THR 346 Ca -0.01 -0.68 -0.04 0.00 0.77 0.00 0.00 66.41 66.45 1x88 h THR 346 Cb 1.15 1.05 -0.03 0.00 -1.74 0.00 0.00 68.15 68.58 1x88 h THR 346 CO 0.10 0.23 0.31 -0.07 0.37 0.00 0.00 175.52 176.47 1x88 h LEU 347 N 0.36 1.04 -0.55 2.58 3.38 -1.04 -0.88 115.31 120.20 1x88 h LEU 347 Ca 0.10 -0.15 -0.01 0.00 0.09 0.00 0.00 57.88 57.91 1x88 h LEU 347 Cb 0.26 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.71 1x88 h LEU 347 CO -0.00 0.92 0.32 -1.28 0.09 0.00 0.00 178.44 178.49 1x88 h SER 348 N 1.11 0.67 -0.34 -0.43 0.87 -0.89 -0.20 113.55 114.35 1x88 h SER 348 Ca 0.26 -0.07 -0.03 0.00 -1.23 0.00 0.00 61.79 60.72 1x88 h SER 348 Cb 0.20 -0.17 -0.01 0.00 -0.44 0.00 0.00 62.40 61.97 1x88 h SER 348 CO -0.02 0.54 0.10 0.74 -0.53 0.00 0.00 176.83 177.66 1x88 h THR 349 N 0.74 1.21 -0.64 2.23 2.02 -0.57 -1.17 112.91 116.73 1x88 h THR 349 Ca 0.20 -0.70 -0.04 0.00 0.77 0.00 0.00 66.41 66.64 1x88 h THR 349 Cb 0.01 1.04 -0.03 0.00 -1.74 0.00 0.00 68.15 67.43 1x88 h THR 349 CO -0.03 0.24 0.26 -0.07 0.37 0.00 0.00 175.52 176.29 1x88 h LEU 350 N 0.39 0.88 -0.51 2.58 3.38 -0.91 0.91 115.31 122.03 1x88 h LEU 350 Ca 0.11 -0.17 -0.03 0.00 0.09 0.00 0.00 57.88 57.88 1x88 h LEU 350 Cb 0.27 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.77 1x88 h LEU 350 CO -0.00 0.81 0.20 -0.33 0.09 0.00 0.00 178.44 179.21 1x88 h GLU 351 N 0.90 0.76 -0.32 1.13 4.39 -0.93 0.98 114.58 121.50 1x88 h GLU 351 Ca 0.21 -0.14 -0.02 0.00 0.34 0.00 0.00 59.36 59.75 1x88 h GLU 351 Cb 0.20 -0.12 -0.01 0.00 -0.10 0.00 0.00 28.75 28.71 1x88 h GLU 351 CO -0.02 0.68 0.11 -0.92 -1.16 0.00 0.00 179.01 177.70 1x88 h TYR 352 N 0.68 0.50 -0.52 4.33 5.03 -0.93 -2.46 116.97 123.61 1x88 h TYR 352 Ca 0.17 -0.04 -0.10 0.00 2.58 0.00 0.00 58.73 61.33 1x88 h TYR 352 Cb 0.20 -0.15 -0.02 0.00 1.55 0.00 0.00 36.73 38.32 1x88 h TYR 352 CO 0.01 0.49 -0.09 0.00 -1.32 0.00 0.00 178.16 177.24 1x88 h ALA 353 N 0.95 0.86 -0.39 1.82 0.00 -0.64 -2.83 119.26 119.03 1x88 h ALA 353 Ca 0.10 -0.34 -0.05 0.00 0.00 0.00 0.00 54.91 54.63 1x88 h ALA 353 Cb 0.22 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 1x88 h ALA 353 CO -0.01 0.65 0.03 1.25 0.00 0.00 0.00 179.25 181.17 1x88 h HIS 354 N 0.85 0.62 -0.35 0.00 -0.00 -0.68 -2.68 115.15 112.91 1x88 h HIS 354 Ca 0.14 -0.06 -0.14 0.00 -0.00 0.00 0.00 60.37 60.31 1x88 h HIS 354 Cb 0.63 -0.18 -0.01 0.00 -0.00 0.00 0.00 27.41 27.85 1x88 h HIS 354 CO 0.04 0.58 -0.34 -0.09 -0.00 0.00 0.00 177.93 178.13 1x88 h ARG 355 N 0.58 0.79 0.00 5.26 2.43 -1.27 -3.05 114.38 119.11 1x88 h ARG 355 Ca 0.12 -0.38 0.00 0.00 -0.81 0.00 0.00 59.98 58.92 1x88 h ARG 355 Cb 0.33 -0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.87 1x88 h ARG 355 CO 0.01 1.01 0.00 0.00 -1.51 0.00 0.00 179.97 179.47 1x88 h ALA 356 N 0.96 1.00 -0.01 2.80 0.00 -1.23 -2.77 119.26 120.01 1x88 h ALA 356 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.98 1x88 h ALA 356 Cb 0.88 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.67 1x88 h ALA 356 CO 0.08 0.00 0.01 0.87 0.00 0.00 0.00 179.25 180.21 1x88 h LYS 357 N 0.00 0.00 -0.09 0.00 1.57 -1.54 -2.46 116.57 114.05 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 0.10 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.41 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 -3.93 0.77 -4.69 0.86 4.13 -1.04 -4.34 115.26 107.02 1x88 n ASN 358 Ca -0.03 -1.65 -0.42 0.00 1.68 0.00 0.00 54.58 54.17 1x88 n ASN 358 Cb 0.10 -0.06 -0.03 0.00 -1.54 0.00 0.00 39.78 38.24 1x88 n ASN 358 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 1x88 s ILE 359 N -1.88 4.87 -0.22 2.41 1.01 -0.93 -4.78 121.20 121.68 1x88 s ILE 359 Ca 0.25 1.79 -0.09 0.00 0.00 0.00 0.00 60.65 62.60 1x88 s ILE 359 Cb 0.13 -4.20 -0.05 0.00 0.01 0.00 0.00 42.46 38.35 1x88 s ILE 359 CO 0.20 0.07 0.12 -0.22 0.00 0.00 0.00 174.94 175.11 1x88 s LEU 360 N 1.79 4.00 0.34 2.97 1.98 -1.26 -0.83 118.68 127.67 1x88 s LEU 360 Ca 0.43 0.09 0.09 0.00 -2.89 0.00 0.00 54.13 51.85 1x88 s LEU 360 Cb -0.18 -2.05 -0.06 0.00 0.66 0.00 0.00 46.19 44.56 1x88 s LEU 360 CO 0.17 0.10 -0.00 0.20 -1.89 0.00 0.00 176.35 174.93 1x88 s ASN 361 N 0.85 4.12 -0.51 3.68 -0.87 -0.68 -4.38 114.94 117.15 1x88 s ASN 361 Ca 0.06 -1.02 0.05 0.00 -1.57 0.00 0.00 52.86 50.39 1x88 s ASN 361 Cb -0.13 -0.51 0.20 0.00 -0.02 0.00 0.00 41.25 40.79 1x88 s ASN 361 CO 0.03 -0.24 0.47 0.29 -2.57 0.00 0.00 177.10 175.08 1x88 n LYS 362 N -0.94 1.03 -1.62 -0.60 5.02 0.59 0.72 118.16 122.36 1x88 n LYS 362 Ca -0.04 -3.72 -0.46 0.00 -2.02 0.00 0.00 58.31 52.07 1x88 n LYS 362 Cb 0.63 -1.82 -0.03 0.00 -0.02 0.00 0.00 35.03 33.79 1x88 n LYS 362 CO 0.00 0.00 0.00 -2.30 -0.52 0.00 0.00 177.40 174.58 1x88 n PRO 363 N 2.06 1.55 -3.76 1.97 -0.02 -1.24 -4.18 135.00 131.38 1x88 n PRO 363 Ca 0.26 0.55 -0.13 0.00 -2.02 0.00 0.00 63.50 62.16 1x88 n PRO 363 Cb 0.45 -2.06 -0.11 0.00 -0.02 0.00 0.00 33.50 31.76 1x88 n PRO 363 CO 0.00 0.00 0.00 -2.00 1.98 0.00 0.00 175.50 175.48 1x88 s GLU 364 N -0.88 0.39 0.55 -0.52 2.12 -1.08 -4.99 118.70 114.28 1x88 s GLU 364 Ca 0.66 0.45 -0.21 0.00 0.36 0.00 0.00 54.97 56.22 1x88 s GLU 364 Cb -0.72 0.19 -0.05 0.00 0.26 0.00 0.00 34.13 33.81 1x88 s GLU 364 CO 0.55 -0.05 1.25 1.33 -0.54 0.00 0.00 175.26 177.80 1x88 n VAL 365 N 2.88 3.78 1.17 3.70 0.24 -1.26 -4.55 118.33 124.28 1x88 n VAL 365 Ca -0.13 -0.50 0.09 0.00 -2.04 0.00 0.00 64.34 61.76 1x88 n VAL 365 Cb 0.58 -1.51 0.55 0.00 -1.47 0.00 0.00 33.84 31.99 1x88 n VAL 365 CO 0.00 0.00 0.00 0.59 -2.14 0.00 0.00 176.83 175.28