#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1gav n THR 3 N 0.00 0.00 -2.64 0.00 -2.24 -1.26 -4.83 114.28 103.31 1gav n THR 3 Ca 0.00 0.00 -0.43 0.00 -2.27 0.00 0.00 64.05 61.35 1gav n THR 3 Cb 0.00 -0.59 -0.01 0.00 -2.10 0.00 0.00 70.33 67.64 1gav n THR 3 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 1gav s LEU 4 N -3.05 3.98 0.07 3.22 2.96 -1.26 -4.89 118.68 119.71 1gav s LEU 4 Ca 0.00 -2.35 -0.06 0.00 -0.22 0.00 0.00 54.13 51.50 1gav s LEU 4 Cb 0.00 -2.55 -0.02 0.00 0.50 0.00 0.00 46.19 44.12 1gav s LEU 4 CO 0.00 -1.17 0.10 0.00 -1.32 0.00 0.00 176.35 173.96 1gav s ARG 5 N 3.96 0.72 0.51 1.98 1.70 -1.26 -4.91 118.95 121.64 1gav s ARG 5 Ca 0.51 -1.01 -0.21 0.00 -0.47 0.00 0.00 55.73 54.54 1gav s ARG 5 Cb 0.02 0.28 -0.06 0.00 -0.57 0.00 0.00 34.95 34.62 1gav s ARG 5 CO 0.04 -0.19 1.18 -1.54 -1.08 0.00 0.00 175.30 173.71 1gav s SER 6 N -2.75 5.83 0.24 -2.89 1.04 -1.26 -4.63 113.70 109.28 1gav s SER 6 Ca 0.04 2.34 -0.15 0.00 0.48 0.00 0.00 55.95 58.65 1gav s SER 6 Cb 0.05 -2.60 0.01 0.00 0.10 0.00 0.00 66.02 63.58 1gav s SER 6 CO -0.10 -1.15 0.53 0.72 0.98 0.00 0.00 173.24 174.22 1gav s PHE 7 N -1.58 0.14 -0.35 5.02 -0.71 -0.69 -4.98 117.98 114.83 1gav s PHE 7 Ca 0.68 -0.52 -0.21 0.00 -1.04 0.00 0.00 56.93 55.85 1gav s PHE 7 Cb -0.29 0.33 0.00 0.00 -1.21 0.00 0.00 43.02 41.85 1gav s PHE 7 CO 0.34 -1.01 0.65 0.08 -1.34 0.00 0.00 175.22 173.93 1gav s VAL 8 N -3.96 4.88 -0.01 -2.49 1.01 -1.26 -1.51 120.40 117.06 1gav s VAL 8 Ca 0.17 0.61 -0.20 0.00 0.00 0.00 0.00 61.98 62.56 1gav s VAL 8 Cb -0.02 -4.08 -0.27 0.00 0.00 0.00 0.00 36.38 32.01 1gav s VAL 8 CO 0.05 -0.32 1.03 0.25 0.00 0.00 0.00 175.10 176.12 1gav h LEU 9 N 9.40 0.56 -7.95 3.92 5.85 -0.95 -3.43 115.31 122.70 1gav h LEU 9 Ca -0.26 -0.84 -0.67 0.00 0.84 0.00 0.00 57.88 56.96 1gav h LEU 9 Cb 1.11 -0.18 -0.36 0.00 0.37 0.00 0.00 40.66 41.60 1gav h LEU 9 CO 0.84 1.34 -0.83 -0.69 -0.34 0.00 0.00 178.44 178.76 1gav s VAL 10 N -2.91 2.08 -0.52 1.05 1.01 -0.96 -4.96 120.40 115.19 1gav s VAL 10 Ca -0.13 -1.26 -0.17 0.00 0.00 0.00 0.00 61.98 60.42 1gav s VAL 10 Cb 0.03 -2.04 0.09 0.00 0.00 0.00 0.00 36.38 34.46 1gav s VAL 10 CO 0.84 0.25 0.52 -0.62 0.00 0.00 0.00 175.10 176.10 1gav s ASP 11 N 1.21 6.18 -0.66 3.32 2.15 -1.26 -1.38 116.67 126.24 1gav s ASP 11 Ca -0.02 -1.41 0.00 0.00 0.43 0.00 0.00 52.55 51.56 1gav s ASP 11 Cb -0.16 -2.23 0.40 0.00 -0.30 0.00 0.00 42.92 40.63 1gav s ASP 11 CO -0.09 -0.83 1.76 0.59 -0.17 0.00 0.00 175.17 176.42 1gav n ASN 12 N 5.59 6.74 0.00 -0.34 3.02 -1.26 -4.96 115.26 124.05 1gav n ASN 12 Ca -0.11 -3.79 0.00 0.00 -0.03 0.00 0.00 54.58 50.64 1gav n ASN 12 Cb 0.43 -0.84 0.00 0.00 -0.61 0.00 0.00 39.78 38.75 1gav n ASN 12 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1gav n GLY 13 N -0.65 1.95 0.00 7.41 0.00 -1.26 -3.14 105.19 109.50 1gav n GLY 13 Ca 0.52 0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.57 1gav n GLY 13 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1gav n GLY 14 N 0.00 0.28 0.00 -0.02 0.00 -1.26 -5.03 105.19 99.15 1gav n GLY 14 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1gav n GLY 14 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1gav n THR 15 N 0.00 0.00 0.03 2.61 -1.04 -1.19 -4.55 114.28 110.15 1gav n THR 15 Ca 0.00 0.01 0.00 0.00 -2.04 0.00 0.00 64.05 62.02 1gav n THR 15 Cb 0.00 -0.14 0.00 0.00 -1.82 0.00 0.00 70.33 68.37 1gav n THR 15 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1gav n GLY 16 N 3.33 1.65 3.71 3.41 0.00 -1.26 -4.91 105.19 111.12 1gav n GLY 16 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 1gav n GLY 16 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1gav n ASN 17 N 1.30 3.52 -4.49 1.61 3.02 -1.26 -4.70 115.26 114.26 1gav n ASN 17 Ca 0.00 1.11 -0.41 0.00 -0.03 0.00 0.00 54.58 55.25 1gav n ASN 17 Cb 0.33 -1.52 -0.10 0.00 -0.61 0.00 0.00 39.78 37.88 1gav n ASN 17 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1gav s VAL 18 N 0.43 5.20 -0.04 2.41 1.01 -0.48 -4.96 120.40 123.98 1gav s VAL 18 Ca 0.70 -0.45 -0.04 0.00 0.00 0.00 0.00 61.98 62.20 1gav s VAL 18 Cb -0.56 -3.78 -0.04 0.00 0.00 0.00 0.00 36.38 32.00 1gav s VAL 18 CO 0.43 -0.14 0.15 -0.89 0.00 0.00 0.00 175.10 174.64 1gav s THR 19 N 1.69 5.29 -0.06 3.92 2.01 -1.26 -0.23 115.64 127.00 1gav s THR 19 Ca 0.05 -0.10 0.03 0.00 0.31 0.00 0.00 61.69 61.99 1gav s THR 19 Cb -0.18 -3.40 0.00 0.00 0.01 0.00 0.00 72.50 68.93 1gav s THR 19 CO 0.10 0.43 -0.16 -0.69 -0.69 0.00 0.00 174.62 173.61 1gav s VAL 20 N -1.20 1.40 0.26 3.82 1.01 -0.57 -4.34 120.40 120.79 1gav s VAL 20 Ca 0.22 -0.66 0.10 0.00 0.00 0.00 0.00 61.98 61.64 1gav s VAL 20 Cb -0.12 -1.23 -0.04 0.00 0.00 0.00 0.00 36.38 34.98 1gav s VAL 20 CO 0.13 0.41 -0.07 0.68 0.00 0.00 0.00 175.10 176.24 1gav s VAL 21 N 0.34 3.13 0.11 2.92 -7.23 0.12 -1.70 120.40 118.08 1gav s VAL 21 Ca -0.11 -2.02 -0.30 0.00 -1.81 0.00 0.00 61.98 57.74 1gav s VAL 21 Cb -0.14 -2.65 -0.06 0.00 0.56 0.00 0.00 36.38 34.09 1gav s VAL 21 CO 0.04 -0.35 1.19 -2.84 -0.31 0.00 0.00 175.10 172.83 1gav s PRO 22 N -3.51 4.47 -0.01 4.82 0.02 -1.26 -0.33 135.00 139.20 1gav s PRO 22 Ca 0.30 1.79 0.00 0.00 0.02 0.00 0.00 61.00 63.11 1gav s PRO 22 Cb -0.06 -3.31 -0.01 0.00 0.02 0.00 0.00 34.50 31.13 1gav s PRO 22 CO 0.18 -0.17 -0.01 0.28 -0.33 0.00 0.00 177.00 176.95 1gav n VAL 23 N 3.39 0.08 -3.82 3.83 0.31 0.56 -4.91 118.33 117.77 1gav n VAL 23 Ca 0.07 -0.03 -0.10 0.00 -0.01 0.00 0.00 64.34 64.27 1gav n VAL 23 Cb 0.46 -0.66 -0.05 0.00 -0.91 0.00 0.00 33.84 32.68 1gav n VAL 23 CO 0.00 0.00 0.00 -0.94 -1.32 0.00 0.00 176.83 174.57 1gav s SER 24 N -3.87 -0.15 -0.42 4.52 1.04 -1.22 -5.02 113.70 108.58 1gav s SER 24 Ca -0.02 -0.63 0.08 0.00 0.48 0.00 0.00 55.95 55.87 1gav s SER 24 Cb 0.00 0.53 0.32 0.00 0.10 0.00 0.00 66.02 66.97 1gav s SER 24 CO 0.03 -1.00 0.90 -3.20 0.98 0.00 0.00 173.24 170.95 1gav n ASN 25 N -0.29 -0.95 -4.84 7.02 5.15 -1.26 -1.65 115.26 118.43 1gav n ASN 25 Ca -0.09 -3.31 -0.37 0.00 -0.60 0.00 0.00 54.58 50.21 1gav n ASN 25 Cb 0.63 0.72 -0.06 0.00 -0.53 0.00 0.00 39.78 40.53 1gav n ASN 25 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1gav s ALA 26 N -0.86 3.79 -1.56 5.20 0.00 -1.19 -4.28 121.76 122.87 1gav s ALA 26 Ca 0.31 -0.53 -0.04 0.00 0.00 0.00 0.00 51.96 51.70 1gav s ALA 26 Cb 0.30 -2.13 0.01 0.00 0.00 0.00 0.00 23.12 21.30 1gav s ALA 26 CO -0.09 0.49 0.44 0.09 0.00 0.00 0.00 175.76 176.70 1gav n ASN 27 N 2.24 -5.75 -0.38 0.00 3.02 -1.26 -1.75 115.26 111.39 1gav n ASN 27 Ca -0.17 -0.22 -0.05 0.00 -0.03 0.00 0.00 54.58 54.11 1gav n ASN 27 Cb 0.54 -4.69 -0.02 0.00 -0.61 0.00 0.00 39.78 35.00 1gav n ASN 27 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1gav n GLY 28 N -1.35 0.76 3.10 7.41 0.00 -1.26 -5.00 105.19 108.85 1gav n GLY 28 Ca -0.13 -0.73 -0.33 0.00 0.00 0.00 0.00 46.02 44.83 1gav n GLY 28 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1gav s VAL 29 N -2.15 2.37 0.16 1.61 1.01 -0.72 -4.41 120.40 118.26 1gav s VAL 29 Ca 0.00 -1.51 -0.28 0.00 0.00 0.00 0.00 61.98 60.19 1gav s VAL 29 Cb 0.00 -2.35 -0.07 0.00 0.00 0.00 0.00 36.38 33.95 1gav s VAL 29 CO 0.00 0.00 0.87 0.00 0.00 0.00 0.00 175.10 175.97 1gav s ALA 30 N 1.15 3.35 -0.08 5.51 0.00 -0.49 -3.13 121.76 128.07 1gav s ALA 30 Ca -0.07 0.48 0.02 0.00 0.00 0.00 0.00 51.96 52.40 1gav s ALA 30 Cb -0.19 -3.12 0.01 0.00 0.00 0.00 0.00 23.12 19.81 1gav s ALA 30 CO -0.05 0.15 -0.14 -2.00 0.00 0.00 0.00 175.76 173.72 1gav s GLU 31 N -0.69 1.97 -0.00 0.00 2.12 -0.66 -1.98 118.70 119.46 1gav s GLU 31 Ca 0.41 -0.50 0.08 0.00 0.36 0.00 0.00 54.97 55.32 1gav s GLU 31 Cb -0.24 -1.61 -0.02 0.00 0.26 0.00 0.00 34.13 32.52 1gav s GLU 31 CO 0.28 0.03 -0.24 -1.58 -0.54 0.00 0.00 175.26 173.21 1gav s TRP 32 N 0.69 2.39 0.12 5.30 0.51 0.11 -0.32 118.94 127.74 1gav s TRP 32 Ca -0.14 -0.39 0.03 0.00 -2.12 0.00 0.00 56.10 53.49 1gav s TRP 32 Cb -0.16 -1.48 -0.04 0.00 -0.81 0.00 0.00 33.47 30.98 1gav s TRP 32 CO 0.03 0.05 -0.08 -0.51 -0.51 0.00 0.00 176.95 175.94 1gav s LEU 33 N -0.86 2.50 0.00 2.99 1.43 0.55 -1.36 118.68 123.93 1gav s LEU 33 Ca 0.11 -0.97 -0.02 0.00 -1.03 0.00 0.00 54.13 52.21 1gav s LEU 33 Cb -0.10 -0.21 0.14 0.00 0.03 0.00 0.00 46.19 46.06 1gav s LEU 33 CO 0.00 -0.38 0.97 -1.54 0.23 0.00 0.00 176.35 175.63 1gav n SER 34 N 0.01 1.12 -3.71 2.29 3.41 -0.88 0.14 113.62 115.99 1gav n SER 34 Ca -0.12 -1.99 -0.42 0.00 -0.26 0.00 0.00 58.87 56.08 1gav n SER 34 Cb 0.60 -0.65 0.00 0.00 -0.26 0.00 0.00 64.21 63.91 1gav n SER 34 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1gav n ASN 35 N -3.02 6.30 -4.31 4.04 3.02 -1.26 -4.83 115.26 115.18 1gav n ASN 35 Ca 0.15 -3.12 -0.16 0.00 -0.03 0.00 0.00 54.58 51.42 1gav n ASN 35 Cb 0.55 -1.43 -0.10 0.00 -0.61 0.00 0.00 39.78 38.19 1gav n ASN 35 CO 0.00 0.00 0.00 0.20 -2.62 0.00 0.00 177.26 174.84 1gav s ASN 36 N 0.63 1.17 0.28 6.41 0.01 -1.26 -5.08 114.94 117.11 1gav s ASN 36 Ca 0.45 -1.38 -0.30 0.00 -0.71 0.00 0.00 52.86 50.92 1gav s ASN 36 Cb 0.13 0.17 -0.12 0.00 0.41 0.00 0.00 41.25 41.84 1gav s ASN 36 CO -0.03 -0.73 1.59 -1.20 -1.51 0.00 0.00 177.10 175.22 1gav n SER 37 N -0.46 3.79 -0.13 -1.22 7.64 -1.26 -4.74 113.62 117.24 1gav n SER 37 Ca 0.00 1.14 0.27 0.00 1.01 0.00 0.00 58.87 61.29 1gav n SER 37 Cb 0.66 -1.58 0.72 0.00 -1.01 0.00 0.00 64.21 63.00 1gav n SER 37 CO 0.00 0.00 0.00 0.03 -3.01 0.00 0.00 175.04 172.06 1gav h ARG 38 N 4.87 0.00 -0.01 1.43 2.47 -1.97 0.54 114.38 121.71 1gav h ARG 38 Ca -0.47 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.26 1gav h ARG 38 Cb 1.23 0.00 -0.00 0.00 -1.65 0.00 0.00 29.97 29.55 1gav h ARG 38 CO 0.80 0.00 0.04 0.66 0.56 0.00 0.00 179.97 182.03 1gav h SER 39 N 0.00 0.00 -1.26 7.04 4.64 -1.87 -3.26 113.55 118.84 1gav h SER 39 Ca 0.39 0.00 -0.39 0.00 -0.47 0.00 0.00 61.79 61.32 1gav h SER 39 Cb 1.71 0.00 -0.32 0.00 -0.31 0.00 0.00 62.40 63.48 1gav h SER 39 CO -0.00 0.00 -0.96 0.00 -0.87 0.00 0.00 176.83 174.99 1gav n GLN 40 N -3.36 1.02 -4.38 4.77 10.64 0.19 -3.88 117.38 122.38 1gav n GLN 40 Ca -0.03 -2.91 -0.27 0.00 -1.83 0.00 0.00 57.00 51.96 1gav n GLN 40 Cb 0.12 -1.39 -0.12 0.00 -0.86 0.00 0.00 30.24 27.98 1gav n GLN 40 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 1gav s ALA 41 N -1.69 2.31 0.47 2.61 0.00 -1.19 -4.62 121.76 119.65 1gav s ALA 41 Ca 0.33 -1.49 -0.23 0.00 0.00 0.00 0.00 51.96 50.57 1gav s ALA 41 Cb 0.35 -0.32 -0.07 0.00 0.00 0.00 0.00 23.12 23.08 1gav s ALA 41 CO -0.06 0.45 1.20 0.71 0.00 0.00 0.00 175.76 178.06 1gav s TYR 42 N -1.36 2.80 -0.00 0.00 1.51 -1.26 -4.67 117.35 114.37 1gav s TYR 42 Ca 0.15 1.51 -0.01 0.00 -1.01 0.00 0.00 57.07 57.71 1gav s TYR 42 Cb -0.09 -3.45 -0.00 0.00 -0.11 0.00 0.00 41.96 38.31 1gav s TYR 42 CO 0.07 -1.71 0.02 0.50 -1.11 0.00 0.00 175.55 173.31 1gav s ARG 43 N -2.68 0.12 -0.01 -0.62 3.52 -0.85 -2.08 118.95 116.34 1gav s ARG 43 Ca 0.64 -0.15 -0.00 0.00 -0.13 0.00 0.00 55.73 56.09 1gav s ARG 43 Cb -0.31 0.05 0.02 0.00 -1.56 0.00 0.00 34.95 33.14 1gav s ARG 43 CO 0.37 -0.02 0.02 0.08 -0.81 0.00 0.00 175.30 174.94 1gav s VAL 44 N -0.42 -0.03 0.08 7.11 1.01 -0.46 -0.47 120.40 127.21 1gav s VAL 44 Ca -0.05 0.11 0.03 0.00 0.00 0.00 0.00 61.98 62.07 1gav s VAL 44 Cb -0.03 -0.05 -0.03 0.00 0.00 0.00 0.00 36.38 36.27 1gav s VAL 44 CO -0.00 0.04 -0.09 0.42 0.00 0.00 0.00 175.10 175.47 1gav s THR 45 N 0.53 0.79 0.09 3.92 -4.23 0.07 0.09 115.64 116.90 1gav s THR 45 Ca -0.04 -1.50 -0.21 0.00 -1.18 0.00 0.00 61.69 58.76 1gav s THR 45 Cb -0.06 -1.17 0.05 0.00 1.34 0.00 0.00 72.50 72.66 1gav s THR 45 CO -0.02 -0.54 0.51 0.00 -0.54 0.00 0.00 174.62 174.03 1gav s ALA 46 N -2.25 -1.28 -0.09 3.99 0.00 -0.84 -0.86 121.76 120.43 1gav s ALA 46 Ca 0.01 0.41 -0.20 0.00 0.00 0.00 0.00 51.96 52.19 1gav s ALA 46 Cb -0.04 0.56 0.05 0.00 0.00 0.00 0.00 23.12 23.69 1gav s ALA 46 CO -0.01 -0.59 0.48 -1.54 0.00 0.00 0.00 175.76 174.11 1gav s SER 47 N -2.33 -0.45 -0.18 0.00 1.04 -1.09 -1.40 113.70 109.30 1gav s SER 47 Ca -0.02 0.61 -0.00 0.00 0.48 0.00 0.00 55.95 57.02 1gav s SER 47 Cb -0.00 0.64 0.04 0.00 0.10 0.00 0.00 66.02 66.81 1gav s SER 47 CO -0.07 -0.39 -0.07 -0.47 0.98 0.00 0.00 173.24 173.22 1gav s TYR 48 N -0.69 1.96 0.18 5.02 5.04 -1.26 -1.77 117.35 125.82 1gav s TYR 48 Ca -0.08 -1.27 0.01 0.00 -2.44 0.00 0.00 57.07 53.29 1gav s TYR 48 Cb -0.03 -1.43 -0.04 0.00 0.35 0.00 0.00 41.96 40.80 1gav s TYR 48 CO 0.04 -0.66 0.05 1.03 -1.34 0.00 0.00 175.55 174.67 1gav s ARG 49 N 1.55 1.13 0.61 4.97 0.52 -1.14 -4.97 118.95 121.62 1gav s ARG 49 Ca 0.00 -1.56 -0.11 0.00 -0.52 0.00 0.00 55.73 53.54 1gav s ARG 49 Cb -0.16 -0.08 -0.04 0.00 0.52 0.00 0.00 34.95 35.19 1gav s ARG 49 CO -0.08 -0.22 1.02 0.00 0.02 0.00 0.00 175.30 176.04 1gav s ALA 50 N -3.83 3.11 -0.18 2.13 0.00 -1.26 -0.39 121.76 121.34 1gav s ALA 50 Ca 0.28 -0.09 -0.08 0.00 0.00 0.00 0.00 51.96 52.06 1gav s ALA 50 Cb 0.07 -3.07 0.07 0.00 0.00 0.00 0.00 23.12 20.20 1gav s ALA 50 CO 0.06 -0.67 0.42 0.45 0.00 0.00 0.00 175.76 176.02 1gav s SER 51 N -4.15 -0.39 0.72 0.00 0.15 -0.70 -4.73 113.70 104.61 1gav s SER 51 Ca 0.55 0.95 0.00 0.00 0.70 0.00 0.00 55.95 58.15 1gav s SER 51 Cb -0.11 1.05 0.00 0.00 -1.71 0.00 0.00 66.02 65.25 1gav s SER 51 CO 0.53 -0.21 0.00 0.61 1.20 0.00 0.00 173.24 175.37 1gav n GLY 52 N 4.81 -0.45 0.26 9.45 0.00 -1.26 -2.35 105.19 115.65 1gav n GLY 52 Ca -0.16 -1.04 0.13 0.00 0.00 0.00 0.00 46.02 44.95 1gav n GLY 52 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1gav n ALA 53 N 1.07 3.14 -2.04 4.61 0.00 -1.26 -4.44 120.51 121.58 1gav n ALA 53 Ca 0.00 -0.42 -0.04 0.00 0.00 0.00 0.00 53.44 52.97 1gav n ALA 53 Cb 0.00 -1.10 -0.04 0.00 0.00 0.00 0.00 19.45 18.30 1gav n ALA 53 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1gav n ASP 54 N -0.62 -0.58 -4.20 0.00 5.68 -1.26 -5.01 116.55 110.57 1gav n ASP 54 Ca 0.12 -1.78 -0.12 0.00 -0.50 0.00 0.00 54.79 52.51 1gav n ASP 54 Cb 0.36 0.17 -0.10 0.00 -1.14 0.00 0.00 41.12 40.40 1gav n ASP 54 CO 0.00 0.00 0.00 -0.54 -1.33 0.00 0.00 177.20 175.33 1gav s LYS 55 N 0.00 0.92 0.16 0.11 1.02 -0.99 0.38 119.74 121.33 1gav s LYS 55 Ca 0.03 -1.35 0.09 0.00 0.02 0.00 0.00 55.97 54.75 1gav s LYS 55 Cb 0.03 -0.40 -0.04 0.00 -0.52 0.00 0.00 37.83 36.91 1gav s LYS 55 CO -0.01 0.03 -0.19 1.03 -0.92 0.00 0.00 175.35 175.29 1gav s ARG 56 N -3.66 1.26 -0.12 1.68 1.81 0.72 -1.72 118.95 118.92 1gav s ARG 56 Ca 0.13 -1.38 -0.04 0.00 -1.72 0.00 0.00 55.73 52.72 1gav s ARG 56 Cb 0.03 -1.36 0.05 0.00 -0.45 0.00 0.00 34.95 33.23 1gav s ARG 56 CO -0.02 0.28 0.12 0.21 -0.68 0.00 0.00 175.30 175.21 1gav s LYS 57 N -2.67 0.04 0.17 3.54 2.20 0.48 -0.75 119.74 122.75 1gav s LYS 57 Ca 0.15 0.26 -0.18 0.00 -0.36 0.00 0.00 55.97 55.83 1gav s LYS 57 Cb -0.06 -0.98 -0.08 0.00 -1.51 0.00 0.00 37.83 35.20 1gav s LYS 57 CO 0.06 -0.49 0.64 0.71 -0.36 0.00 0.00 175.35 175.92 1gav s TYR 58 N 2.22 3.68 -0.26 4.03 1.51 0.55 -2.90 117.35 126.19 1gav s TYR 58 Ca 0.04 1.28 -0.02 0.00 -1.01 0.00 0.00 57.07 57.35 1gav s TYR 58 Cb -0.14 -2.53 0.08 0.00 -0.11 0.00 0.00 41.96 39.27 1gav s TYR 58 CO -0.07 0.43 0.08 0.99 -1.11 0.00 0.00 175.55 175.86 1gav s THR 59 N -1.40 0.54 -0.07 -0.71 2.01 -0.73 -1.21 115.64 114.06 1gav s THR 59 Ca 0.38 -0.92 0.02 0.00 0.31 0.00 0.00 61.69 61.48 1gav s THR 59 Cb -0.17 -1.27 -0.02 0.00 0.01 0.00 0.00 72.50 71.05 1gav s THR 59 CO 0.20 -0.50 -0.13 -0.63 -0.69 0.00 0.00 174.62 172.88 1gav s ILE 60 N 1.82 3.19 -0.03 1.82 1.01 -0.26 -2.66 121.20 126.08 1gav s ILE 60 Ca 0.05 -0.66 0.02 0.00 0.00 0.00 0.00 60.65 60.06 1gav s ILE 60 Cb -0.17 -2.28 0.01 0.00 0.01 0.00 0.00 42.46 40.03 1gav s ILE 60 CO -0.21 0.58 -0.08 -0.54 0.00 0.00 0.00 174.94 174.69 1gav s LYS 61 N -0.53 1.01 0.08 2.79 1.02 -0.04 -0.54 119.74 123.53 1gav s LYS 61 Ca 0.07 -0.28 0.10 0.00 0.02 0.00 0.00 55.97 55.89 1gav s LYS 61 Cb -0.12 -0.93 -0.03 0.00 -0.52 0.00 0.00 37.83 36.23 1gav s LYS 61 CO 0.02 0.07 -0.26 -1.17 -0.92 0.00 0.00 175.35 173.08 1gav s LEU 62 N 0.38 2.24 -0.11 3.17 2.96 -0.54 -0.75 118.68 126.03 1gav s LEU 62 Ca -0.06 -0.65 -0.02 0.00 -0.22 0.00 0.00 54.13 53.18 1gav s LEU 62 Cb -0.10 -1.27 0.04 0.00 0.50 0.00 0.00 46.19 45.36 1gav s LEU 62 CO 0.01 0.23 0.02 -1.61 -1.32 0.00 0.00 176.35 173.68 1gav s GLU 63 N -1.58 0.53 -0.25 1.98 2.02 0.38 -2.03 118.70 119.75 1gav s GLU 63 Ca 0.13 -0.02 -0.03 0.00 0.02 0.00 0.00 54.97 55.06 1gav s GLU 63 Cb -0.10 -1.31 0.01 0.00 0.10 0.00 0.00 34.13 32.83 1gav s GLU 63 CO 0.04 -0.42 -0.03 0.08 0.02 0.00 0.00 175.26 174.95 1gav s VAL 64 N 1.97 3.25 0.36 2.63 1.01 -0.32 -2.02 120.40 127.28 1gav s VAL 64 Ca 0.03 -0.78 -0.07 0.00 0.00 0.00 0.00 61.98 61.16 1gav s VAL 64 Cb -0.14 -2.60 -0.05 0.00 0.00 0.00 0.00 36.38 33.59 1gav s VAL 64 CO -0.06 0.25 0.66 -2.16 0.00 0.00 0.00 175.10 173.79 1gav s PRO 65 N 1.41 3.67 -0.54 2.72 0.04 -1.26 -0.26 135.00 140.78 1gav s PRO 65 Ca 0.03 0.19 -0.11 0.00 0.04 0.00 0.00 61.00 61.14 1gav s PRO 65 Cb -0.16 -2.52 0.14 0.00 0.04 0.00 0.00 34.50 32.00 1gav s PRO 65 CO -0.03 0.07 0.44 0.21 0.04 0.00 0.00 177.00 177.73 1gav s LYS 66 N -3.83 2.75 -0.11 4.56 2.47 -0.35 -4.97 119.74 120.26 1gav s LYS 66 Ca 0.47 -1.89 -0.29 0.00 -1.56 0.00 0.00 55.97 52.70 1gav s LYS 66 Cb -0.10 -4.07 -0.03 0.00 -1.46 0.00 0.00 37.83 32.16 1gav s LYS 66 CO 0.32 -1.24 1.45 0.42 0.16 0.00 0.00 175.35 176.46 1gav s ILE 67 N 1.18 3.94 0.27 5.43 1.01 -1.26 -0.92 121.20 130.85 1gav s ILE 67 Ca 0.07 1.15 -0.07 0.00 0.00 0.00 0.00 60.65 61.80 1gav s ILE 67 Cb -0.25 -3.74 -0.01 0.00 0.01 0.00 0.00 42.46 38.47 1gav s ILE 67 CO -0.01 -0.10 0.41 0.68 0.00 0.00 0.00 174.94 175.92 1gav s VAL 68 N 3.70 0.00 -0.25 2.92 -7.23 -0.99 -4.94 120.40 113.60 1gav s VAL 68 Ca 0.64 -1.58 0.03 0.00 -1.81 0.00 0.00 61.98 59.25 1gav s VAL 68 Cb -0.27 -2.40 0.06 0.00 0.56 0.00 0.00 36.38 34.33 1gav s VAL 68 CO 0.22 0.00 -0.11 -0.89 -0.31 0.00 0.00 175.10 174.01 1gav s THR 69 N -3.74 2.08 0.60 5.32 2.01 -1.26 -1.44 115.64 119.21 1gav s THR 69 Ca 0.28 -1.56 -0.14 0.00 0.31 0.00 0.00 61.69 60.58 1gav s THR 69 Cb 0.01 -2.20 -0.04 0.00 0.01 0.00 0.00 72.50 70.28 1gav s THR 69 CO 0.13 -0.02 1.03 -1.58 -0.69 0.00 0.00 174.62 173.49 1gav s GLN 70 N 1.15 3.50 -0.08 4.92 0.74 -0.05 -4.85 119.66 124.98 1gav s GLN 70 Ca -0.08 0.94 -0.03 0.00 0.05 0.00 0.00 55.36 56.24 1gav s GLN 70 Cb -0.20 -2.07 0.05 0.00 1.10 0.00 0.00 33.01 31.89 1gav s GLN 70 CO -0.05 -0.64 0.17 0.14 -0.55 0.00 0.00 175.29 174.35 1gav s VAL 71 N -2.84 -0.17 -0.05 1.34 -7.23 -1.26 -0.65 120.40 109.54 1gav s VAL 71 Ca 0.58 0.26 -0.01 0.00 -1.81 0.00 0.00 61.98 61.01 1gav s VAL 71 Cb -0.12 -0.29 0.03 0.00 0.56 0.00 0.00 36.38 36.55 1gav s VAL 71 CO 0.44 0.11 0.01 -0.69 -0.31 0.00 0.00 175.10 174.66 1gav s VAL 72 N 1.76 0.23 -1.44 1.32 1.01 0.34 -4.78 120.40 118.84 1gav s VAL 72 Ca -0.03 0.16 -0.08 0.00 0.00 0.00 0.00 61.98 62.03 1gav s VAL 72 Cb -0.12 -0.38 0.05 0.00 0.00 0.00 0.00 36.38 35.93 1gav s VAL 72 CO -0.06 0.21 0.84 0.59 0.00 0.00 0.00 175.10 176.68 1gav n ASN 73 N 4.84 -3.14 -0.22 3.32 3.02 -1.26 -0.52 115.26 121.31 1gav n ASN 73 Ca -0.13 -0.81 -0.03 0.00 -0.03 0.00 0.00 54.58 53.59 1gav n ASN 73 Cb 0.50 -3.89 -0.01 0.00 -0.61 0.00 0.00 39.78 35.77 1gav n ASN 73 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1gav n GLY 74 N -1.66 0.52 3.25 7.41 0.00 -1.26 -4.98 105.19 108.47 1gav n GLY 74 Ca -0.11 -0.18 -0.35 0.00 0.00 0.00 0.00 46.02 45.37 1gav n GLY 74 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1gav s VAL 75 N -1.79 3.29 -0.07 1.61 1.01 0.32 -5.08 120.40 119.69 1gav s VAL 75 Ca 0.00 -0.91 -0.11 0.00 0.00 0.00 0.00 61.98 60.96 1gav s VAL 75 Cb 0.00 -2.69 -0.05 0.00 0.00 0.00 0.00 36.38 33.64 1gav s VAL 75 CO 0.00 0.14 0.27 -1.83 0.00 0.00 0.00 175.10 173.68 1gav s GLU 76 N 1.39 3.72 -0.00 2.72 -1.05 -1.26 -0.50 118.70 123.71 1gav s GLU 76 Ca 0.01 0.12 0.02 0.00 -0.15 0.00 0.00 54.97 54.96 1gav s GLU 76 Cb -0.17 -3.23 -0.01 0.00 -0.44 0.00 0.00 34.13 30.29 1gav s GLU 76 CO -0.02 0.69 -0.06 -0.51 0.95 0.00 0.00 175.26 176.31 1gav s LEU 77 N -0.91 2.02 -0.20 1.83 1.43 0.18 -4.98 118.68 118.05 1gav s LEU 77 Ca 0.19 -0.12 -0.29 0.00 -1.03 0.00 0.00 54.13 52.87 1gav s LEU 77 Cb -0.14 -0.30 -0.01 0.00 0.03 0.00 0.00 46.19 45.76 1gav s LEU 77 CO 0.08 0.06 1.35 -2.16 0.23 0.00 0.00 176.35 175.91 1gav s PRO 78 N -0.19 4.08 0.29 1.29 0.04 -1.26 -0.87 135.00 138.38 1gav s PRO 78 Ca 0.02 1.59 0.02 0.00 0.04 0.00 0.00 61.00 62.67 1gav s PRO 78 Cb -0.03 -3.85 -0.04 0.00 0.04 0.00 0.00 34.50 30.62 1gav s PRO 78 CO -0.00 -0.91 0.13 0.08 0.04 0.00 0.00 177.00 176.33 1gav s VAL 79 N 4.01 0.46 -0.22 -0.36 1.01 -0.52 -4.71 120.40 120.07 1gav s VAL 79 Ca 0.59 -2.00 -0.05 0.00 0.00 0.00 0.00 61.98 60.52 1gav s VAL 79 Cb -0.22 -2.56 -0.02 0.00 0.00 0.00 0.00 36.38 33.59 1gav s VAL 79 CO 0.20 0.00 -0.01 -0.55 0.00 0.00 0.00 175.10 174.74 1gav s SER 80 N -3.37 4.55 0.44 3.32 0.15 -1.25 -2.35 113.70 115.20 1gav s SER 80 Ca 0.36 -0.32 0.13 0.00 0.70 0.00 0.00 55.95 56.82 1gav s SER 80 Cb 0.06 -1.79 0.99 0.00 -1.71 0.00 0.00 66.02 63.58 1gav s SER 80 CO 0.16 -0.00 2.01 0.00 1.20 0.00 0.00 173.24 176.60 1gav h ALA 81 N 8.00 1.71 0.00 5.45 0.00 -1.37 -3.47 119.26 129.58 1gav h ALA 81 Ca -0.40 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.38 1gav h ALA 81 Cb 1.17 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.91 1gav h ALA 81 CO 0.60 0.22 0.00 -2.67 0.00 0.00 0.00 179.25 177.39 1gav n TRP 82 N -4.36 0.00 -4.09 0.00 4.27 -1.26 -5.00 117.44 106.99 1gav n TRP 82 Ca -0.02 0.00 -0.11 0.00 -3.89 0.00 0.00 57.50 53.48 1gav n TRP 82 Cb 0.21 0.00 -0.11 0.00 -1.36 0.00 0.00 31.31 30.05 1gav n TRP 82 CO 0.00 0.00 0.00 0.15 -2.29 0.00 0.00 177.69 175.55 1gav s LYS 83 N -2.00 0.61 -0.10 -2.67 1.02 -1.26 -1.22 119.74 114.12 1gav s LYS 83 Ca 0.00 -0.97 -0.03 0.00 0.02 0.00 0.00 55.97 54.99 1gav s LYS 83 Cb 0.00 -0.18 -0.03 0.00 -0.52 0.00 0.00 37.83 37.09 1gav s LYS 83 CO 0.00 0.00 0.03 0.00 -0.92 0.00 0.00 175.35 174.47 1gav s ALA 84 N -2.33 3.41 -0.02 5.17 0.00 0.64 -4.94 121.76 123.68 1gav s ALA 84 Ca -0.02 -0.77 0.07 0.00 0.00 0.00 0.00 51.96 51.24 1gav s ALA 84 Cb -0.04 -1.61 -0.02 0.00 0.00 0.00 0.00 23.12 21.45 1gav s ALA 84 CO -0.02 0.55 -0.24 0.71 0.00 0.00 0.00 175.76 176.76 1gav s TYR 85 N -0.78 2.18 -0.02 0.00 1.51 -1.26 -1.17 117.35 117.80 1gav s TYR 85 Ca 0.12 -0.45 0.03 0.00 -1.01 0.00 0.00 57.07 55.77 1gav s TYR 85 Cb -0.12 -1.41 -0.00 0.00 -0.11 0.00 0.00 41.96 40.32 1gav s TYR 85 CO 0.02 -0.06 -0.11 0.00 -1.11 0.00 0.00 175.55 174.29 1gav s ALA 86 N -0.51 1.03 -0.05 3.71 0.00 -0.86 -5.02 121.76 120.06 1gav s ALA 86 Ca 0.08 -0.46 0.01 0.00 0.00 0.00 0.00 51.96 51.59 1gav s ALA 86 Cb -0.10 -0.33 0.02 0.00 0.00 0.00 0.00 23.12 22.71 1gav s ALA 86 CO -0.00 0.20 -0.07 0.45 0.00 0.00 0.00 175.76 176.34 1gav s SER 87 N 0.00 1.22 -0.05 0.00 0.15 -1.26 -1.47 113.70 112.30 1gav s SER 87 Ca -0.01 -0.18 0.02 0.00 0.70 0.00 0.00 55.95 56.49 1gav s SER 87 Cb -0.08 -0.57 0.01 0.00 -1.71 0.00 0.00 66.02 63.68 1gav s SER 87 CO 0.00 -0.03 -0.11 -0.63 1.20 0.00 0.00 173.24 173.68 1gav s ILE 88 N 0.88 0.96 -0.15 6.45 1.09 0.30 -5.02 121.20 125.71 1gav s ILE 88 Ca -0.11 -0.41 0.01 0.00 -1.10 0.00 0.00 60.65 59.03 1gav s ILE 88 Cb -0.15 -0.87 0.02 0.00 -1.06 0.00 0.00 42.46 40.40 1gav s ILE 88 CO 0.01 0.30 -0.16 -1.81 -0.10 0.00 0.00 174.94 173.18 1gav s ASP 89 N 0.46 2.79 -0.12 3.58 1.11 -1.26 -1.11 116.67 122.12 1gav s ASP 89 Ca -0.09 -0.53 0.01 0.00 0.18 0.00 0.00 52.55 52.13 1gav s ASP 89 Cb -0.13 -1.25 -0.01 0.00 1.07 0.00 0.00 42.92 42.60 1gav s ASP 89 CO 0.02 -0.03 -0.17 -0.22 1.18 0.00 0.00 175.17 175.94 1gav s LEU 90 N 1.39 2.46 -0.12 1.23 0.20 -0.35 -4.97 118.68 118.51 1gav s LEU 90 Ca 0.04 -0.43 0.03 0.00 0.69 0.00 0.00 54.13 54.46 1gav s LEU 90 Cb -0.13 -1.53 0.01 0.00 -0.43 0.00 0.00 46.19 44.11 1gav s LEU 90 CO -0.10 0.15 -0.21 -0.89 -0.29 0.00 0.00 176.35 175.01 1gav s THR 91 N 0.40 1.94 -0.04 3.68 2.01 -1.26 -0.33 115.64 122.04 1gav s THR 91 Ca -0.13 -0.92 0.02 0.00 0.31 0.00 0.00 61.69 60.96 1gav s THR 91 Cb -0.17 -1.72 0.01 0.00 0.01 0.00 0.00 72.50 70.64 1gav s THR 91 CO 0.06 0.53 -0.07 -0.63 -0.69 0.00 0.00 174.62 173.82 1gav s ILE 92 N 0.73 0.71 0.71 1.82 1.01 0.07 -4.94 121.20 121.31 1gav s ILE 92 Ca -0.10 -0.25 -0.15 0.00 0.00 0.00 0.00 60.65 60.14 1gav s ILE 92 Cb -0.16 -0.68 0.03 0.00 0.01 0.00 0.00 42.46 41.66 1gav s ILE 92 CO 0.01 0.25 1.21 -2.84 0.00 0.00 0.00 174.94 173.57 1gav s PRO 93 N 0.63 2.24 0.00 2.79 0.02 -1.26 -0.20 135.00 139.22 1gav s PRO 93 Ca -0.10 1.78 0.27 0.00 0.02 0.00 0.00 61.00 62.97 1gav s PRO 93 Cb -0.13 -1.84 1.16 0.00 0.02 0.00 0.00 34.50 33.71 1gav s PRO 93 CO 0.01 -1.76 1.86 0.44 -0.33 0.00 0.00 177.00 177.22 1gav n ILE 94 N -2.57 0.17 0.65 2.83 -5.35 0.16 -2.40 119.36 112.85 1gav n ILE 94 Ca 0.14 0.04 0.13 0.00 -0.27 0.00 0.00 62.75 62.79 1gav n ILE 94 Cb 0.50 -0.59 0.45 0.00 -1.74 0.00 0.00 39.64 38.26 1gav n ILE 94 CO 0.00 0.00 0.00 0.49 -1.76 0.00 0.00 176.55 175.28 1gav n PHE 95 N -1.47 0.75 -1.66 4.28 3.72 -1.26 -4.74 117.46 117.08 1gav n PHE 95 Ca 0.07 0.23 -0.42 0.00 -0.05 0.00 0.00 57.45 57.28 1gav n PHE 95 Cb 0.30 -0.87 -0.03 0.00 -0.94 0.00 0.00 39.48 37.93 1gav n PHE 95 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1gav n ALA 96 N -1.73 1.65 -2.01 4.37 0.00 -1.01 -4.94 120.51 116.84 1gav n ALA 96 Ca 0.05 0.22 -0.22 0.00 0.00 0.00 0.00 53.44 53.50 1gav n ALA 96 Cb 0.38 -2.68 0.08 0.00 0.00 0.00 0.00 19.45 17.23 1gav n ALA 96 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1gav s ALA 97 N 4.31 4.18 0.12 0.00 0.00 -1.26 -4.87 121.76 124.23 1gav s ALA 97 Ca 0.88 -1.90 -0.30 0.00 0.00 0.00 0.00 51.96 50.64 1gav s ALA 97 Cb -0.44 -1.75 -0.10 0.00 0.00 0.00 0.00 23.12 20.82 1gav s ALA 97 CO 0.42 -1.14 1.50 1.15 0.00 0.00 0.00 175.76 177.69 1gav h THR 98 N -0.16 0.00 -0.64 0.00 2.02 -2.00 -1.55 112.91 110.58 1gav h THR 98 Ca -0.34 0.00 0.12 0.00 0.77 0.00 0.00 66.41 66.96 1gav h THR 98 Cb 1.28 0.00 -0.09 0.00 -1.74 0.00 0.00 68.15 67.60 1gav h THR 98 CO 0.41 0.00 0.17 0.44 0.37 0.00 0.00 175.52 176.90 1gav h ASP 99 N -0.40 0.06 -0.02 4.18 3.32 -1.99 -0.58 116.42 120.99 1gav h ASP 99 Ca 0.06 0.11 0.03 0.00 0.02 0.00 0.00 57.03 57.25 1gav h ASP 99 Cb 0.56 0.14 -0.05 0.00 0.22 0.00 0.00 39.33 40.20 1gav h ASP 99 CO -0.51 0.03 -0.29 0.44 -1.72 0.00 0.00 179.24 177.19 1gav h ASP 100 N 0.30 -0.87 -0.57 6.45 3.32 -1.70 -1.27 116.42 122.07 1gav h ASP 100 Ca 0.34 0.12 0.08 0.00 0.02 0.00 0.00 57.03 57.59 1gav h ASP 100 Cb 0.52 0.36 -0.06 0.00 0.22 0.00 0.00 39.33 40.36 1gav h ASP 100 CO -0.41 -0.35 0.24 0.58 -1.72 0.00 0.00 179.24 177.57 1gav h VAL 101 N -0.43 0.84 -0.35 -1.35 2.07 -0.47 -0.77 116.25 115.78 1gav h VAL 101 Ca 0.07 -0.15 0.07 0.00 0.82 0.00 0.00 66.70 67.51 1gav h VAL 101 Cb 0.52 0.35 -0.07 0.00 -1.52 0.00 0.00 31.29 30.58 1gav h VAL 101 CO -0.26 0.08 -0.09 0.74 0.02 0.00 0.00 177.57 178.06 1gav h THR 102 N 0.44 0.64 0.16 2.57 2.02 -0.37 0.40 112.91 118.78 1gav h THR 102 Ca 0.28 0.00 0.02 0.00 0.77 0.00 0.00 66.41 67.47 1gav h THR 102 Cb 0.29 0.64 -0.04 0.00 -1.74 0.00 0.00 68.15 67.31 1gav h THR 102 CO -0.25 0.00 -0.33 0.58 0.37 0.00 0.00 175.52 175.89 1gav h VAL 103 N -0.00 0.31 -0.67 3.16 2.07 -0.06 0.21 116.25 121.27 1gav h VAL 103 Ca 0.17 0.00 0.14 0.00 0.82 0.00 0.00 66.70 67.83 1gav h VAL 103 Cb 0.26 0.31 -0.12 0.00 -1.52 0.00 0.00 31.29 30.22 1gav h VAL 103 CO -0.37 0.00 -0.09 0.40 0.02 0.00 0.00 177.57 177.54 1gav h ILE 104 N -0.58 0.37 -0.39 4.57 2.04 -0.38 0.37 117.51 123.52 1gav h ILE 104 Ca 0.02 -0.02 0.08 0.00 1.00 0.00 0.00 64.86 65.95 1gav h ILE 104 Cb 0.59 0.32 -0.09 0.00 -0.74 0.00 0.00 36.82 36.90 1gav h ILE 104 CO -0.17 0.01 -0.20 -1.28 0.00 0.00 0.00 178.15 176.51 1gav h SER 105 N 0.05 -0.67 -0.07 1.72 0.87 0.14 -1.56 113.55 114.02 1gav h SER 105 Ca 0.34 0.15 -0.08 0.00 -1.23 0.00 0.00 61.79 60.97 1gav h SER 105 Cb 0.55 0.36 -0.01 0.00 -0.44 0.00 0.00 62.40 62.86 1gav h SER 105 CO -0.64 -0.23 -0.19 0.11 -0.53 0.00 0.00 176.83 175.35 1gav h LYS 106 N -0.13 0.45 0.07 2.24 1.57 0.27 -2.92 116.57 118.12 1gav h LYS 106 Ca 0.19 -0.14 0.01 0.00 -1.87 0.00 0.00 60.65 58.84 1gav h LYS 106 Cb 0.43 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.68 1gav h LYS 106 CO -0.47 0.62 -0.10 0.77 -0.57 0.00 0.00 179.45 179.70 1gav h SER 107 N 0.41 -0.26 -0.51 0.86 0.02 0.23 0.20 113.55 114.49 1gav h SER 107 Ca 0.07 0.03 0.08 0.00 -0.84 0.00 0.00 61.79 61.13 1gav h SER 107 Cb 0.56 0.10 -0.06 0.00 0.14 0.00 0.00 62.40 63.13 1gav h SER 107 CO 0.04 -0.15 0.15 -0.07 -1.14 0.00 0.00 176.83 175.66 1gav h LEU 108 N -0.20 0.11 -0.01 5.07 3.38 -1.33 0.39 115.31 122.71 1gav h LEU 108 Ca 0.01 0.08 0.03 0.00 0.09 0.00 0.00 57.88 58.09 1gav h LEU 108 Cb 0.21 0.08 -0.03 0.00 0.09 0.00 0.00 40.66 41.00 1gav h LEU 108 CO -0.05 0.08 -0.16 0.00 0.09 0.00 0.00 178.44 178.40 1gav h ALA 109 N 1.37 -0.19 -0.35 1.53 0.00 -1.19 -1.43 119.26 118.99 1gav h ALA 109 Ca 0.25 0.01 0.05 0.00 0.00 0.00 0.00 54.91 55.22 1gav h ALA 109 Cb 0.31 0.29 -0.04 0.00 0.00 0.00 0.00 17.79 18.35 1gav h ALA 109 CO -0.29 -0.65 0.09 0.78 0.00 0.00 0.00 179.25 179.18 1gav h GLY 110 N -0.26 0.43 -0.37 0.00 0.00 0.36 0.11 103.07 103.34 1gav h GLY 110 Ca 0.06 -0.04 0.10 0.00 0.00 0.00 0.00 47.33 47.44 1gav h GLY 110 CO -0.16 -0.00 -0.32 -2.00 0.00 0.00 0.00 176.54 174.06 1gav h LEU 111 N 0.23 -1.10 -1.39 3.11 5.85 0.75 -0.92 115.31 121.85 1gav h LEU 111 Ca 0.17 0.22 0.00 0.00 0.84 0.00 0.00 57.88 59.10 1gav h LEU 111 Cb 0.17 0.55 0.00 0.00 0.37 0.00 0.00 40.66 41.75 1gav h LEU 111 CO -0.20 -0.30 0.00 0.49 -0.34 0.00 0.00 178.44 178.09 1gav n PHE 112 N -5.43 0.15 -1.67 1.25 3.72 -0.75 -4.45 117.46 110.29 1gav n PHE 112 Ca 0.04 -0.08 -0.42 0.00 -0.05 0.00 0.00 57.45 56.94 1gav n PHE 112 Cb 0.35 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.89 1gav n PHE 112 CO 0.00 0.00 0.00 1.17 -0.05 0.00 0.00 176.76 177.88 1gav n LYS 113 N 0.63 1.81 -2.14 -1.08 4.81 0.35 -4.66 118.16 117.89 1gav n LYS 113 Ca 0.17 0.64 -0.42 0.00 -0.87 0.00 0.00 58.31 57.83 1gav n LYS 113 Cb 0.43 -2.24 -0.03 0.00 0.02 0.00 0.00 35.03 33.21 1gav n LYS 113 CO 0.00 0.00 0.00 0.08 1.17 0.00 0.00 177.40 178.65 1gav s VAL 114 N -1.17 3.24 0.00 3.15 1.01 -1.26 -2.15 120.40 123.22 1gav s VAL 114 Ca 0.59 0.87 0.00 0.00 0.00 0.00 0.00 61.98 63.44 1gav s VAL 114 Cb -0.56 -3.56 0.00 0.00 0.00 0.00 0.00 36.38 32.26 1gav s VAL 114 CO 0.59 0.06 0.00 0.61 0.00 0.00 0.00 175.10 176.36 1gav n GLY 115 N 3.56 2.82 3.87 4.51 0.00 -1.26 -5.06 105.19 113.63 1gav n GLY 115 Ca 0.12 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.84 1gav n GLY 115 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1gav s ASN 116 N -0.63 6.40 0.22 1.61 0.01 -0.91 -4.84 114.94 116.79 1gav s ASN 116 Ca 0.00 1.28 -0.19 0.00 -0.71 0.00 0.00 52.86 53.24 1gav s ASN 116 Cb 0.00 -2.40 0.19 0.00 0.41 0.00 0.00 41.25 39.45 1gav s ASN 116 CO 0.00 -0.63 1.56 1.55 -1.51 0.00 0.00 177.10 178.07 1gav h PRO 117 N 0.47 -0.03 -0.71 -0.60 0.13 -1.89 -1.93 132.00 127.43 1gav h PRO 117 Ca -0.46 0.00 0.11 0.00 -0.87 0.00 0.00 66.00 64.78 1gav h PRO 117 Cb 1.19 0.01 -0.08 0.00 0.13 0.00 0.00 31.00 32.25 1gav h PRO 117 CO 0.62 -0.02 0.33 0.82 -0.23 0.00 0.00 178.00 179.52 1gav h ILE 118 N -0.03 0.79 -0.14 -3.56 2.04 -1.90 0.16 117.51 114.87 1gav h ILE 118 Ca 0.31 -0.19 -0.01 0.00 1.00 0.00 0.00 64.86 65.97 1gav h ILE 118 Cb 0.57 0.20 -0.01 0.00 -0.74 0.00 0.00 36.82 36.85 1gav h ILE 118 CO -0.93 0.10 0.03 0.00 0.00 0.00 0.00 178.15 177.35 1gav h ALA 119 N 1.46 0.19 -0.22 1.87 0.00 -1.63 -1.19 119.26 119.74 1gav h ALA 119 Ca 0.36 -0.14 0.05 0.00 0.00 0.00 0.00 54.91 55.19 1gav h ALA 119 Cb 0.44 -0.05 -0.06 0.00 0.00 0.00 0.00 17.79 18.12 1gav h ALA 119 CO -0.31 -0.17 -0.16 1.49 0.00 0.00 0.00 179.25 180.10 1gav h GLU 120 N 0.03 -0.15 -0.16 0.00 4.81 -0.53 0.24 114.58 118.82 1gav h GLU 120 Ca 0.04 0.01 0.04 0.00 -0.13 0.00 0.00 59.36 59.33 1gav h GLU 120 Cb 0.26 0.03 -0.04 0.00 0.63 0.00 0.00 28.75 29.63 1gav h GLU 120 CO 0.00 -0.10 -0.11 0.00 -0.73 0.00 0.00 179.01 178.07 1gav h ALA 121 N 0.97 0.02 0.01 2.92 0.00 -0.57 -1.96 119.26 120.65 1gav h ALA 121 Ca 0.13 0.06 0.03 0.00 0.00 0.00 0.00 54.91 55.13 1gav h ALA 121 Cb 0.35 0.25 -0.04 0.00 0.00 0.00 0.00 17.79 18.35 1gav h ALA 121 CO -0.31 -0.55 -0.22 0.82 0.00 0.00 0.00 179.25 178.99 1gav h ILE 122 N -0.11 0.49 0.00 0.00 2.04 -0.55 -0.89 117.51 118.49 1gav h ILE 122 Ca 0.10 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.96 1gav h ILE 122 Cb 0.26 0.49 0.00 0.00 -0.74 0.00 0.00 36.82 36.83 1gav h ILE 122 CO -0.23 0.00 0.00 -1.54 0.00 0.00 0.00 178.15 176.38 1gav n SER 123 N -5.34 0.15 -0.61 1.72 3.41 0.01 -2.63 113.62 110.33 1gav n SER 123 Ca -0.05 -1.23 0.00 0.00 -0.26 0.00 0.00 58.87 57.34 1gav n SER 123 Cb 0.26 -0.07 0.00 0.00 -0.26 0.00 0.00 64.21 64.13 1gav n SER 123 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1gav n SER 124 N -0.33 0.09 -2.32 4.04 3.41 -0.74 -4.98 113.62 112.79 1gav n SER 124 Ca 0.00 -1.92 -0.14 0.00 -0.26 0.00 0.00 58.87 56.55 1gav n SER 124 Cb 0.04 -0.19 -0.01 0.00 -0.26 0.00 0.00 64.21 63.79 1gav n SER 124 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1gav n GLN 125 N 0.05 -2.02 -3.37 4.33 6.02 -1.07 -4.92 117.38 116.40 1gav n GLN 125 Ca 0.00 0.71 -0.20 0.00 -0.01 0.00 0.00 57.00 57.50 1gav n GLN 125 Cb 0.73 -5.29 -0.00 0.00 1.02 0.00 0.00 30.24 26.70 1gav n GLN 125 CO 0.00 0.00 0.00 -1.12 -1.01 0.00 0.00 177.06 174.93 1gav s SER 126 N -2.05 5.18 0.00 1.08 0.01 -0.42 -5.05 113.70 112.45 1gav s SER 126 Ca 0.00 -0.72 0.00 0.00 1.31 0.00 0.00 55.95 56.54 1gav s SER 126 Cb 0.00 -0.37 0.00 0.00 0.21 0.00 0.00 66.02 65.86 1gav s SER 126 CO 0.00 -0.82 0.00 0.61 0.41 0.00 0.00 173.24 173.44 1gav n GLY 127 N -1.75 3.81 3.36 3.44 0.00 -1.26 -4.55 105.19 108.24 1gav n GLY 127 Ca 0.06 -2.12 -0.41 0.00 0.00 0.00 0.00 46.02 43.54 1gav n GLY 127 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1gav s PHE 128 N 0.48 3.27 0.37 1.61 0.08 -1.26 -4.86 117.98 117.66 1gav s PHE 128 Ca 0.00 -1.07 0.03 0.00 0.12 0.00 0.00 56.93 56.01 1gav s PHE 128 Cb 0.00 -2.73 -0.01 0.00 -0.57 0.00 0.00 43.02 39.71 1gav s PHE 128 CO 0.00 -0.73 0.11 2.48 -0.10 0.00 0.00 175.22 176.98 1gav n TYR 129 N 5.03 0.24 0.00 0.36 0.18 -1.26 -5.25 117.16 116.46 1gav n TYR 129 Ca -0.11 -2.26 0.00 0.00 1.88 0.00 0.00 57.90 57.40 1gav n TYR 129 Cb 0.45 -0.04 0.00 0.00 -0.38 0.00 0.00 39.34 39.36 1gav n TYR 129 CO 0.00 0.00 0.00 0.00 -2.08 0.00 0.00 176.86 174.78