#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 0.69 -2.78 0.00 -2.24 -1.26 -4.73 114.28 103.96 1gav n THR 3 Ca 0.00 -0.48 -0.43 0.00 -2.27 0.00 0.00 64.05 60.88 1gav n THR 3 Cb 0.00 -0.53 -0.02 0.00 -2.10 0.00 0.00 70.33 67.68 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 -4.72 4.45 0.03 3.22 2.96 -1.26 -4.90 118.68 118.47 1gav s LEU 4 Ca -0.06 -2.15 -0.17 0.00 -0.22 0.00 0.00 54.13 51.54 1gav s LEU 4 Cb 0.04 -2.47 0.03 0.00 0.50 0.00 0.00 46.19 44.29 1gav s LEU 4 CO 0.50 -1.13 0.37 0.00 -1.32 0.00 0.00 176.35 174.77 1gav s ARG 5 N 3.30 0.85 0.77 1.98 1.70 -1.26 -4.94 118.95 121.35 1gav s ARG 5 Ca 0.42 -0.37 -0.14 0.00 -0.47 0.00 0.00 55.73 55.17 1gav s ARG 5 Cb -0.02 0.38 0.06 0.00 -0.57 0.00 0.00 34.95 34.80 1gav s ARG 5 CO -0.05 -0.28 1.21 -1.54 -1.08 0.00 0.00 175.30 173.56 1gav s SER 6 N -1.90 3.88 0.08 -2.89 1.04 -1.26 -4.75 113.70 107.91 1gav s SER 6 Ca -0.07 2.35 -0.26 0.00 0.48 0.00 0.00 55.95 58.46 1gav s SER 6 Cb -0.01 -2.59 0.08 0.00 0.10 0.00 0.00 66.02 63.60 1gav s SER 6 CO -0.01 -2.48 0.75 0.72 0.98 0.00 0.00 173.24 173.20 1gav s PHE 7 N -2.08 -0.43 -0.29 5.02 -0.71 -0.72 -4.99 117.98 113.77 1gav s PHE 7 Ca 0.74 0.25 -0.27 0.00 -1.04 0.00 0.00 56.93 56.60 1gav s PHE 7 Cb -0.29 0.56 0.01 0.00 -1.21 0.00 0.00 43.02 42.09 1gav s PHE 7 CO 0.48 -0.71 0.97 0.08 -1.34 0.00 0.00 175.22 174.70 1gav s VAL 8 N -3.45 4.64 -0.05 -2.49 1.01 -1.26 -0.98 120.40 117.83 1gav s VAL 8 Ca 0.03 1.63 -0.18 0.00 0.00 0.00 0.00 61.98 63.46 1gav s VAL 8 Cb -0.01 -4.30 -0.31 0.00 0.00 0.00 0.00 36.38 31.76 1gav s VAL 8 CO -0.10 -0.33 0.79 0.25 0.00 0.00 0.00 175.10 175.71 1gav h LEU 9 N 9.73 0.52 -8.00 3.92 5.85 -0.62 -3.44 115.31 123.28 1gav h LEU 9 Ca -0.21 -0.92 -0.65 0.00 0.84 0.00 0.00 57.88 56.94 1gav h LEU 9 Cb 1.07 -0.17 -0.35 0.00 0.37 0.00 0.00 40.66 41.58 1gav h LEU 9 CO 0.97 1.55 -0.85 -0.69 -0.34 0.00 0.00 178.44 179.08 1gav s VAL 10 N -2.49 1.95 -0.62 1.05 1.01 -0.85 -4.98 120.40 115.48 1gav s VAL 10 Ca -0.15 -0.93 -0.11 0.00 0.00 0.00 0.00 61.98 60.80 1gav s VAL 10 Cb 0.03 -1.81 0.16 0.00 0.00 0.00 0.00 36.38 34.76 1gav s VAL 10 CO 0.83 0.47 0.52 -0.62 0.00 0.00 0.00 175.10 176.31 1gav s ASP 11 N 1.32 6.03 -0.76 3.32 2.15 -1.26 -1.19 116.67 126.28 1gav s ASP 11 Ca 0.04 -2.31 -0.02 0.00 0.43 0.00 0.00 52.55 50.68 1gav s ASP 11 Cb -0.14 -2.08 0.27 0.00 -0.30 0.00 0.00 42.92 40.68 1gav s ASP 11 CO -0.12 -0.63 2.22 0.59 -0.17 0.00 0.00 175.17 177.06 1gav n ASN 12 N 4.41 7.27 0.00 -0.34 5.03 -1.26 -4.93 115.26 125.43 1gav n ASN 12 Ca 0.01 -3.66 0.00 0.00 0.87 0.00 0.00 54.58 51.80 1gav n ASN 12 Cb 0.42 -1.12 0.00 0.00 -1.02 0.00 0.00 39.78 38.06 1gav n ASN 12 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1gav n GLY 13 N -0.12 2.20 0.00 7.41 0.00 -1.26 -3.35 105.19 110.07 1gav n GLY 13 Ca 0.53 0.07 0.00 0.00 0.00 0.00 0.00 46.02 46.61 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 0.98 0.00 -0.02 0.00 -1.26 -5.01 105.19 99.88 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 -1.30 0.00 0.00 0.00 173.32 172.02 1gav n THR 15 N 0.00 0.00 0.16 2.61 -2.24 -1.21 -4.70 114.28 108.90 1gav n THR 15 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 1gav n THR 15 Cb 0.26 -0.54 0.00 0.00 -2.10 0.00 0.00 70.33 67.95 1gav n THR 15 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1gav n GLY 16 N 2.88 1.89 3.73 3.38 0.00 -1.26 -4.91 105.19 110.90 1gav n GLY 16 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 1gav n GLY 16 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1gav s ASN 17 N 1.53 6.41 -0.44 1.61 0.01 -1.26 -4.67 114.94 118.12 1gav s ASN 17 Ca 0.00 2.87 -0.15 0.00 -0.71 0.00 0.00 52.86 54.87 1gav s ASN 17 Cb 0.00 -2.62 0.05 0.00 0.41 0.00 0.00 41.25 39.10 1gav s ASN 17 CO 0.00 -0.92 0.34 -0.69 -1.51 0.00 0.00 177.10 174.32 1gav s VAL 18 N 0.61 5.17 0.12 1.60 1.01 -0.33 -4.97 120.40 123.61 1gav s VAL 18 Ca 0.69 -0.91 -0.02 0.00 0.00 0.00 0.00 61.98 61.74 1gav s VAL 18 Cb -0.48 -4.00 -0.05 0.00 0.00 0.00 0.00 36.38 31.86 1gav s VAL 18 CO 0.39 -0.45 0.31 -0.89 0.00 0.00 0.00 175.10 174.46 1gav s THR 19 N 1.64 5.27 -0.02 3.92 2.01 -1.26 0.15 115.64 127.35 1gav s THR 19 Ca 0.04 -0.25 0.02 0.00 0.31 0.00 0.00 61.69 61.82 1gav s THR 19 Cb -0.22 -3.65 0.00 0.00 0.01 0.00 0.00 72.50 68.64 1gav s THR 19 CO 0.08 0.03 -0.09 0.54 -0.69 0.00 0.00 174.62 174.49 1gav s VAL 20 N -1.65 0.77 0.23 3.82 0.11 -0.15 -4.26 120.40 119.28 1gav s VAL 20 Ca 0.38 -0.36 0.11 0.00 -2.93 0.00 0.00 61.98 59.18 1gav s VAL 20 Cb -0.12 -0.69 -0.05 0.00 -1.53 0.00 0.00 36.38 34.00 1gav s VAL 20 CO 0.27 0.24 -0.19 0.68 -3.33 0.00 0.00 175.10 172.77 1gav s VAL 21 N 0.16 2.60 0.27 2.04 -7.23 0.74 -1.75 120.40 117.23 1gav s VAL 21 Ca -0.03 -2.12 -0.30 0.00 -1.81 0.00 0.00 61.98 57.73 1gav s VAL 21 Cb -0.08 -2.31 -0.10 0.00 0.56 0.00 0.00 36.38 34.45 1gav s VAL 21 CO 0.00 -0.24 1.39 -2.84 -0.31 0.00 0.00 175.10 173.10 1gav s PRO 22 N -3.09 4.30 0.00 4.82 0.02 -1.26 0.61 135.00 140.40 1gav s PRO 22 Ca 0.26 2.26 0.00 0.00 0.02 0.00 0.00 61.00 63.54 1gav s PRO 22 Cb -0.07 -3.10 0.00 0.00 0.02 0.00 0.00 34.50 31.35 1gav s PRO 22 CO 0.13 -0.34 0.00 0.28 -0.33 0.00 0.00 177.00 176.75 1gav n VAL 23 N 1.80 0.00 -3.64 3.83 0.31 0.60 -4.85 118.33 116.38 1gav n VAL 23 Ca 0.04 0.00 -0.09 0.00 -0.01 0.00 0.00 64.34 64.28 1gav n VAL 23 Cb 0.41 -0.10 -0.02 0.00 -0.91 0.00 0.00 33.84 33.22 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 -1.30 -0.41 -0.37 4.52 1.04 -1.15 -5.01 113.70 111.02 1gav s SER 24 Ca 0.00 -0.31 0.13 0.00 0.48 0.00 0.00 55.95 56.25 1gav s SER 24 Cb 0.00 0.66 0.42 0.00 0.10 0.00 0.00 66.02 67.20 1gav s SER 24 CO 0.00 -1.16 1.20 -3.20 0.98 0.00 0.00 173.24 171.07 1gav n ASN 25 N -0.42 -0.60 -4.81 7.02 5.15 -1.25 -1.80 115.26 118.54 1gav n ASN 25 Ca -0.10 -2.55 -0.37 0.00 -0.60 0.00 0.00 54.58 50.95 1gav n ASN 25 Cb 0.62 0.41 -0.06 0.00 -0.53 0.00 0.00 39.78 40.22 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 -1.10 3.53 -1.33 5.20 0.00 -1.19 -3.96 121.76 122.92 1gav s ALA 26 Ca 0.24 0.07 -0.05 0.00 0.00 0.00 0.00 51.96 52.22 1gav s ALA 26 Cb 0.42 -2.69 0.03 0.00 0.00 0.00 0.00 23.12 20.88 1gav s ALA 26 CO -0.04 0.38 0.37 0.09 0.00 0.00 0.00 175.76 176.56 1gav n ASN 27 N 1.27 -4.56 -0.86 0.00 3.02 -1.26 -1.51 115.26 111.36 1gav n ASN 27 Ca -0.07 -0.19 -0.10 0.00 -0.03 0.00 0.00 54.58 54.19 1gav n ASN 27 Cb 0.51 -3.76 -0.04 0.00 -0.61 0.00 0.00 39.78 35.88 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 -1.17 0.97 3.16 7.41 0.00 -1.25 -4.98 105.19 109.34 1gav n GLY 28 Ca -0.09 -0.54 -0.35 0.00 0.00 0.00 0.00 46.02 45.04 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 -2.41 2.99 0.27 1.61 1.01 -0.57 -4.38 120.40 118.92 1gav s VAL 29 Ca 0.00 -1.48 -0.29 0.00 0.00 0.00 0.00 61.98 60.21 1gav s VAL 29 Cb 0.00 -2.76 -0.09 0.00 0.00 0.00 0.00 36.38 33.52 1gav s VAL 29 CO 0.00 -0.18 0.94 0.00 0.00 0.00 0.00 175.10 175.87 1gav s ALA 30 N 1.23 3.30 -0.09 5.51 0.00 -0.21 -3.14 121.76 128.36 1gav s ALA 30 Ca -0.04 0.59 -0.02 0.00 0.00 0.00 0.00 51.96 52.49 1gav s ALA 30 Cb -0.20 -3.20 0.04 0.00 0.00 0.00 0.00 23.12 19.75 1gav s ALA 30 CO -0.02 0.20 0.04 -2.00 0.00 0.00 0.00 175.76 173.98 1gav s GLU 31 N -1.44 0.24 0.23 0.00 2.12 -0.75 -1.38 118.70 117.72 1gav s GLU 31 Ca 0.44 0.12 0.05 0.00 0.36 0.00 0.00 54.97 55.94 1gav s GLU 31 Cb -0.24 -1.08 -0.03 0.00 0.26 0.00 0.00 34.13 33.04 1gav s GLU 31 CO 0.30 -0.42 0.33 -1.58 -0.54 0.00 0.00 175.26 173.34 1gav s TRP 32 N 2.07 3.41 -0.02 5.30 0.51 0.91 -0.29 118.94 130.82 1gav s TRP 32 Ca 0.04 -0.01 -0.06 0.00 -2.12 0.00 0.00 56.10 53.94 1gav s TRP 32 Cb -0.13 -1.56 0.01 0.00 -0.81 0.00 0.00 33.47 30.97 1gav s TRP 32 CO -0.05 0.46 0.14 -0.51 -0.51 0.00 0.00 176.95 176.48 1gav s LEU 33 N -3.84 1.51 0.92 2.99 1.43 0.20 -1.93 118.68 119.95 1gav s LEU 33 Ca 0.34 -0.00 -0.14 0.00 -1.03 0.00 0.00 54.13 53.29 1gav s LEU 33 Cb -0.09 0.60 0.15 0.00 0.03 0.00 0.00 46.19 46.89 1gav s LEU 33 CO 0.28 -0.24 1.23 -0.94 0.23 0.00 0.00 176.35 176.91 1gav s SER 34 N -0.79 3.51 -1.14 2.29 1.04 -0.41 -0.19 113.70 118.01 1gav s SER 34 Ca -0.09 0.58 -0.16 0.00 0.48 0.00 0.00 55.95 56.77 1gav s SER 34 Cb -0.05 -0.88 0.15 0.00 0.10 0.00 0.00 66.02 65.34 1gav s SER 34 CO 0.01 -2.51 1.38 0.21 0.98 0.00 0.00 173.24 173.31 1gav s ASN 35 N -4.58 6.93 0.28 7.02 2.47 -1.26 -4.79 114.94 121.01 1gav s ASN 35 Ca 0.68 -2.67 -0.13 0.00 0.42 0.00 0.00 52.86 51.15 1gav s ASN 35 Cb -0.08 -2.42 0.01 0.00 -1.45 0.00 0.00 41.25 37.30 1gav s ASN 35 CO 0.52 -0.88 0.55 0.20 -3.72 0.00 0.00 177.10 173.77 1gav s ASN 36 N 3.20 0.02 0.55 -4.21 0.01 -1.26 -5.06 114.94 108.18 1gav s ASN 36 Ca 0.41 -0.97 -0.19 0.00 -0.71 0.00 0.00 52.86 51.41 1gav s ASN 36 Cb -0.03 0.65 -0.06 0.00 0.41 0.00 0.00 41.25 42.23 1gav s ASN 36 CO -0.02 -1.26 1.11 -0.94 -1.51 0.00 0.00 177.10 174.48 1gav s SER 37 N -3.03 5.75 0.57 -1.22 1.04 -1.26 -4.73 113.70 110.82 1gav s SER 37 Ca 0.21 2.10 0.30 0.00 0.48 0.00 0.00 55.95 59.04 1gav s SER 37 Cb -0.02 -2.57 1.46 0.00 0.10 0.00 0.00 66.02 64.98 1gav s SER 37 CO 0.10 -1.19 1.87 0.03 0.98 0.00 0.00 173.24 175.03 1gav h ARG 38 N 1.10 0.00 0.00 4.02 2.47 -1.97 0.33 114.38 120.33 1gav h ARG 38 Ca -0.49 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.23 1gav h ARG 38 Cb 1.25 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.57 1gav h ARG 38 CO 0.57 0.00 0.00 0.66 0.56 0.00 0.00 179.97 181.76 1gav h SER 39 N 0.00 0.00 0.00 7.04 4.64 -1.88 -3.25 113.55 120.09 1gav h SER 39 Ca 0.33 0.00 -0.10 0.00 -0.47 0.00 0.00 61.79 61.55 1gav h SER 39 Cb 1.51 0.00 -0.22 0.00 -0.31 0.00 0.00 62.40 63.38 1gav h SER 39 CO -0.00 0.00 -0.79 0.00 -0.87 0.00 0.00 176.83 175.17 1gav n GLN 40 N -2.52 0.08 -3.51 4.77 6.02 0.11 -3.78 117.38 118.54 1gav n GLN 40 Ca 0.00 -1.66 -0.32 0.00 -0.01 0.00 0.00 57.00 55.01 1gav n GLN 40 Cb 0.17 -0.28 -0.05 0.00 1.02 0.00 0.00 30.24 31.11 1gav n GLN 40 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1gav s ALA 41 N -0.16 3.66 0.35 -1.58 0.00 -0.97 -4.82 121.76 118.23 1gav s ALA 41 Ca 0.21 -0.37 -0.27 0.00 0.00 0.00 0.00 51.96 51.53 1gav s ALA 41 Cb 0.23 -2.32 -0.09 0.00 0.00 0.00 0.00 23.12 20.94 1gav s ALA 41 CO -0.10 0.57 1.19 0.71 0.00 0.00 0.00 175.76 178.13 1gav s TYR 42 N -1.70 3.19 0.01 0.00 1.51 -1.26 -4.62 117.35 114.47 1gav s TYR 42 Ca 0.43 1.55 0.00 0.00 -1.01 0.00 0.00 57.07 58.05 1gav s TYR 42 Cb -0.12 -3.44 -0.01 0.00 -0.11 0.00 0.00 41.96 38.28 1gav s TYR 42 CO 0.22 -1.27 -0.01 0.50 -1.11 0.00 0.00 175.55 173.88 1gav s ARG 43 N -1.96 0.13 -0.00 -0.62 3.52 -0.76 -1.29 118.95 117.96 1gav s ARG 43 Ca 0.52 -0.20 0.01 0.00 -0.13 0.00 0.00 55.73 55.93 1gav s ARG 43 Cb -0.33 -0.01 -0.00 0.00 -1.56 0.00 0.00 34.95 33.05 1gav s ARG 43 CO 0.43 -0.00 -0.05 0.08 -0.81 0.00 0.00 175.30 174.95 1gav s VAL 44 N -0.45 0.37 0.04 7.11 1.01 -0.81 -0.65 120.40 127.03 1gav s VAL 44 Ca -0.05 -0.22 0.01 0.00 0.00 0.00 0.00 61.98 61.73 1gav s VAL 44 Cb -0.03 -0.32 -0.03 0.00 0.00 0.00 0.00 36.38 36.00 1gav s VAL 44 CO -0.00 0.09 -0.06 0.42 0.00 0.00 0.00 175.10 175.55 1gav s THR 45 N -0.14 0.44 0.00 3.92 -4.23 -0.34 -0.06 115.64 115.23 1gav s THR 45 Ca 0.02 -1.18 -0.14 0.00 -1.18 0.00 0.00 61.69 59.20 1gav s THR 45 Cb -0.02 -0.71 0.02 0.00 1.34 0.00 0.00 72.50 73.14 1gav s THR 45 CO -0.00 -0.50 0.30 0.00 -0.54 0.00 0.00 174.62 173.88 1gav s ALA 46 N -1.80 -0.74 -0.05 3.99 0.00 -0.48 -0.80 121.76 121.88 1gav s ALA 46 Ca -0.08 0.23 -0.17 0.00 0.00 0.00 0.00 51.96 51.94 1gav s ALA 46 Cb -0.07 0.14 0.03 0.00 0.00 0.00 0.00 23.12 23.22 1gav s ALA 46 CO -0.01 -0.30 0.39 -1.54 0.00 0.00 0.00 175.76 174.30 1gav s SER 47 N -1.51 -0.31 -0.16 0.00 1.04 -0.55 -1.04 113.70 111.17 1gav s SER 47 Ca -0.12 0.33 -0.01 0.00 0.48 0.00 0.00 55.95 56.64 1gav s SER 47 Cb -0.04 0.45 0.04 0.00 0.10 0.00 0.00 66.02 66.57 1gav s SER 47 CO 0.02 -0.42 -0.04 -0.47 0.98 0.00 0.00 173.24 173.31 1gav s TYR 48 N -1.01 1.59 0.16 5.02 5.04 -1.26 -0.83 117.35 126.05 1gav s TYR 48 Ca -0.11 -1.01 0.01 0.00 -2.44 0.00 0.00 57.07 53.53 1gav s TYR 48 Cb -0.04 -1.26 -0.04 0.00 0.35 0.00 0.00 41.96 40.96 1gav s TYR 48 CO 0.04 -0.60 0.02 1.03 -1.34 0.00 0.00 175.55 174.71 1gav s ARG 49 N 1.67 1.03 0.43 4.97 0.52 -0.89 -4.98 118.95 121.69 1gav s ARG 49 Ca 0.01 -1.49 -0.18 0.00 -0.52 0.00 0.00 55.73 53.55 1gav s ARG 49 Cb -0.15 -0.09 -0.09 0.00 0.52 0.00 0.00 34.95 35.14 1gav s ARG 49 CO -0.08 -0.17 0.90 0.00 0.02 0.00 0.00 175.30 175.97 1gav s ALA 50 N -3.79 3.13 -0.04 2.13 0.00 -1.26 -0.55 121.76 121.38 1gav s ALA 50 Ca 0.23 0.23 -0.02 0.00 0.00 0.00 0.00 51.96 52.40 1gav s ALA 50 Cb 0.07 -3.03 0.03 0.00 0.00 0.00 0.00 23.12 20.19 1gav s ALA 50 CO 0.03 0.07 0.06 0.45 0.00 0.00 0.00 175.76 176.36 1gav s SER 51 N -2.49 1.11 0.32 0.00 0.15 -0.78 -4.77 113.70 107.25 1gav s SER 51 Ca 0.59 0.07 0.00 0.00 0.70 0.00 0.00 55.95 57.31 1gav s SER 51 Cb -0.10 -0.15 0.00 0.00 -1.71 0.00 0.00 66.02 64.07 1gav s SER 51 CO 0.20 -0.24 0.00 0.61 1.20 0.00 0.00 173.24 175.00 1gav n GLY 52 N 5.25 -1.74 1.14 9.45 0.00 -1.26 -2.13 105.19 115.89 1gav n GLY 52 Ca -0.04 -1.29 0.12 0.00 0.00 0.00 0.00 46.02 44.81 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 -0.15 2.43 -2.17 4.61 0.00 -1.26 -4.44 120.51 119.53 1gav n ALA 53 Ca 0.00 -0.97 -0.01 0.00 0.00 0.00 0.00 53.44 52.46 1gav n ALA 53 Cb 0.02 -0.88 -0.02 0.00 0.00 0.00 0.00 19.45 18.57 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 1.47 -0.06 -4.04 0.00 5.75 -1.26 -5.05 116.55 113.37 1gav n ASP 54 Ca 0.19 -1.86 -0.10 0.00 -0.01 0.00 0.00 54.79 53.01 1gav n ASP 54 Cb 0.60 -0.01 -0.08 0.00 -1.03 0.00 0.00 41.12 40.61 1gav n ASP 54 CO 0.00 0.00 0.00 -0.54 -0.11 0.00 0.00 177.20 176.55 1gav s LYS 55 N 0.00 1.21 0.10 0.11 1.02 -0.91 -2.42 119.74 118.85 1gav s LYS 55 Ca 0.12 -1.31 0.02 0.00 0.02 0.00 0.00 55.97 54.82 1gav s LYS 55 Cb 0.14 0.36 -0.04 0.00 -0.52 0.00 0.00 37.83 37.76 1gav s LYS 55 CO -0.06 -0.44 -0.07 1.03 -0.92 0.00 0.00 175.35 174.89 1gav s ARG 56 N -4.02 0.83 -0.05 1.68 1.81 -0.16 -1.86 118.95 117.18 1gav s ARG 56 Ca 0.23 -1.30 -0.02 0.00 -1.72 0.00 0.00 55.73 52.92 1gav s ARG 56 Cb 0.04 -0.24 0.04 0.00 -0.45 0.00 0.00 34.95 34.33 1gav s ARG 56 CO 0.04 -0.01 0.10 0.21 -0.68 0.00 0.00 175.30 174.97 1gav s LYS 57 N -3.66 0.00 -0.05 3.54 2.20 0.29 -1.12 119.74 120.94 1gav s LYS 57 Ca 0.11 0.38 -0.08 0.00 -0.36 0.00 0.00 55.97 56.01 1gav s LYS 57 Cb 0.04 -0.30 -0.05 0.00 -1.51 0.00 0.00 37.83 36.01 1gav s LYS 57 CO -0.04 -0.24 0.24 0.71 -0.36 0.00 0.00 175.35 175.65 1gav s TYR 58 N 1.69 3.62 -0.13 4.03 2.02 0.55 -2.11 117.35 127.02 1gav s TYR 58 Ca -0.02 0.63 -0.01 0.00 -0.37 0.00 0.00 57.07 57.29 1gav s TYR 58 Cb -0.12 -2.02 0.04 0.00 -0.40 0.00 0.00 41.96 39.46 1gav s TYR 58 CO -0.04 0.67 -0.01 0.99 -1.57 0.00 0.00 175.55 175.59 1gav s THR 59 N -1.14 0.65 -0.04 -0.71 2.01 -0.01 -0.76 115.64 115.64 1gav s THR 59 Ca 0.22 -0.27 0.06 0.00 0.31 0.00 0.00 61.69 62.00 1gav s THR 59 Cb -0.13 -0.89 -0.01 0.00 0.01 0.00 0.00 72.50 71.48 1gav s THR 59 CO 0.11 0.11 -0.21 -0.63 -0.69 0.00 0.00 174.62 173.31 1gav s ILE 60 N 1.84 1.73 -0.01 1.82 1.01 -0.25 -1.47 121.20 125.86 1gav s ILE 60 Ca 0.02 -0.91 0.03 0.00 0.00 0.00 0.00 60.65 59.80 1gav s ILE 60 Cb -0.14 -1.45 -0.01 0.00 0.01 0.00 0.00 42.46 40.87 1gav s ILE 60 CO -0.07 0.49 -0.11 -0.54 0.00 0.00 0.00 174.94 174.71 1gav s LYS 61 N -0.26 0.88 -0.02 2.79 1.02 0.02 0.09 119.74 124.26 1gav s LYS 61 Ca 0.02 -0.37 0.06 0.00 0.02 0.00 0.00 55.97 55.69 1gav s LYS 61 Cb -0.11 -0.85 -0.01 0.00 -0.52 0.00 0.00 37.83 36.34 1gav s LYS 61 CO 0.01 0.22 -0.20 -1.17 -0.92 0.00 0.00 175.35 173.29 1gav s LEU 62 N -0.20 2.02 -0.19 3.17 2.96 -0.09 -1.20 118.68 125.15 1gav s LEU 62 Ca 0.03 -0.36 0.00 0.00 -0.22 0.00 0.00 54.13 53.59 1gav s LEU 62 Cb -0.05 -1.02 0.04 0.00 0.50 0.00 0.00 46.19 45.66 1gav s LEU 62 CO -0.00 0.23 -0.09 -1.61 -1.32 0.00 0.00 176.35 173.56 1gav s GLU 63 N -0.39 1.91 -0.31 1.98 2.02 0.18 -1.46 118.70 122.63 1gav s GLU 63 Ca 0.06 -0.74 -0.04 0.00 0.02 0.00 0.00 54.97 54.27 1gav s GLU 63 Cb -0.08 -2.30 0.04 0.00 0.10 0.00 0.00 34.13 31.89 1gav s GLU 63 CO -0.00 -0.41 0.04 0.08 0.02 0.00 0.00 175.26 174.98 1gav s VAL 64 N 1.46 3.33 0.48 2.63 1.01 -0.36 -1.83 120.40 127.12 1gav s VAL 64 Ca -0.00 -1.22 -0.05 0.00 0.00 0.00 0.00 61.98 60.71 1gav s VAL 64 Cb -0.16 -2.87 -0.03 0.00 0.00 0.00 0.00 36.38 33.32 1gav s VAL 64 CO -0.08 -0.09 0.77 -2.16 0.00 0.00 0.00 175.10 173.53 1gav s PRO 65 N 1.33 3.49 -0.57 2.72 0.04 -1.26 -0.22 135.00 140.53 1gav s PRO 65 Ca -0.03 0.13 -0.09 0.00 0.04 0.00 0.00 61.00 61.04 1gav s PRO 65 Cb -0.19 -2.40 0.15 0.00 0.04 0.00 0.00 34.50 32.10 1gav s PRO 65 CO 0.00 -0.20 0.45 0.21 0.04 0.00 0.00 177.00 177.50 1gav s LYS 66 N -4.72 2.73 -0.26 4.56 2.47 -0.14 -4.96 119.74 119.41 1gav s LYS 66 Ca 0.47 -2.03 -0.29 0.00 -1.56 0.00 0.00 55.97 52.57 1gav s LYS 66 Cb -0.10 -4.01 -0.02 0.00 -1.46 0.00 0.00 37.83 32.24 1gav s LYS 66 CO 0.44 -1.22 1.56 0.42 0.16 0.00 0.00 175.35 176.71 1gav s ILE 67 N 0.91 3.77 0.15 5.43 1.01 -1.26 -1.11 121.20 130.10 1gav s ILE 67 Ca 0.10 0.86 -0.05 0.00 0.00 0.00 0.00 60.65 61.55 1gav s ILE 67 Cb -0.23 -3.83 -0.02 0.00 0.01 0.00 0.00 42.46 38.39 1gav s ILE 67 CO -0.02 -0.38 0.19 0.68 0.00 0.00 0.00 174.94 175.40 1gav s VAL 68 N 5.24 0.08 -0.36 2.92 -7.23 -0.73 -4.97 120.40 115.36 1gav s VAL 68 Ca 0.69 -1.63 -0.05 0.00 -1.81 0.00 0.00 61.98 59.17 1gav s VAL 68 Cb -0.22 -1.97 0.06 0.00 0.56 0.00 0.00 36.38 34.82 1gav s VAL 68 CO 0.29 -0.34 0.12 -0.89 -0.31 0.00 0.00 175.10 173.97 1gav s THR 69 N -4.01 3.52 0.52 5.32 2.01 -1.26 -1.13 115.64 120.61 1gav s THR 69 Ca 0.21 -1.46 -0.17 0.00 0.31 0.00 0.00 61.69 60.58 1gav s THR 69 Cb 0.05 -3.12 -0.07 0.00 0.01 0.00 0.00 72.50 69.37 1gav s THR 69 CO 0.02 -0.33 1.01 -1.58 -0.69 0.00 0.00 174.62 173.05 1gav s GLN 70 N 1.30 3.76 -0.16 4.92 0.74 0.29 -4.86 119.66 125.65 1gav s GLN 70 Ca 0.00 1.12 -0.04 0.00 0.05 0.00 0.00 55.36 56.50 1gav s GLN 70 Cb -0.21 -2.10 0.05 0.00 1.10 0.00 0.00 33.01 31.85 1gav s GLN 70 CO -0.00 -0.44 0.06 0.14 -0.55 0.00 0.00 175.29 174.50 1gav s VAL 71 N -2.41 0.20 -0.36 1.34 -7.23 -1.26 -0.55 120.40 110.13 1gav s VAL 71 Ca 0.62 -0.24 0.01 0.00 -1.81 0.00 0.00 61.98 60.55 1gav s VAL 71 Cb -0.13 -0.72 0.10 0.00 0.56 0.00 0.00 36.38 36.19 1gav s VAL 71 CO 0.29 -0.16 0.10 -0.69 -0.31 0.00 0.00 175.10 174.33 1gav s VAL 72 N 2.01 2.74 -0.74 1.32 1.01 -0.79 -4.65 120.40 121.29 1gav s VAL 72 Ca 0.01 -2.14 -0.03 0.00 0.00 0.00 0.00 61.98 59.83 1gav s VAL 72 Cb -0.16 -2.91 0.00 0.00 0.00 0.00 0.00 36.38 33.32 1gav s VAL 72 CO -0.08 -0.58 0.64 0.59 0.00 0.00 0.00 175.10 175.67 1gav n ASN 73 N 4.42 -3.30 0.00 3.32 3.02 -1.26 -2.20 115.26 119.27 1gav n ASN 73 Ca -0.00 -0.34 0.00 0.00 -0.03 0.00 0.00 54.58 54.21 1gav n ASN 73 Cb 0.42 -3.16 0.00 0.00 -0.61 0.00 0.00 39.78 36.42 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 -1.23 1.63 3.51 7.41 0.00 -1.26 -4.91 105.19 110.34 1gav n GLY 74 Ca -0.08 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.51 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 -2.55 4.34 -0.31 1.61 1.01 -0.93 -4.99 120.40 118.58 1gav s VAL 75 Ca 0.00 -1.32 -0.29 0.00 0.00 0.00 0.00 61.98 60.37 1gav s VAL 75 Cb 0.00 -4.95 0.01 0.00 0.00 0.00 0.00 36.38 31.45 1gav s VAL 75 CO 0.00 -1.75 1.10 -1.83 0.00 0.00 0.00 175.10 172.62 1gav s GLU 76 N 3.75 4.07 -0.03 2.72 -1.05 -1.26 -1.88 118.70 125.02 1gav s GLU 76 Ca 0.41 1.12 0.01 0.00 -0.15 0.00 0.00 54.97 56.36 1gav s GLU 76 Cb -0.02 -3.74 -0.03 0.00 -0.44 0.00 0.00 34.13 29.89 1gav s GLU 76 CO -0.08 -0.90 -0.02 -0.51 0.95 0.00 0.00 175.26 174.70 1gav s LEU 77 N 3.68 3.40 -0.22 1.83 1.43 0.29 -4.95 118.68 124.14 1gav s LEU 77 Ca 0.47 -0.00 -0.22 0.00 -1.03 0.00 0.00 54.13 53.34 1gav s LEU 77 Cb -0.13 -1.87 -0.02 0.00 0.03 0.00 0.00 46.19 44.20 1gav s LEU 77 CO 0.15 0.32 0.70 -2.16 0.23 0.00 0.00 176.35 175.59 1gav s PRO 78 N -1.24 4.19 0.10 1.29 0.04 -1.26 -0.55 135.00 137.57 1gav s PRO 78 Ca 0.16 0.72 0.01 0.00 0.04 0.00 0.00 61.00 61.93 1gav s PRO 78 Cb -0.11 -3.61 -0.00 0.00 0.04 0.00 0.00 34.50 30.81 1gav s PRO 78 CO 0.06 -0.37 0.11 1.33 0.04 0.00 0.00 177.00 178.18 1gav n VAL 79 N 4.98 0.00 -4.76 -0.36 0.24 -0.28 -4.69 118.33 113.45 1gav n VAL 79 Ca 0.01 -0.58 -0.26 0.00 -2.04 0.00 0.00 64.34 61.47 1gav n VAL 79 Cb 0.49 0.32 -0.16 0.00 -1.47 0.00 0.00 33.84 33.02 1gav n VAL 79 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 1gav s SER 80 N -1.63 2.10 0.28 -1.34 1.04 -1.25 -1.77 113.70 111.14 1gav s SER 80 Ca 0.09 -0.36 -0.02 0.00 0.48 0.00 0.00 55.95 56.15 1gav s SER 80 Cb 0.00 -0.87 0.44 0.00 0.10 0.00 0.00 66.02 65.69 1gav s SER 80 CO 0.07 0.09 1.92 0.00 0.98 0.00 0.00 173.24 176.30 1gav h ALA 81 N 6.73 1.43 -1.73 5.32 0.00 -1.46 -3.46 119.26 126.08 1gav h ALA 81 Ca -0.29 -0.04 0.29 0.00 0.00 0.00 0.00 54.91 54.87 1gav h ALA 81 Cb 1.19 -0.32 -0.10 0.00 0.00 0.00 0.00 17.79 18.56 1gav h ALA 81 CO 0.47 0.47 0.76 1.67 0.00 0.00 0.00 179.25 182.63 1gav s TRP 82 N -5.97 -0.04 0.08 0.00 1.48 -1.26 -5.01 118.94 108.21 1gav s TRP 82 Ca -0.12 -0.11 0.03 0.00 -1.06 0.00 0.00 56.10 54.84 1gav s TRP 82 Cb 0.19 0.57 -0.03 0.00 -1.16 0.00 0.00 33.47 33.04 1gav s TRP 82 CO 0.80 -0.41 -0.09 0.15 -4.06 0.00 0.00 176.95 173.35 1gav s LYS 83 N -2.52 0.76 0.00 3.25 1.02 -1.26 -0.97 119.74 120.03 1gav s LYS 83 Ca 0.16 -1.09 0.03 0.00 0.02 0.00 0.00 55.97 55.09 1gav s LYS 83 Cb 0.03 -0.40 -0.03 0.00 -0.52 0.00 0.00 37.83 36.90 1gav s LYS 83 CO -0.02 0.05 -0.07 0.00 -0.92 0.00 0.00 175.35 174.39 1gav s ALA 84 N -2.43 2.99 -0.03 5.17 0.00 0.69 -4.94 121.76 123.22 1gav s ALA 84 Ca 0.03 -1.02 0.06 0.00 0.00 0.00 0.00 51.96 51.02 1gav s ALA 84 Cb -0.03 -1.11 -0.01 0.00 0.00 0.00 0.00 23.12 21.97 1gav s ALA 84 CO -0.01 0.61 -0.19 0.71 0.00 0.00 0.00 175.76 176.87 1gav s TYR 85 N -0.98 1.80 0.02 0.00 1.51 -1.26 -1.22 117.35 117.22 1gav s TYR 85 Ca 0.17 -0.41 0.07 0.00 -1.01 0.00 0.00 57.07 55.89 1gav s TYR 85 Cb -0.11 -1.18 -0.02 0.00 -0.11 0.00 0.00 41.96 40.54 1gav s TYR 85 CO 0.07 -0.08 -0.20 0.00 -1.11 0.00 0.00 175.55 174.22 1gav s ALA 86 N -0.30 1.71 -0.05 3.71 0.00 -0.53 -5.00 121.76 121.30 1gav s ALA 86 Ca 0.04 -0.97 -0.02 0.00 0.00 0.00 0.00 51.96 51.01 1gav s ALA 86 Cb -0.09 -0.38 0.04 0.00 0.00 0.00 0.00 23.12 22.69 1gav s ALA 86 CO 0.00 0.40 0.09 0.45 0.00 0.00 0.00 175.76 176.70 1gav s SER 87 N -0.85 0.16 -0.06 0.00 0.15 -1.26 -0.91 113.70 110.93 1gav s SER 87 Ca 0.08 0.18 0.02 0.00 0.70 0.00 0.00 55.95 56.92 1gav s SER 87 Cb -0.08 0.06 0.01 0.00 -1.71 0.00 0.00 66.02 64.30 1gav s SER 87 CO 0.01 -0.16 -0.11 -0.63 1.20 0.00 0.00 173.24 173.55 1gav s ILE 88 N 1.33 1.03 -0.17 6.45 1.09 0.11 -5.01 121.20 126.04 1gav s ILE 88 Ca -0.07 -0.42 -0.00 0.00 -1.10 0.00 0.00 60.65 59.06 1gav s ILE 88 Cb -0.12 -0.95 0.00 0.00 -1.06 0.00 0.00 42.46 40.33 1gav s ILE 88 CO -0.04 0.33 -0.14 -1.81 -0.10 0.00 0.00 174.94 173.17 1gav s ASP 89 N 0.66 3.67 -0.16 3.58 1.11 -1.26 -1.10 116.67 123.17 1gav s ASP 89 Ca -0.13 -0.49 0.02 0.00 0.18 0.00 0.00 52.55 52.13 1gav s ASP 89 Cb -0.15 -1.57 0.01 0.00 1.07 0.00 0.00 42.92 42.28 1gav s ASP 89 CO 0.03 0.06 -0.21 -0.22 1.18 0.00 0.00 175.17 176.01 1gav s LEU 90 N 0.97 2.09 -0.14 1.23 2.96 0.07 -4.98 118.68 120.88 1gav s LEU 90 Ca -0.02 -0.61 0.01 0.00 -0.22 0.00 0.00 54.13 53.29 1gav s LEU 90 Cb -0.15 -1.44 -0.00 0.00 0.50 0.00 0.00 46.19 45.11 1gav s LEU 90 CO -0.02 0.04 -0.18 -0.89 -1.32 0.00 0.00 176.35 173.98 1gav s THR 91 N 1.04 2.50 -0.05 3.68 2.01 -1.26 -0.33 115.64 123.24 1gav s THR 91 Ca -0.02 -0.84 0.02 0.00 0.31 0.00 0.00 61.69 61.17 1gav s THR 91 Cb -0.14 -2.03 0.01 0.00 0.01 0.00 0.00 72.50 70.35 1gav s THR 91 CO -0.07 0.53 -0.10 -0.63 -0.69 0.00 0.00 174.62 173.67 1gav s ILE 92 N 0.64 0.91 0.63 1.82 1.01 -0.27 -4.97 121.20 120.97 1gav s ILE 92 Ca -0.09 -0.37 -0.17 0.00 0.00 0.00 0.00 60.65 60.01 1gav s ILE 92 Cb -0.16 -0.84 -0.02 0.00 0.01 0.00 0.00 42.46 41.46 1gav s ILE 92 CO 0.02 0.30 1.15 -2.16 0.00 0.00 0.00 174.94 174.25 1gav s PRO 93 N 0.55 2.86 0.08 2.79 0.04 -1.26 -0.98 135.00 139.07 1gav s PRO 93 Ca -0.10 1.61 0.20 0.00 0.04 0.00 0.00 61.00 62.75 1gav s PRO 93 Cb -0.13 -1.94 0.84 0.00 0.04 0.00 0.00 34.50 33.30 1gav s PRO 93 CO 0.02 -1.24 1.64 0.44 0.04 0.00 0.00 177.00 177.90 1gav n ILE 94 N -2.00 0.74 0.37 0.56 -5.35 -1.02 -2.25 119.36 110.41 1gav n ILE 94 Ca 0.12 0.15 0.13 0.00 -0.27 0.00 0.00 62.75 62.88 1gav n ILE 94 Cb 0.51 -0.91 0.34 0.00 -1.74 0.00 0.00 39.64 37.84 1gav n ILE 94 CO 0.00 0.00 0.00 -0.26 -1.76 0.00 0.00 176.55 174.53 1gav h PHE 95 N 0.00 0.00 -1.97 4.28 0.04 -1.91 -3.44 116.94 113.94 1gav h PHE 95 Ca 0.00 0.00 -0.60 0.00 2.80 0.00 0.00 57.97 60.17 1gav h PHE 95 Cb 0.37 0.00 0.01 0.00 2.20 0.00 0.00 35.95 38.53 1gav h PHE 95 CO 0.00 0.00 1.21 0.00 -0.60 0.00 0.00 178.31 178.92 1gav n ALA 96 N -1.97 1.14 -2.08 2.45 0.00 -0.95 -4.96 120.51 114.12 1gav n ALA 96 Ca 0.04 0.16 -0.27 0.00 0.00 0.00 0.00 53.44 53.37 1gav n ALA 96 Cb 0.44 -2.59 0.03 0.00 0.00 0.00 0.00 19.45 17.33 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 5.09 3.30 0.16 0.00 0.00 -1.26 -4.80 121.76 124.24 1gav s ALA 97 Ca 0.95 -0.69 -0.29 0.00 0.00 0.00 0.00 51.96 51.93 1gav s ALA 97 Cb -0.62 -2.61 -0.03 0.00 0.00 0.00 0.00 23.12 19.87 1gav s ALA 97 CO 0.48 -0.80 1.55 1.79 0.00 0.00 0.00 175.76 178.77 1gav h THR 98 N -0.18 0.01 -0.88 0.00 1.35 -1.99 0.68 112.91 111.91 1gav h THR 98 Ca -0.45 0.00 0.21 0.00 -0.55 0.00 0.00 66.41 65.61 1gav h THR 98 Cb 1.26 0.01 -0.12 0.00 -1.73 0.00 0.00 68.15 67.57 1gav h THR 98 CO 0.61 0.00 0.39 0.44 -0.25 0.00 0.00 175.52 176.71 1gav h ASP 99 N -0.12 0.34 0.05 5.36 3.32 -2.00 0.98 116.42 124.34 1gav h ASP 99 Ca 0.17 0.15 -0.00 0.00 0.02 0.00 0.00 57.03 57.36 1gav h ASP 99 Cb 0.50 0.12 0.00 0.00 0.22 0.00 0.00 39.33 40.17 1gav h ASP 99 CO -0.83 0.02 -0.02 0.44 -1.72 0.00 0.00 179.24 177.13 1gav h ASP 100 N 0.42 -0.05 -0.27 6.45 3.32 -0.09 -2.69 116.42 123.51 1gav h ASP 100 Ca 0.54 -0.10 0.05 0.00 0.02 0.00 0.00 57.03 57.54 1gav h ASP 100 Cb 1.00 0.01 -0.05 0.00 0.22 0.00 0.00 39.33 40.51 1gav h ASP 100 CO -0.51 0.07 -0.06 0.58 -1.72 0.00 0.00 179.24 177.60 1gav h VAL 101 N -0.17 0.74 -0.61 -1.35 2.07 0.53 -2.52 116.25 114.93 1gav h VAL 101 Ca -0.01 -0.00 0.13 0.00 0.82 0.00 0.00 66.70 67.64 1gav h VAL 101 Cb 0.15 0.73 -0.10 0.00 -1.52 0.00 0.00 31.29 30.55 1gav h VAL 101 CO 0.01 0.00 0.00 0.74 0.02 0.00 0.00 177.57 178.34 1gav h THR 102 N 0.00 0.50 -0.26 2.57 2.02 -0.61 -0.09 112.91 117.05 1gav h THR 102 Ca 0.13 -0.04 0.05 0.00 0.77 0.00 0.00 66.41 67.32 1gav h THR 102 Cb 0.19 0.37 -0.05 0.00 -1.74 0.00 0.00 68.15 66.93 1gav h THR 102 CO -0.27 0.02 -0.07 0.58 0.37 0.00 0.00 175.52 176.15 1gav h VAL 103 N 0.12 0.72 -0.41 3.16 2.07 -1.14 0.18 116.25 120.95 1gav h VAL 103 Ca 0.32 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.91 1gav h VAL 103 Cb 0.51 0.72 -0.09 0.00 -1.52 0.00 0.00 31.29 30.91 1gav h VAL 103 CO -0.52 0.00 -0.41 0.40 0.02 0.00 0.00 177.57 177.06 1gav h ILE 104 N -0.01 0.13 -0.63 4.57 2.04 -0.82 0.60 117.51 123.39 1gav h ILE 104 Ca 0.13 0.00 0.09 0.00 1.00 0.00 0.00 64.86 66.08 1gav h ILE 104 Cb 0.21 0.13 -0.11 0.00 -0.74 0.00 0.00 36.82 36.31 1gav h ILE 104 CO -0.28 0.00 -0.46 -1.28 0.00 0.00 0.00 178.15 176.13 1gav h SER 105 N -0.31 -1.60 -0.21 1.72 0.87 -0.01 0.71 113.55 114.73 1gav h SER 105 Ca 0.15 0.26 -0.01 0.00 -1.23 0.00 0.00 61.79 60.96 1gav h SER 105 Cb 0.58 0.72 -0.01 0.00 -0.44 0.00 0.00 62.40 63.25 1gav h SER 105 CO -0.57 -0.33 0.09 0.11 -0.53 0.00 0.00 176.83 175.60 1gav h LYS 106 N -0.21 0.30 -0.71 2.24 1.57 0.10 -2.80 116.57 117.07 1gav h LYS 106 Ca 0.18 -0.05 0.15 0.00 -1.87 0.00 0.00 60.65 59.06 1gav h LYS 106 Cb 0.55 -0.05 -0.10 0.00 0.08 0.00 0.00 32.23 32.71 1gav h LYS 106 CO -0.72 0.34 0.17 0.77 -0.57 0.00 0.00 179.45 179.44 1gav h SER 107 N 0.19 0.03 0.18 0.86 0.02 0.16 0.25 113.55 115.25 1gav h SER 107 Ca 0.07 0.14 0.00 0.00 -0.84 0.00 0.00 61.79 61.16 1gav h SER 107 Cb 0.14 0.18 -0.01 0.00 0.14 0.00 0.00 62.40 62.85 1gav h SER 107 CO -0.01 -0.02 -0.15 -0.07 -1.14 0.00 0.00 176.83 175.44 1gav h LEU 108 N 0.28 -0.40 -1.17 5.07 3.38 -0.75 0.27 115.31 121.99 1gav h LEU 108 Ca 0.39 0.03 0.09 0.00 0.09 0.00 0.00 57.88 58.48 1gav h LEU 108 Cb 0.64 0.13 -0.06 0.00 0.09 0.00 0.00 40.66 41.46 1gav h LEU 108 CO -0.48 -0.24 0.58 0.00 0.09 0.00 0.00 178.44 178.40 1gav h ALA 109 N 0.44 1.58 0.03 1.53 0.00 -0.59 -1.49 119.26 120.75 1gav h ALA 109 Ca -0.01 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 1gav h ALA 109 Cb 0.32 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.88 1gav h ALA 109 CO -0.02 0.25 -0.01 0.78 0.00 0.00 0.00 179.25 180.25 1gav h GLY 110 N 0.94 -0.04 -0.44 0.00 0.00 -0.19 -1.70 103.07 101.65 1gav h GLY 110 Ca 0.41 0.01 0.16 0.00 0.00 0.00 0.00 47.33 47.91 1gav h GLY 110 CO -0.17 -0.01 -0.11 -2.00 0.00 0.00 0.00 176.54 174.25 1gav h LEU 111 N -0.37 -0.55 -1.49 3.11 5.85 0.07 -1.56 115.31 120.36 1gav h LEU 111 Ca -0.00 0.21 0.00 0.00 0.84 0.00 0.00 57.88 58.93 1gav h LEU 111 Cb 0.35 0.41 0.00 0.00 0.37 0.00 0.00 40.66 41.79 1gav h LEU 111 CO 0.01 -0.22 0.00 0.49 -0.34 0.00 0.00 178.44 178.37 1gav n PHE 112 N -5.43 0.12 -1.67 1.25 3.72 -0.88 -4.44 117.46 110.12 1gav n PHE 112 Ca 0.12 -0.06 -0.41 0.00 -0.05 0.00 0.00 57.45 57.04 1gav n PHE 112 Cb 0.42 0.00 0.01 0.00 -0.94 0.00 0.00 39.48 38.97 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 0.76 1.72 -2.05 -1.08 4.81 -0.59 -4.62 118.16 117.11 1gav n LYS 113 Ca 0.17 0.61 -0.42 0.00 -0.87 0.00 0.00 58.31 57.80 1gav n LYS 113 Cb 0.46 -2.25 -0.03 0.00 0.02 0.00 0.00 35.03 33.24 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 -1.21 3.48 0.00 3.15 1.01 -1.26 -1.99 120.40 123.57 1gav s VAL 114 Ca 0.61 0.76 0.00 0.00 0.00 0.00 0.00 61.98 63.36 1gav s VAL 114 Cb -0.53 -3.49 0.00 0.00 0.00 0.00 0.00 36.38 32.35 1gav s VAL 114 CO 0.58 -0.03 0.00 0.61 0.00 0.00 0.00 175.10 176.26 1gav n GLY 115 N 3.95 1.25 3.89 4.51 0.00 -1.26 -5.06 105.19 112.47 1gav n GLY 115 Ca 0.16 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.89 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 -1.06 6.29 0.19 1.61 0.01 -0.84 -4.82 114.94 116.32 1gav s ASN 116 Ca 0.00 1.08 -0.25 0.00 -0.71 0.00 0.00 52.86 52.98 1gav s ASN 116 Cb 0.00 -2.32 0.06 0.00 0.41 0.00 0.00 41.25 39.40 1gav s ASN 116 CO 0.00 -0.63 1.55 -0.65 -1.51 0.00 0.00 177.10 175.86 1gav h PRO 117 N 0.24 -0.03 -0.51 -0.60 0.11 -1.89 -0.11 132.00 129.21 1gav h PRO 117 Ca -0.46 0.00 0.09 0.00 0.11 0.00 0.00 66.00 65.74 1gav h PRO 117 Cb 1.20 0.01 -0.08 0.00 0.11 0.00 0.00 31.00 32.24 1gav h PRO 117 CO 0.62 -0.02 0.07 0.82 -0.21 0.00 0.00 178.00 179.28 1gav h ILE 118 N -0.03 0.67 -0.26 4.15 5.03 -1.91 0.18 117.51 125.35 1gav h ILE 118 Ca 0.23 -0.07 0.03 0.00 -0.12 0.00 0.00 64.86 64.94 1gav h ILE 118 Cb 0.50 0.46 -0.03 0.00 -3.03 0.00 0.00 36.82 34.72 1gav h ILE 118 CO -0.93 0.04 0.06 0.00 -0.68 0.00 0.00 178.15 176.64 1gav h ALA 119 N 1.42 0.27 0.17 1.87 0.00 -1.29 -1.35 119.26 120.35 1gav h ALA 119 Ca 0.26 0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.21 1gav h ALA 119 Cb 0.37 0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.18 1gav h ALA 119 CO -0.36 -0.35 -0.35 0.93 0.00 0.00 0.00 179.25 179.11 1gav h GLU 120 N 0.16 -0.55 -0.56 0.00 5.08 0.79 -0.81 114.58 118.69 1gav h GLU 120 Ca 0.12 0.04 0.10 0.00 -1.00 0.00 0.00 59.36 58.61 1gav h GLU 120 Cb 0.11 0.12 -0.11 0.00 0.50 0.00 0.00 28.75 29.38 1gav h GLU 120 CO -0.15 -0.36 -0.36 0.00 -1.00 0.00 0.00 179.01 177.14 1gav h ALA 121 N -0.98 -0.13 -0.12 3.43 0.00 -0.59 -0.30 119.26 120.56 1gav h ALA 121 Ca -0.02 0.14 0.04 0.00 0.00 0.00 0.00 54.91 55.08 1gav h ALA 121 Cb 0.54 0.82 -0.05 0.00 0.00 0.00 0.00 17.79 19.10 1gav h ALA 121 CO -0.14 -0.72 -0.19 0.82 0.00 0.00 0.00 179.25 179.02 1gav h ILE 122 N -0.19 0.52 0.00 0.00 2.04 -1.01 0.68 117.51 119.55 1gav h ILE 122 Ca 0.21 0.00 0.00 0.00 1.00 0.00 0.00 64.86 66.07 1gav h ILE 122 Cb 0.55 0.52 0.00 0.00 -0.74 0.00 0.00 36.82 37.16 1gav h ILE 122 CO -0.66 0.00 0.00 -1.54 0.00 0.00 0.00 178.15 175.95 1gav n SER 123 N -5.33 0.00 -0.88 1.72 3.41 -0.18 -1.21 113.62 111.16 1gav n SER 123 Ca -0.03 -0.46 0.03 0.00 -0.26 0.00 0.00 58.87 58.15 1gav n SER 123 Cb 0.24 0.00 0.03 0.00 -0.26 0.00 0.00 64.21 64.22 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 -0.77 0.64 -4.38 4.04 3.41 -0.30 -4.97 113.62 111.28 1gav n SER 124 Ca 0.04 -2.17 -0.38 0.00 -0.26 0.00 0.00 58.87 56.10 1gav n SER 124 Cb 0.02 -0.27 -0.07 0.00 -0.26 0.00 0.00 64.21 63.63 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 -1.54 -4.12 4.33 6.02 -0.35 -4.88 117.38 116.88 1gav n GLN 125 Ca 0.04 0.20 -0.27 0.00 -0.01 0.00 0.00 57.00 56.97 1gav n GLN 125 Cb 0.87 -4.56 -0.05 0.00 1.02 0.00 0.00 30.24 27.53 1gav n GLN 125 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.06 176.50 1gav s SER 126 N -3.58 4.48 0.00 1.08 0.15 0.08 -5.03 113.70 110.88 1gav s SER 126 Ca 0.58 -1.23 0.00 0.00 0.70 0.00 0.00 55.95 55.99 1gav s SER 126 Cb -0.33 0.05 0.00 0.00 -1.71 0.00 0.00 66.02 64.03 1gav s SER 126 CO 0.99 -0.82 0.00 0.61 1.20 0.00 0.00 173.24 175.22 1gav n GLY 127 N -1.46 2.80 1.43 9.45 0.00 -1.26 -4.63 105.19 111.52 1gav n GLY 127 Ca -0.04 -2.12 0.11 0.00 0.00 0.00 0.00 46.02 43.97 1gav n GLY 127 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1gav n PHE 128 N -0.52 1.16 0.19 1.61 3.72 -1.26 -3.99 117.46 118.36 1gav n PHE 128 Ca 0.00 -0.54 0.08 0.00 -0.05 0.00 0.00 57.45 56.94 1gav n PHE 128 Cb 0.00 -0.09 0.11 0.00 -0.94 0.00 0.00 39.48 38.57 1gav n PHE 128 CO 0.00 0.00 0.00 1.88 -0.05 0.00 0.00 176.76 178.59 1gav h TYR 129 N 4.20 0.00 0.00 1.38 0.05 -2.05 -3.54 116.97 117.00 1gav h TYR 129 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.78 1gav h TYR 129 Cb 1.15 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.89 1gav h TYR 129 CO 0.59 0.22 0.00 0.00 -1.05 0.00 0.00 178.16 177.92