#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vve s LYS 2 N 0.00 2.08 -0.38 1.45 -2.85 -1.26 -4.78 119.74 114.00 1vve s LYS 2 Ca 0.00 -2.26 0.02 0.00 -1.00 0.00 0.00 55.97 52.73 1vve s LYS 2 Cb 0.00 -1.57 0.15 0.00 -2.06 0.00 0.00 37.83 34.35 1vve s LYS 2 CO 0.00 -0.21 0.28 0.00 0.10 0.00 0.00 175.35 175.51 1vve s GLN 4 N 0.58 -1.57 0.54 0.00 -0.21 -1.22 0.28 119.66 118.06 1vve s GLN 4 Ca 0.25 0.69 -0.19 0.00 0.02 0.00 0.00 55.36 56.14 1vve s GLN 4 Cb -0.10 -1.49 -0.10 0.00 1.00 0.00 0.00 33.01 32.33 1vve s GLN 4 CO -0.09 -4.12 0.46 -1.13 -2.12 0.00 0.00 175.29 168.29 1vve n SER 5 N -5.18 -1.28 -4.79 5.90 3.41 -0.96 -4.30 113.62 106.42 1vve n SER 5 Ca 0.04 0.75 -0.32 0.00 -0.26 0.00 0.00 58.87 59.08 1vve n SER 5 Cb 0.55 -1.13 0.03 0.00 -0.26 0.00 0.00 64.21 63.41 1vve n SER 5 CO 0.00 0.00 0.00 -2.16 -0.16 0.00 0.00 175.04 172.72 1vve s PRO 6 N -1.89 3.01 0.90 4.33 0.04 -1.26 -5.01 135.00 135.11 1vve s PRO 6 Ca 0.67 1.24 -0.12 0.00 0.04 0.00 0.00 61.00 62.83 1vve s PRO 6 Cb -0.47 -1.99 0.13 0.00 0.04 0.00 0.00 34.50 32.21 1vve s PRO 6 CO 0.56 -1.07 1.13 -1.25 0.04 0.00 0.00 177.00 176.41 1vve s PRO 7 N -4.25 1.22 1.20 0.56 0.04 -1.26 -4.91 135.00 127.61 1vve s PRO 7 Ca 0.64 0.37 -0.19 0.00 0.04 0.00 0.00 61.00 61.86 1vve s PRO 7 Cb -0.18 -1.84 0.28 0.00 0.04 0.00 0.00 34.50 32.81 1vve s PRO 7 CO 0.42 -2.16 1.10 -1.12 0.04 0.00 0.00 177.00 175.28 1vve s SER 8 N -3.95 0.92 0.01 6.66 0.01 -1.26 -4.84 113.70 111.26 1vve s SER 8 Ca 0.63 0.69 0.00 0.00 1.31 0.00 0.00 55.95 58.58 1vve s SER 8 Cb -0.15 -0.97 -0.00 0.00 0.21 0.00 0.00 66.02 65.11 1vve s SER 8 CO 0.54 -4.13 0.01 2.30 0.41 0.00 0.00 173.24 172.37 1vve n ILE 9 N -4.77 0.00 -1.52 1.44 -5.35 -1.05 -5.01 119.36 103.10 1vve n ILE 9 Ca 0.12 -0.09 -0.28 0.00 -0.27 0.00 0.00 62.75 62.24 1vve n ILE 9 Cb 0.59 0.05 -0.16 0.00 -1.74 0.00 0.00 39.64 38.38 1vve n ILE 9 CO 0.00 0.00 0.00 -1.20 -1.76 0.00 0.00 176.55 173.59 1vve n SER 10 N -2.82 0.01 -4.17 7.28 7.64 -1.26 -2.07 113.62 118.23 1vve n SER 10 Ca 0.00 -0.50 -0.34 0.00 1.01 0.00 0.00 58.87 59.04 1vve n SER 10 Cb 0.02 -0.95 -0.05 0.00 -1.01 0.00 0.00 64.21 62.22 1vve n SER 10 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 1vve n ASN 11 N 10.37 -0.85 -3.70 6.43 5.03 -1.26 -3.91 115.26 127.36 1vve n ASN 11 Ca 0.60 -1.24 -0.13 0.00 0.87 0.00 0.00 54.58 54.69 1vve n ASN 11 Cb 0.20 -1.90 -0.07 0.00 -1.02 0.00 0.00 39.78 36.99 1vve n ASN 11 CO 0.00 0.00 0.00 -0.83 -1.83 0.00 0.00 177.26 174.60 1vve s GLY 12 N -4.12 -0.23 0.00 7.41 0.00 -0.88 -2.47 107.32 107.04 1vve s GLY 12 Ca 0.15 0.34 0.00 0.00 0.00 0.00 0.00 44.72 45.22 1vve s GLY 12 CO 0.97 0.10 0.00 0.54 0.00 0.00 0.00 173.10 174.71 1vve n ARG 13 N 0.83 0.90 -3.64 2.90 1.74 0.38 -2.54 116.66 117.24 1vve n ARG 13 Ca -0.20 0.00 -0.09 0.00 -0.77 0.00 0.00 57.85 56.80 1vve n ARG 13 Cb 0.58 0.00 -0.07 0.00 -1.02 0.00 0.00 32.46 31.95 1vve n ARG 13 CO 0.00 0.00 0.00 -3.38 -1.52 0.00 0.00 177.63 172.73 1vve s HIS 14 N 0.59 -0.97 0.00 -1.55 -3.43 -1.26 0.26 115.29 108.92 1vve s HIS 14 Ca 0.00 2.04 0.00 0.00 -0.80 0.00 0.00 55.06 56.30 1vve s HIS 14 Cb 0.00 0.53 0.00 0.00 -1.43 0.00 0.00 32.58 31.68 1vve s HIS 14 CO 0.00 -0.48 0.00 -1.71 -2.00 0.00 0.00 174.74 170.55 1vve n ASN 15 N 3.85 0.00 -0.00 7.38 4.05 -1.25 -4.93 115.26 124.36 1vve n ASN 15 Ca -0.18 0.00 -0.00 0.00 0.45 0.00 0.00 54.58 54.85 1vve n ASN 15 Cb 0.58 0.00 -0.00 0.00 1.23 0.00 0.00 39.78 41.59 1vve n ASN 15 CO 0.00 0.00 0.00 1.23 -3.05 0.00 0.00 177.26 175.44 1vve h GLY 16 N 0.00 0.00 0.00 8.20 0.00 -1.86 -3.43 103.07 105.98 1vve h GLY 16 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1vve h GLY 16 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 176.54 178.12 1vve n TYR 17 N -2.28 0.00 0.00 5.60 0.18 -1.26 -5.01 117.16 114.39 1vve n TYR 17 Ca -0.00 0.00 0.00 0.00 1.88 0.00 0.00 57.90 59.78 1vve n TYR 17 Cb 0.00 0.00 0.00 0.00 -0.38 0.00 0.00 39.34 38.96 1vve n TYR 17 CO 0.00 0.00 0.00 -0.85 -2.08 0.00 0.00 176.86 173.93 1vve n GLU 18 N 0.00 0.00 0.00 -3.48 0.28 -1.26 -5.10 120.64 111.08 1vve n GLU 18 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.00 1vve n GLU 18 Cb 0.00 0.00 0.00 0.00 1.43 0.00 0.00 31.44 32.87 1vve n GLU 18 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 177.13 176.72 1vve n ASP 19 N 0.00 0.00 -3.41 -1.84 9.92 -1.26 -5.05 116.55 114.91 1vve n ASP 19 Ca 0.00 0.00 -0.23 0.00 -0.53 0.00 0.00 54.79 54.03 1vve n ASP 19 Cb 0.00 0.00 -0.10 0.00 -0.64 0.00 0.00 41.12 40.38 1vve n ASP 19 CO 0.00 0.00 0.00 0.72 0.13 0.00 0.00 177.20 178.05 1vve s PHE 20 N -1.00 0.20 1.21 1.24 -0.71 -1.26 -2.25 117.98 115.41 1vve s PHE 20 Ca 0.00 -1.20 -0.16 0.00 -1.04 0.00 0.00 56.93 54.53 1vve s PHE 20 Cb 0.00 -0.66 0.27 0.00 -1.21 0.00 0.00 43.02 41.42 1vve s PHE 20 CO 0.00 -0.90 0.73 0.66 -1.34 0.00 0.00 175.22 174.37 1vve n TYR 21 N 4.18 -1.72 0.00 3.49 4.01 0.80 -4.63 117.16 123.29 1vve n TYR 21 Ca 0.11 -0.19 0.00 0.00 -0.16 0.00 0.00 57.90 57.66 1vve n TYR 21 Cb 0.41 -1.60 0.00 0.00 -0.31 0.00 0.00 39.34 37.84 1vve n TYR 21 CO 0.00 0.00 0.00 0.25 -0.46 0.00 0.00 176.86 176.65 1vve n THR 22 N -4.99 0.00 -3.64 -0.72 -2.24 -1.25 0.17 114.28 101.61 1vve n THR 22 Ca 0.03 0.00 -0.05 0.00 -2.27 0.00 0.00 64.05 61.76 1vve n THR 22 Cb 0.56 -1.12 -0.06 0.00 -2.10 0.00 0.00 70.33 67.61 1vve n THR 22 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1vve s ASP 23 N -4.88 -0.17 -0.51 3.42 2.15 -1.26 -3.30 116.67 112.13 1vve s ASP 23 Ca 0.00 0.29 0.00 0.00 0.43 0.00 0.00 52.55 53.27 1vve s ASP 23 Cb 0.00 0.28 0.00 0.00 -0.30 0.00 0.00 42.92 42.90 1vve s ASP 23 CO 0.00 -0.08 0.00 0.61 -0.17 0.00 0.00 175.17 175.53 1vve n GLY 24 N 1.47 0.67 3.97 2.66 0.00 0.37 -4.92 105.19 109.41 1vve n GLY 24 Ca -0.09 -0.22 -0.26 0.00 0.00 0.00 0.00 46.02 45.45 1vve n GLY 24 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1vve s SER 25 N -2.38 3.86 0.03 1.61 0.01 -0.88 -4.86 113.70 111.09 1vve s SER 25 Ca 0.00 -0.18 -0.20 0.00 1.31 0.00 0.00 55.95 56.88 1vve s SER 25 Cb 0.00 -0.05 0.04 0.00 0.21 0.00 0.00 66.02 66.22 1vve s SER 25 CO 0.00 -2.21 0.46 -0.69 0.41 0.00 0.00 173.24 171.21 1vve s VAL 26 N -3.42 0.04 -0.09 3.43 1.01 -1.25 -1.43 120.40 118.70 1vve s VAL 26 Ca 0.70 -0.35 -0.02 0.00 0.00 0.00 0.00 61.98 62.31 1vve s VAL 26 Cb -0.04 -0.94 0.03 0.00 0.00 0.00 0.00 36.38 35.43 1vve s VAL 26 CO 0.48 -0.19 0.01 -0.69 0.00 0.00 0.00 175.10 174.70 1vve s VAL 27 N -2.29 0.35 -0.54 2.92 1.01 -0.99 -4.76 120.40 116.10 1vve s VAL 27 Ca -0.06 0.06 -0.27 0.00 0.00 0.00 0.00 61.98 61.71 1vve s VAL 27 Cb -0.01 -0.56 -0.01 0.00 0.00 0.00 0.00 36.38 35.79 1vve s VAL 27 CO -0.01 0.19 1.74 -0.89 0.00 0.00 0.00 175.10 176.13 1vve s THR 28 N 1.98 3.48 0.21 3.92 2.01 -1.26 -0.21 115.64 125.78 1vve s THR 28 Ca 0.04 0.37 -0.30 0.00 0.31 0.00 0.00 61.69 62.12 1vve s THR 28 Cb -0.13 -4.00 -0.09 0.00 0.01 0.00 0.00 72.50 68.29 1vve s THR 28 CO -0.06 -0.87 1.36 -0.31 -0.69 0.00 0.00 174.62 174.05 1vve s TYR 29 N 7.88 3.18 0.36 4.92 1.51 -1.26 -3.80 117.35 130.13 1vve s TYR 29 Ca 0.66 1.14 -0.01 0.00 -1.01 0.00 0.00 57.07 57.86 1vve s TYR 29 Cb -0.14 -3.68 -0.04 0.00 -0.11 0.00 0.00 41.96 37.99 1vve s TYR 29 CO 0.24 -2.17 0.58 -1.12 -1.11 0.00 0.00 175.55 171.98 1vve s SER 30 N 0.37 6.31 0.14 2.29 0.01 0.14 -4.86 113.70 118.10 1vve s SER 30 Ca 0.58 0.55 0.08 0.00 1.31 0.00 0.00 55.95 58.46 1vve s SER 30 Cb -0.38 -2.08 -0.04 0.00 0.21 0.00 0.00 66.02 63.73 1vve s SER 30 CO 0.40 -0.32 -0.18 0.00 0.41 0.00 0.00 173.24 173.55 1vve n ASN 32 N 0.51 -4.38 -4.56 0.00 4.13 -1.03 -4.60 115.26 105.33 1vve n ASN 32 Ca -0.15 0.29 -0.21 0.00 1.68 0.00 0.00 54.58 56.19 1vve n ASN 32 Cb 0.56 -0.93 -0.06 0.00 -1.54 0.00 0.00 39.78 37.82 1vve n ASN 32 CO 0.00 0.00 0.00 -0.55 0.28 0.00 0.00 177.26 176.99 1vve s SER 33 N -1.33 4.23 0.00 6.41 0.15 -1.26 -1.54 113.70 120.37 1vve s SER 33 Ca 0.48 0.13 0.00 0.00 0.70 0.00 0.00 55.95 57.26 1vve s SER 33 Cb -0.23 -2.54 0.00 0.00 -1.71 0.00 0.00 66.02 61.54 1vve s SER 33 CO 0.75 -3.47 0.00 0.61 1.20 0.00 0.00 173.24 172.33 1vve n GLY 34 N 6.63 1.97 3.54 9.45 0.00 -1.26 -5.13 105.19 120.39 1vve n GLY 34 Ca 0.43 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 46.14 1vve n GLY 34 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1vve s TYR 35 N -1.97 2.73 -0.00 1.61 1.51 -0.59 -4.84 117.35 115.80 1vve s TYR 35 Ca 0.00 -0.15 -0.21 0.00 -1.01 0.00 0.00 57.07 55.69 1vve s TYR 35 Cb 0.00 -1.51 -0.05 0.00 -0.11 0.00 0.00 41.96 40.29 1vve s TYR 35 CO 0.00 0.35 0.63 -1.12 -1.11 0.00 0.00 175.55 174.30 1vve s SER 36 N -1.65 7.01 -0.54 2.29 0.01 0.74 -4.80 113.70 116.76 1vve s SER 36 Ca 0.17 1.21 -0.18 0.00 1.31 0.00 0.00 55.95 58.46 1vve s SER 36 Cb -0.11 -2.38 0.09 0.00 0.21 0.00 0.00 66.02 63.83 1vve s SER 36 CO 0.08 0.07 0.60 -0.22 0.41 0.00 0.00 173.24 174.18 1vve s LEU 37 N -0.07 5.43 0.03 2.44 2.96 -1.23 -0.63 118.68 127.61 1vve s LEU 37 Ca 0.33 -1.33 -0.11 0.00 -0.22 0.00 0.00 54.13 52.80 1vve s LEU 37 Cb -0.18 -2.31 -0.06 0.00 0.50 0.00 0.00 46.19 44.14 1vve s LEU 37 CO 0.18 -0.94 0.38 -0.63 -1.32 0.00 0.00 176.35 174.02 1vve s ILE 38 N 2.34 5.11 0.00 6.68 -1.09 0.33 -4.78 121.20 129.79 1vve s ILE 38 Ca 0.10 0.55 0.00 0.00 -2.23 0.00 0.00 60.65 59.07 1vve s ILE 38 Cb -0.24 -3.65 0.00 0.00 -1.58 0.00 0.00 42.46 37.00 1vve s ILE 38 CO 0.07 0.41 0.00 0.61 -1.23 0.00 0.00 174.94 174.81 1vve n GLY 39 N 1.30 -2.01 3.77 6.18 0.00 -1.26 0.24 105.19 113.41 1vve n GLY 39 Ca -0.11 -2.17 -0.39 0.00 0.00 0.00 0.00 46.02 43.35 1vve n GLY 39 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1vve s ASN 40 N -1.66 6.27 -0.20 1.61 2.20 -1.26 -4.86 114.94 117.05 1vve s ASN 40 Ca 0.00 2.65 -0.06 0.00 -0.94 0.00 0.00 52.86 54.51 1vve s ASN 40 Cb 0.00 -2.64 -0.24 0.00 -2.00 0.00 0.00 41.25 36.37 1vve s ASN 40 CO 0.00 -0.87 3.51 -1.20 -2.94 0.00 0.00 177.10 175.60 1vve n SER 41 N 0.08 5.61 0.00 3.54 7.64 -1.26 -4.30 113.62 124.93 1vve n SER 41 Ca 0.04 -2.48 0.00 0.00 1.01 0.00 0.00 58.87 57.44 1vve n SER 41 Cb 0.44 -1.42 0.00 0.00 -1.01 0.00 0.00 64.21 62.22 1vve n SER 41 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1vve n GLY 42 N 2.64 0.01 3.00 0.23 0.00 -1.25 -4.18 105.19 105.64 1vve n GLY 42 Ca 0.47 0.68 -0.18 0.00 0.00 0.00 0.00 46.02 47.00 1vve n GLY 42 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1vve n VAL 43 N 0.00 0.00 -3.52 1.61 0.31 0.71 -4.27 118.33 113.16 1vve n VAL 43 Ca 0.00 -0.04 -0.29 0.00 -0.01 0.00 0.00 64.34 64.00 1vve n VAL 43 Cb 0.00 -0.45 -0.14 0.00 -0.91 0.00 0.00 33.84 32.34 1vve n VAL 43 CO 0.00 0.00 0.00 -0.22 -1.32 0.00 0.00 176.83 175.29 1vve s LEU 44 N 0.81 0.61 -0.26 7.52 2.96 -0.94 -2.34 118.68 127.04 1vve s LEU 44 Ca 0.34 -1.45 -0.29 0.00 -0.22 0.00 0.00 54.13 52.52 1vve s LEU 44 Cb -0.05 -0.35 0.01 0.00 0.50 0.00 0.00 46.19 46.30 1vve s LEU 44 CO 0.33 -0.42 1.07 0.00 -1.32 0.00 0.00 176.35 176.01 1vve s SER 46 N 1.42 2.68 -0.88 0.00 0.15 -1.19 0.14 113.70 116.02 1vve s SER 46 Ca 0.45 -0.62 0.00 0.00 0.70 0.00 0.00 55.95 56.48 1vve s SER 46 Cb -0.14 -0.79 0.00 0.00 -1.71 0.00 0.00 66.02 63.38 1vve s SER 46 CO 0.10 -0.21 0.00 0.61 1.20 0.00 0.00 173.24 174.94 1vve n GLY 47 N 4.94 0.07 1.51 9.45 0.00 -1.26 -3.37 105.19 116.53 1vve n GLY 47 Ca -0.11 -0.48 -0.03 0.00 0.00 0.00 0.00 46.02 45.41 1vve n GLY 47 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1vve n GLY 48 N -1.08 0.36 3.07 -0.02 0.00 -1.24 -4.86 105.19 101.42 1vve n GLY 48 Ca -0.12 -0.40 -0.02 0.00 0.00 0.00 0.00 46.02 45.49 1vve n GLY 48 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1vve s GLU 49 N -4.41 0.87 0.07 1.61 2.12 -1.22 -5.02 118.70 112.72 1vve s GLU 49 Ca 0.02 -0.50 -0.32 0.00 0.36 0.00 0.00 54.97 54.53 1vve s GLU 49 Cb -0.01 -0.00 -0.11 0.00 0.26 0.00 0.00 34.13 34.27 1vve s GLU 49 CO 0.13 -1.22 1.84 0.91 -0.54 0.00 0.00 175.26 176.38 1vve n TRP 50 N 4.05 2.52 -4.29 5.30 7.02 -1.26 -3.20 117.44 127.58 1vve n TRP 50 Ca 0.13 -0.12 -0.15 0.00 -1.02 0.00 0.00 57.50 56.34 1vve n TRP 50 Cb 0.56 -2.71 -0.10 0.00 -2.42 0.00 0.00 31.31 26.64 1vve n TRP 50 CO 0.00 0.00 0.00 -1.12 -2.02 0.00 0.00 177.69 174.55 1vve s SER 51 N 3.07 1.51 -0.89 -0.99 0.01 -0.95 -4.91 113.70 110.55 1vve s SER 51 Ca 0.85 -1.20 -0.04 0.00 1.31 0.00 0.00 55.95 56.87 1vve s SER 51 Cb -0.53 0.07 -0.03 0.00 0.21 0.00 0.00 66.02 65.74 1vve s SER 51 CO 0.41 -0.54 0.78 0.47 0.41 0.00 0.00 173.24 174.77 1vve n ASP 52 N -0.33 -7.06 -4.75 2.44 8.00 -1.26 -2.21 116.55 111.38 1vve n ASP 52 Ca -0.06 -0.42 -0.38 0.00 0.71 0.00 0.00 54.79 54.65 1vve n ASP 52 Cb 0.64 -4.96 -0.06 0.00 -0.02 0.00 0.00 41.12 36.72 1vve n ASP 52 CO 0.00 0.00 0.00 -2.16 -0.39 0.00 0.00 177.20 174.65 1vve s PRO 53 N -3.83 4.24 1.06 -0.24 0.04 -1.26 -4.40 135.00 130.61 1vve s PRO 53 Ca 0.21 0.38 -0.17 0.00 0.04 0.00 0.00 61.00 61.46 1vve s PRO 53 Cb -0.03 -3.39 0.23 0.00 0.04 0.00 0.00 34.50 31.35 1vve s PRO 53 CO 0.76 0.29 1.22 -1.25 0.04 0.00 0.00 177.00 178.06 1vve s PRO 54 N 0.22 -0.13 -0.00 0.56 0.04 -1.26 -4.89 135.00 129.54 1vve s PRO 54 Ca 0.24 -0.21 0.08 0.00 0.04 0.00 0.00 61.00 61.14 1vve s PRO 54 Cb -0.15 -1.74 -0.02 0.00 0.04 0.00 0.00 34.50 32.63 1vve s PRO 54 CO 0.10 -2.96 -0.24 0.95 0.04 0.00 0.00 177.00 174.89 1vve s THR 55 N -3.46 2.28 -0.98 1.26 -4.23 0.66 -4.84 115.64 106.33 1vve s THR 55 Ca 0.72 -1.13 -0.04 0.00 -1.18 0.00 0.00 61.69 60.06 1vve s THR 55 Cb -0.07 -1.84 0.24 0.00 1.34 0.00 0.00 72.50 72.17 1vve s THR 55 CO 0.54 0.51 0.91 0.00 -0.54 0.00 0.00 174.62 176.05 1vve n GLN 57 N 2.41 3.92 -4.29 0.00 6.02 0.20 -4.66 117.38 120.98 1vve n GLN 57 Ca 0.23 0.00 -0.30 0.00 -0.01 0.00 0.00 57.00 56.91 1vve n GLN 57 Cb 0.38 0.00 -0.16 0.00 1.02 0.00 0.00 30.24 31.47 1vve n GLN 57 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 1vve s ILE 58 N 2.27 1.68 -0.56 5.09 1.09 -1.26 0.26 121.20 129.77 1vve s ILE 58 Ca 0.00 -0.73 0.04 0.00 -1.10 0.00 0.00 60.65 58.86 1vve s ILE 58 Cb 0.00 -1.54 0.39 0.00 -1.06 0.00 0.00 42.46 40.25 1vve s ILE 58 CO 0.00 0.48 1.23 1.33 -0.10 0.00 0.00 174.94 177.88 1vve n VAL 59 N 4.44 2.91 -0.25 2.92 0.24 -1.26 -4.41 118.33 122.92 1vve n VAL 59 Ca -0.19 -5.07 0.00 0.00 -2.04 0.00 0.00 64.34 57.04 1vve n VAL 59 Cb 0.51 -1.31 0.00 0.00 -1.47 0.00 0.00 33.84 31.56 1vve n VAL 59 CO 0.00 0.00 0.00 0.29 -2.14 0.00 0.00 176.83 174.98 1vve n LYS 60 N -0.41 -1.34 -4.20 7.34 5.02 -1.26 -3.16 118.16 120.15 1vve n LYS 60 Ca 0.39 0.00 -0.19 0.00 -2.02 0.00 0.00 58.31 56.50 1vve n LYS 60 Cb 0.52 0.00 -0.12 0.00 -0.02 0.00 0.00 35.03 35.41 1vve n LYS 60 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1vve n PRO 62 N 1.06 1.38 -1.39 0.00 -0.04 -1.26 -4.82 135.00 129.93 1vve n PRO 62 Ca -0.19 -0.60 0.00 0.00 -0.04 0.00 0.00 63.50 62.67 1vve n PRO 62 Cb 0.55 -1.15 0.00 0.00 -0.04 0.00 0.00 33.50 32.86 1vve n PRO 62 CO 0.00 0.00 0.00 1.58 -0.04 0.00 0.00 175.50 177.04 1vve n HIS 63 N -0.03 -2.88 -2.69 0.54 -0.00 -1.26 -4.81 115.22 104.09 1vve n HIS 63 Ca 0.07 1.73 -0.42 0.00 0.46 0.00 0.00 57.72 59.56 1vve n HIS 63 Cb 0.15 -2.98 -0.03 0.00 -0.12 0.00 0.00 29.99 27.01 1vve n HIS 63 CO 0.00 0.00 0.00 -1.25 0.46 0.00 0.00 176.34 175.55 1vve s PRO 64 N -1.68 3.29 -0.13 1.57 0.04 -1.26 -4.75 135.00 132.09 1vve s PRO 64 Ca 0.00 -0.78 -0.01 0.00 0.04 0.00 0.00 61.00 60.26 1vve s PRO 64 Cb 0.00 -4.51 -0.08 0.00 0.04 0.00 0.00 34.50 29.95 1vve s PRO 64 CO 0.00 -2.01 -0.13 0.25 0.04 0.00 0.00 177.00 175.15 1vve n THR 65 N 6.23 0.75 -0.89 1.26 -2.24 -1.26 -4.65 114.28 113.48 1vve n THR 65 Ca 0.09 -0.26 0.07 0.00 -2.27 0.00 0.00 64.05 61.68 1vve n THR 65 Cb 0.48 -1.13 -0.03 0.00 -2.10 0.00 0.00 70.33 67.55 1vve n THR 65 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1vve n ILE 66 N -3.05 -0.14 -2.05 2.28 3.06 -1.26 -2.44 119.36 115.76 1vve n ILE 66 Ca -0.24 0.27 -0.40 0.00 -2.50 0.00 0.00 62.75 59.88 1vve n ILE 66 Cb 0.73 -0.47 -0.03 0.00 0.54 0.00 0.00 39.64 40.42 1vve n ILE 66 CO 0.00 0.00 0.00 -0.44 -2.50 0.00 0.00 176.55 173.61 1vve s SER 67 N -5.15 5.58 -1.83 9.51 0.01 -1.26 -3.81 113.70 116.75 1vve s SER 67 Ca 0.00 0.74 -0.20 0.00 1.31 0.00 0.00 55.95 57.80 1vve s SER 67 Cb 0.00 -2.53 0.20 0.00 0.21 0.00 0.00 66.02 63.90 1vve s SER 67 CO 0.00 -2.06 0.53 0.59 0.41 0.00 0.00 173.24 172.71 1vve n ASN 68 N 11.55 -1.54 0.00 2.44 4.13 -1.26 -2.89 115.26 127.69 1vve n ASN 68 Ca 0.21 -1.24 0.00 0.00 1.68 0.00 0.00 54.58 55.24 1vve n ASN 68 Cb 0.50 -1.69 0.00 0.00 -1.54 0.00 0.00 39.78 37.05 1vve n ASN 68 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1vve n GLY 69 N -1.29 0.00 3.52 7.41 0.00 -1.25 0.13 105.19 113.71 1vve n GLY 69 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.07 1vve n GLY 69 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 173.32 174.90 1vve n TYR 70 N -2.38 -1.40 -4.15 1.61 4.11 -1.02 -2.05 117.16 111.88 1vve n TYR 70 Ca 0.00 0.00 -0.12 0.00 -0.00 0.00 0.00 57.90 57.78 1vve n TYR 70 Cb 0.46 0.00 -0.11 0.00 -0.00 0.00 0.00 39.34 39.70 1vve n TYR 70 CO 0.00 0.00 0.00 -0.48 -0.00 0.00 0.00 176.86 176.38 1vve s LEU 71 N 0.00 2.41 -0.00 -3.48 -0.00 -1.25 0.25 118.68 116.61 1vve s LEU 71 Ca 0.00 -0.83 0.15 0.00 -0.00 0.00 0.00 54.13 53.45 1vve s LEU 71 Cb 0.00 -0.18 -0.17 0.00 -0.00 0.00 0.00 46.19 45.85 1vve s LEU 71 CO 0.00 -0.33 0.63 -0.24 -0.00 0.00 0.00 176.35 176.41 1vve n SER 72 N 0.52 0.73 0.00 1.48 2.88 0.19 -4.73 113.62 114.69 1vve n SER 72 Ca -0.16 -0.84 0.00 0.00 -1.33 0.00 0.00 58.87 56.54 1vve n SER 72 Cb 0.58 1.02 0.00 0.00 -0.75 0.00 0.00 64.21 65.06 1vve n SER 72 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 1vve n SER 73 N -1.37 0.00 -2.73 -3.46 7.64 -1.25 -4.87 113.62 107.58 1vve n SER 73 Ca 0.03 0.00 -0.04 0.00 1.01 0.00 0.00 58.87 59.87 1vve n SER 73 Cb 0.24 0.00 0.02 0.00 -1.01 0.00 0.00 64.21 63.46 1vve n SER 73 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1vve n GLY 74 N 0.00 -0.97 3.73 0.23 0.00 -1.26 -5.01 105.19 101.91 1vve n GLY 74 Ca 0.00 0.75 -0.30 0.00 0.00 0.00 0.00 46.02 46.47 1vve n GLY 74 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1vve s PHE 75 N 0.90 2.34 0.13 1.61 2.19 -1.26 -4.99 117.98 118.90 1vve s PHE 75 Ca 0.28 1.37 -0.17 0.00 0.33 0.00 0.00 56.93 58.73 1vve s PHE 75 Cb 0.05 -3.13 0.04 0.00 -1.31 0.00 0.00 43.02 38.67 1vve s PHE 75 CO -0.07 -2.26 0.43 0.21 1.83 0.00 0.00 175.22 175.36 1vve s LYS 76 N -4.90 1.12 0.21 10.12 2.20 -1.26 -5.04 119.74 122.18 1vve s LYS 76 Ca 0.63 -0.69 -0.17 0.00 -0.36 0.00 0.00 55.97 55.38 1vve s LYS 76 Cb -0.18 0.49 0.21 0.00 -1.51 0.00 0.00 37.83 36.84 1vve s LYS 76 CO 0.57 -0.45 1.59 -0.09 -0.36 0.00 0.00 175.35 176.61 1vve h ARG 77 N 2.31 -0.08 -5.05 4.03 2.43 -2.03 -3.42 114.38 112.56 1vve h ARG 77 Ca -0.34 0.01 -0.36 0.00 -0.81 0.00 0.00 59.98 58.48 1vve h ARG 77 Cb 1.26 0.02 -0.14 0.00 -0.42 0.00 0.00 29.97 30.69 1vve h ARG 77 CO 0.45 -0.05 -0.67 -1.12 -1.51 0.00 0.00 179.97 177.07 1vve s SER 78 N -5.22 1.75 0.00 -3.80 0.01 -1.26 -4.91 113.70 100.28 1vve s SER 78 Ca -0.14 -1.18 0.00 0.00 1.31 0.00 0.00 55.95 55.93 1vve s SER 78 Cb 0.19 0.02 0.00 0.00 0.21 0.00 0.00 66.02 66.44 1vve s SER 78 CO 0.72 -0.49 0.00 -1.22 0.41 0.00 0.00 173.24 172.66 1vve n TYR 79 N -0.37 0.00 0.00 2.43 4.02 -1.26 -4.98 117.16 117.00 1vve n TYR 79 Ca -0.06 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.83 1vve n TYR 79 Cb 0.63 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.95 1vve n TYR 79 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 176.86 174.72 1vve n SER 80 N 0.00 0.00 -1.68 7.72 3.41 -1.19 -4.57 113.62 117.31 1vve n SER 80 Ca 0.00 0.00 0.02 0.00 -0.26 0.00 0.00 58.87 58.63 1vve n SER 80 Cb 0.00 0.00 0.30 0.00 -0.26 0.00 0.00 64.21 64.25 1vve n SER 80 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1vve n TYR 81 N 0.00 1.80 0.00 7.33 4.19 -0.99 -4.15 117.16 125.35 1vve n TYR 81 Ca 0.00 -0.72 0.00 0.00 3.31 0.00 0.00 57.90 60.49 1vve n TYR 81 Cb 0.00 -0.49 0.00 0.00 0.49 0.00 0.00 39.34 39.34 1vve n TYR 81 CO 0.00 0.00 0.00 -1.71 0.91 0.00 0.00 176.86 176.06 1vve n ASN 82 N 0.33 0.00 -3.40 2.98 2.85 0.16 -4.20 115.26 113.99 1vve n ASN 82 Ca 0.26 0.00 -0.25 0.00 -0.11 0.00 0.00 54.58 54.48 1vve n ASN 82 Cb 1.08 0.00 0.02 0.00 1.24 0.00 0.00 39.78 42.12 1vve n ASN 82 CO 0.00 0.00 0.00 0.47 -2.11 0.00 0.00 177.26 175.62 1vve n ASP 83 N 0.00 -6.08 -4.77 1.20 8.00 -1.26 0.27 116.55 113.90 1vve n ASP 83 Ca 0.00 -0.20 -0.37 0.00 0.71 0.00 0.00 54.79 54.92 1vve n ASP 83 Cb 0.00 -2.80 -0.01 0.00 -0.02 0.00 0.00 41.12 38.29 1vve n ASP 83 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1vve s ASN 84 N -2.23 6.18 -0.11 -2.24 4.22 -1.26 -3.54 114.94 115.97 1vve s ASN 84 Ca 0.23 2.35 -0.01 0.00 -2.14 0.00 0.00 52.86 53.29 1vve s ASN 84 Cb -0.03 -2.61 0.03 0.00 1.28 0.00 0.00 41.25 39.92 1vve s ASN 84 CO 0.85 -0.91 -0.05 0.68 -2.04 0.00 0.00 177.10 175.62 1vve s VAL 85 N -1.50 0.86 -0.25 3.54 -7.23 0.61 -4.61 120.40 111.82 1vve s VAL 85 Ca 0.63 -0.25 -0.26 0.00 -1.81 0.00 0.00 61.98 60.29 1vve s VAL 85 Cb -0.30 -0.96 0.00 0.00 0.56 0.00 0.00 36.38 35.69 1vve s VAL 85 CO 0.36 0.29 0.92 -0.62 -0.31 0.00 0.00 175.10 175.74 1vve s ASP 86 N 1.77 6.92 0.14 4.85 -1.08 -1.26 -1.64 116.67 126.37 1vve s ASP 86 Ca 0.04 1.13 -0.30 0.00 -0.52 0.00 0.00 52.55 52.90 1vve s ASP 86 Cb -0.13 -2.48 -0.07 0.00 -1.46 0.00 0.00 42.92 38.79 1vve s ASP 86 CO -0.07 -0.60 1.00 -0.36 0.52 0.00 0.00 175.17 175.65 1vve s PHE 87 N 3.03 3.77 -0.60 -5.34 0.08 0.81 -0.64 117.98 119.09 1vve s PHE 87 Ca 0.39 1.75 0.02 0.00 0.12 0.00 0.00 56.93 59.21 1vve s PHE 87 Cb -0.15 -3.11 0.15 0.00 -0.57 0.00 0.00 43.02 39.34 1vve s PHE 87 CO 0.08 -0.00 0.38 0.21 -0.10 0.00 0.00 175.22 175.79 1vve s LYS 88 N -0.24 2.31 -0.10 0.44 2.20 0.69 -4.81 119.74 120.24 1vve s LYS 88 Ca 0.47 -2.74 -0.35 0.00 -0.36 0.00 0.00 55.97 52.99 1vve s LYS 88 Cb -0.25 -3.50 -0.17 0.00 -1.51 0.00 0.00 37.83 32.40 1vve s LYS 88 CO 0.31 -1.16 1.00 0.00 -0.36 0.00 0.00 175.35 175.14 1vve n LYS 90 N 1.74 0.00 -3.64 0.00 4.76 0.12 -4.83 118.16 116.31 1vve n LYS 90 Ca 0.19 0.07 -0.15 0.00 -2.87 0.00 0.00 58.31 55.55 1vve n LYS 90 Cb 0.04 -0.49 -0.08 0.00 -1.84 0.00 0.00 35.03 32.66 1vve n LYS 90 CO 0.00 0.00 0.00 -0.47 -1.37 0.00 0.00 177.40 175.56 1vve s TYR 91 N -0.16 -0.64 -1.39 2.13 5.04 -1.26 -4.92 117.35 116.14 1vve s TYR 91 Ca 0.00 1.47 -0.08 0.00 -2.44 0.00 0.00 57.07 56.02 1vve s TYR 91 Cb 0.00 0.26 0.04 0.00 0.35 0.00 0.00 41.96 42.60 1vve s TYR 91 CO 0.00 -0.39 1.00 0.41 -1.34 0.00 0.00 175.55 175.23 1vve n GLY 92 N 2.28 -0.46 3.22 8.97 0.00 -1.26 -4.97 105.19 112.97 1vve n GLY 92 Ca -0.15 0.19 -0.09 0.00 0.00 0.00 0.00 46.02 45.96 1vve n GLY 92 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1vve s TYR 93 N -3.38 0.09 -0.23 1.61 2.02 -1.26 -4.72 117.35 111.48 1vve s TYR 93 Ca 0.43 -0.46 0.02 0.00 -0.37 0.00 0.00 57.07 56.69 1vve s TYR 93 Cb -0.21 -0.01 0.05 0.00 -0.40 0.00 0.00 41.96 41.39 1vve s TYR 93 CO 0.78 -0.54 -0.10 0.21 -1.57 0.00 0.00 175.55 174.33 1vve s LYS 94 N -3.62 2.12 -0.72 -0.62 2.20 0.55 -4.78 119.74 114.87 1vve s LYS 94 Ca 0.03 -1.08 -0.30 0.00 -0.36 0.00 0.00 55.97 54.26 1vve s LYS 94 Cb 0.03 -2.66 -0.15 0.00 -1.51 0.00 0.00 37.83 33.54 1vve s LYS 94 CO -0.10 -0.50 2.52 1.28 -0.36 0.00 0.00 175.35 178.19 1vve n LEU 95 N 4.57 1.28 -4.54 5.43 4.77 -1.26 -2.08 117.00 125.18 1vve n LEU 95 Ca -0.14 -0.04 -0.41 0.00 -0.03 0.00 0.00 56.01 55.38 1vve n LEU 95 Cb 0.44 -1.21 -0.03 0.00 -2.33 0.00 0.00 43.42 40.29 1vve n LEU 95 CO 0.21 -1.05 1.21 -0.55 -1.33 0.00 0.00 177.39 175.88 1vve s SER 96 N 9.95 6.29 0.00 -1.43 0.15 0.15 -4.46 113.70 124.35 1vve s SER 96 Ca 1.18 -0.90 0.00 0.00 0.70 0.00 0.00 55.95 56.93 1vve s SER 96 Cb -0.81 -2.54 0.00 0.00 -1.71 0.00 0.00 66.02 60.96 1vve s SER 96 CO 0.41 -1.66 0.00 0.61 1.20 0.00 0.00 173.24 173.80 1vve n GLY 97 N 5.85 0.43 3.12 9.45 0.00 -1.26 -1.29 105.19 121.49 1vve n GLY 97 Ca 0.13 -0.41 -0.30 0.00 0.00 0.00 0.00 46.02 45.44 1vve n GLY 97 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1vve s SER 98 N -4.00 2.64 0.04 1.61 0.01 -1.21 -4.88 113.70 107.91 1vve s SER 98 Ca 0.00 -0.48 -0.17 0.00 1.31 0.00 0.00 55.95 56.61 1vve s SER 98 Cb 0.00 -1.20 -0.21 0.00 0.21 0.00 0.00 66.02 64.81 1vve s SER 98 CO 0.00 0.07 1.17 -1.28 0.41 0.00 0.00 173.24 173.61 1vve h SER 99 N 7.15 0.67 -2.92 2.44 0.87 -1.89 -2.85 113.55 117.00 1vve h SER 99 Ca -0.28 -0.71 -0.65 0.00 -1.23 0.00 0.00 61.79 58.91 1vve h SER 99 Cb 1.20 -0.20 -0.10 0.00 -0.44 0.00 0.00 62.40 62.85 1vve h SER 99 CO 0.50 1.28 -0.51 -0.94 -0.53 0.00 0.00 176.83 176.62 1vve s SER 100 N -6.86 6.09 0.03 6.23 1.04 -1.26 0.28 113.70 119.24 1vve s SER 100 Ca -0.12 0.34 -0.11 0.00 0.48 0.00 0.00 55.95 56.54 1vve s SER 100 Cb 0.05 -1.96 0.01 0.00 0.10 0.00 0.00 66.02 64.22 1vve s SER 100 CO 0.85 0.34 0.23 -0.44 0.98 0.00 0.00 173.24 175.20 1vve s SER 101 N -0.64 -0.04 0.04 7.02 0.01 -0.65 -4.37 113.70 115.07 1vve s SER 101 Ca 0.12 -0.23 0.05 0.00 1.31 0.00 0.00 55.95 57.20 1vve s SER 101 Cb -0.12 0.30 -0.02 0.00 0.21 0.00 0.00 66.02 66.39 1vve s SER 101 CO 0.02 -0.53 -0.15 -0.89 0.41 0.00 0.00 173.24 172.10 1vve s THR 102 N -2.21 1.19 -1.04 1.44 2.01 0.29 0.23 115.64 117.54 1vve s THR 102 Ca -0.08 -1.00 -0.24 0.00 0.31 0.00 0.00 61.69 60.68 1vve s THR 102 Cb -0.03 -1.07 -0.15 0.00 0.01 0.00 0.00 72.50 71.27 1vve s THR 102 CO -0.02 0.05 1.95 0.00 -0.69 0.00 0.00 174.62 175.92 1vve n SER 104 N 14.45 -2.61 -1.40 0.00 7.64 -1.11 0.40 113.62 131.00 1vve n SER 104 Ca 0.45 -0.20 -0.03 0.00 1.01 0.00 0.00 58.87 60.10 1vve n SER 104 Cb 0.46 -0.88 0.01 0.00 -1.01 0.00 0.00 64.21 62.79 1vve n SER 104 CO 0.00 0.00 0.00 -0.81 -3.01 0.00 0.00 175.04 171.22 1vve n PRO 105 N -1.78 1.14 0.00 1.43 -0.04 -1.26 -3.32 135.00 131.17 1vve n PRO 105 Ca 0.02 -0.29 0.00 0.00 -0.04 0.00 0.00 63.50 63.19 1vve n PRO 105 Cb 0.57 -1.11 0.00 0.00 -0.04 0.00 0.00 33.50 32.92 1vve n PRO 105 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1vve n GLY 106 N 0.93 0.42 1.87 0.55 0.00 -1.26 -4.75 105.19 102.95 1vve n GLY 106 Ca 0.06 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.04 1vve n GLY 106 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1vve n ASN 107 N -0.25 -2.98 -3.47 1.61 5.15 -1.21 -4.96 115.26 109.15 1vve n ASN 107 Ca 0.00 -0.15 -0.02 0.00 -0.60 0.00 0.00 54.58 53.81 1vve n ASN 107 Cb 0.31 -1.51 0.02 0.00 -0.53 0.00 0.00 39.78 38.06 1vve n ASN 107 CO 0.00 0.00 0.00 0.42 1.40 0.00 0.00 177.26 179.08 1vve s THR 108 N -3.08 0.00 -0.75 -0.44 -4.23 -1.21 -4.52 115.64 101.41 1vve s THR 108 Ca 0.10 -0.49 -0.06 0.00 -1.18 0.00 0.00 61.69 60.06 1vve s THR 108 Cb -0.01 -2.88 0.19 0.00 1.34 0.00 0.00 72.50 71.14 1vve s THR 108 CO 0.16 0.00 0.61 0.26 -0.54 0.00 0.00 174.62 175.11 1vve s TRP 109 N -2.15 3.62 0.02 3.99 0.23 -1.26 -2.74 118.94 120.66 1vve s TRP 109 Ca 0.23 -2.60 -0.02 0.00 -2.03 0.00 0.00 56.10 51.68 1vve s TRP 109 Cb -0.02 -3.39 -0.04 0.00 0.03 0.00 0.00 33.47 30.05 1vve s TRP 109 CO 0.04 -0.86 0.21 0.15 0.96 0.00 0.00 176.95 177.45 1vve s LYS 110 N -0.32 3.47 1.12 4.98 -0.14 -0.84 -3.65 119.74 124.36 1vve s LYS 110 Ca 0.20 -0.32 -0.17 0.00 -1.36 0.00 0.00 55.97 54.32 1vve s LYS 110 Cb -0.15 -3.06 0.25 0.00 -1.68 0.00 0.00 37.83 33.19 1vve s LYS 110 CO -0.07 0.64 1.13 -1.25 -0.76 0.00 0.00 175.35 175.04 1vve s PRO 111 N -2.15 -0.57 0.08 -1.68 0.04 -1.26 0.10 135.00 129.56 1vve s PRO 111 Ca 0.31 0.03 -0.30 0.00 0.04 0.00 0.00 61.00 61.08 1vve s PRO 111 Cb -0.13 -1.66 -0.16 0.00 0.04 0.00 0.00 34.50 32.59 1vve s PRO 111 CO 0.22 -3.30 0.71 -1.91 0.04 0.00 0.00 177.00 172.75 1vve n GLU 112 N -4.49 0.00 -1.72 4.56 2.13 -1.25 -4.80 120.64 115.07 1vve n GLU 112 Ca 0.11 0.00 -0.38 0.00 0.66 0.00 0.00 57.16 57.55 1vve n GLU 112 Cb 0.59 -1.09 0.06 0.00 0.27 0.00 0.00 31.44 31.26 1vve n GLU 112 CO 0.00 0.00 0.00 -0.11 -0.41 0.00 0.00 177.13 176.61 1vve n LEU 113 N 1.48 5.58 -4.81 4.31 7.94 -1.24 -3.35 117.00 126.91 1vve n LEU 113 Ca 0.16 0.89 -0.30 0.00 -1.11 0.00 0.00 56.01 55.66 1vve n LEU 113 Cb 0.13 -1.55 0.09 0.00 0.53 0.00 0.00 43.42 42.63 1vve n LEU 113 CO 0.50 -0.90 0.72 -2.16 -1.11 0.00 0.00 177.39 174.44 1vve s PRO 114 N -3.09 1.98 -0.29 1.96 0.04 -1.08 -4.33 135.00 130.20 1vve s PRO 114 Ca 0.77 0.56 0.01 0.00 0.04 0.00 0.00 61.00 62.38 1vve s PRO 114 Cb -0.40 -1.91 0.09 0.00 0.04 0.00 0.00 34.50 32.31 1vve s PRO 114 CO 0.45 -1.67 0.04 0.21 0.04 0.00 0.00 177.00 176.06 1vve s LYS 115 N -5.20 1.19 -0.83 4.56 2.20 -0.41 -4.32 119.74 116.93 1vve s LYS 115 Ca 0.61 -1.22 -0.22 0.00 -0.36 0.00 0.00 55.97 54.77 1vve s LYS 115 Cb -0.14 -2.50 -0.18 0.00 -1.51 0.00 0.00 37.83 33.50 1vve s LYS 115 CO 0.54 -0.84 2.36 0.00 -0.36 0.00 0.00 175.35 177.05 1vve n VAL 117 N 8.09 0.00 0.66 0.00 0.24 -0.88 -4.71 118.33 121.73 1vve n VAL 117 Ca 0.51 -0.67 0.08 0.00 -2.04 0.00 0.00 64.34 62.22 1vve n VAL 117 Cb 0.37 -0.43 0.07 0.00 -1.47 0.00 0.00 33.84 32.37 1vve n VAL 117 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23