#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 1.63 0.09 5.55 -2.85 -1.26 -4.99 119.74 117.91 1vve s LYS 2 Ca 0.00 -0.93 0.05 0.00 -1.00 0.00 0.00 55.97 54.09 1vve s LYS 2 Cb 0.00 0.53 -0.03 0.00 -2.06 0.00 0.00 37.83 36.27 1vve s LYS 2 CO 0.00 -0.75 -0.14 0.00 0.10 0.00 0.00 175.35 174.56 1vve s GLN 4 N -2.13 1.66 0.08 0.00 -0.21 -1.26 0.25 119.66 118.05 1vve s GLN 4 Ca 0.02 -1.96 -0.37 0.00 0.02 0.00 0.00 55.36 53.07 1vve s GLN 4 Cb -0.08 -0.26 -0.17 0.00 1.00 0.00 0.00 33.01 33.50 1vve s GLN 4 CO 0.02 -0.43 1.25 -1.13 -2.12 0.00 0.00 175.29 172.87 1vve n SER 5 N -0.98 1.19 -4.77 5.90 3.41 -1.24 -4.57 113.62 112.55 1vve n SER 5 Ca -0.00 1.13 -0.31 0.00 -0.26 0.00 0.00 58.87 59.42 1vve n SER 5 Cb 0.65 -1.13 0.08 0.00 -0.26 0.00 0.00 64.21 63.55 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 0.25 2.47 1.04 4.33 0.04 -1.26 -5.04 135.00 136.83 1vve s PRO 6 Ca 0.84 1.19 -0.16 0.00 0.04 0.00 0.00 61.00 62.92 1vve s PRO 6 Cb -1.01 -1.92 0.21 0.00 0.04 0.00 0.00 34.50 31.82 1vve s PRO 6 CO 0.50 -1.48 1.17 -1.25 0.04 0.00 0.00 177.00 175.98 1vve s PRO 7 N -4.73 0.05 -0.70 0.56 0.04 -1.26 -4.86 135.00 124.10 1vve s PRO 7 Ca 0.62 -0.02 -0.24 0.00 0.04 0.00 0.00 61.00 61.40 1vve s PRO 7 Cb -0.17 -1.74 0.06 0.00 0.04 0.00 0.00 34.50 32.69 1vve s PRO 7 CO 0.52 -2.87 1.07 -1.54 0.04 0.00 0.00 177.00 174.23 1vve s SER 8 N -4.18 6.20 0.53 6.66 1.04 -1.26 -4.70 113.70 118.00 1vve s SER 8 Ca 0.69 -0.91 -0.01 0.00 0.48 0.00 0.00 55.95 56.20 1vve s SER 8 Cb -0.10 -2.46 0.01 0.00 0.10 0.00 0.00 66.02 63.57 1vve s SER 8 CO 0.54 -1.53 0.03 2.30 0.98 0.00 0.00 173.24 175.56 1vve n ILE 9 N 6.05 0.00 -1.31 -1.02 -5.35 -1.21 -4.35 119.36 112.18 1vve n ILE 9 Ca 0.00 0.00 -0.29 0.00 -0.27 0.00 0.00 62.75 62.20 1vve n ILE 9 Cb 0.47 -0.03 -0.16 0.00 -1.74 0.00 0.00 39.64 38.17 1vve n ILE 9 CO 0.00 0.00 0.00 -1.54 -1.76 0.00 0.00 176.55 173.25 1vve n SER 10 N -1.50 -0.40 -2.44 7.28 3.41 -1.26 -0.45 113.62 118.26 1vve n SER 10 Ca 0.00 -0.11 -0.01 0.00 -0.26 0.00 0.00 58.87 58.49 1vve n SER 10 Cb 0.02 -0.66 -0.00 0.00 -0.26 0.00 0.00 64.21 63.31 1vve n SER 10 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1vve n ASN 11 N 7.34 -1.22 -4.70 4.04 4.13 -1.26 -4.44 115.26 119.14 1vve n ASN 11 Ca 0.58 0.46 -0.30 0.00 1.68 0.00 0.00 54.58 57.00 1vve n ASN 11 Cb 0.07 -1.18 -0.09 0.00 -1.54 0.00 0.00 39.78 37.03 1vve n ASN 11 CO 0.00 0.00 0.00 -0.83 0.28 0.00 0.00 177.26 176.71 1vve s GLY 12 N -1.97 2.75 0.00 7.41 0.00 0.40 -2.19 107.32 113.72 1vve s GLY 12 Ca 0.00 -1.33 0.00 0.00 0.00 0.00 0.00 44.72 43.39 1vve s GLY 12 CO 0.00 -2.13 0.00 0.54 0.00 0.00 0.00 173.10 171.51 1vve n ARG 13 N -1.15 1.98 -3.62 2.90 1.74 -0.18 -3.29 116.66 115.03 1vve n ARG 13 Ca -0.12 0.00 -0.02 0.00 -0.77 0.00 0.00 57.85 56.95 1vve n ARG 13 Cb 0.67 0.00 -0.05 0.00 -1.02 0.00 0.00 32.46 32.06 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 -0.10 -1.29 0.00 -1.55 -3.43 -1.26 0.56 115.29 108.22 1vve s HIS 14 Ca 0.00 2.20 0.00 0.00 -0.80 0.00 0.00 55.06 56.46 1vve s HIS 14 Cb 0.00 0.73 0.00 0.00 -1.43 0.00 0.00 32.58 31.88 1vve s HIS 14 CO 0.00 -0.66 0.00 0.09 -2.00 0.00 0.00 174.74 172.17 1vve n ASN 15 N 5.44 0.71 0.00 7.38 3.02 -1.17 -4.92 115.26 125.73 1vve n ASN 15 Ca -0.11 -0.28 0.00 0.00 -0.03 0.00 0.00 54.58 54.16 1vve n ASN 15 Cb 0.49 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.66 1vve n ASN 15 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1vve n GLY 16 N 5.00 0.67 2.84 7.41 0.00 -1.26 -4.22 105.19 115.63 1vve n GLY 16 Ca 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.82 1vve n GLY 16 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 1vve n TYR 17 N 0.00 -1.71 -2.54 1.61 9.36 -1.26 -4.98 117.16 117.64 1vve n TYR 17 Ca 0.00 0.44 0.00 0.00 3.32 0.00 0.00 57.90 61.66 1vve n TYR 17 Cb 0.00 -4.13 0.00 0.00 -0.63 0.00 0.00 39.34 34.58 1vve n TYR 17 CO 0.00 0.00 0.00 0.39 0.22 0.00 0.00 176.86 177.47 1vve n GLU 18 N -3.63 3.71 0.00 2.98 -0.58 -1.26 -5.10 120.64 116.76 1vve n GLU 18 Ca -0.11 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.63 1vve n GLU 18 Cb 0.61 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 31.48 1vve n GLU 18 CO 0.00 0.00 0.00 -3.47 -0.48 0.00 0.00 177.13 173.18 1vve n ASP 19 N 0.00 0.00 -3.28 1.62 2.03 -1.26 -5.00 116.55 110.66 1vve n ASP 19 Ca 0.00 0.00 -0.23 0.00 0.52 0.00 0.00 54.79 55.08 1vve n ASP 19 Cb 0.00 0.00 -0.08 0.00 -0.72 0.00 0.00 41.12 40.32 1vve n ASP 19 CO 0.00 0.00 0.00 0.72 -1.92 0.00 0.00 177.20 176.00 1vve s PHE 20 N -1.00 0.60 0.90 -0.67 -0.71 -1.26 -3.70 117.98 112.15 1vve s PHE 20 Ca 0.00 -2.01 -0.11 0.00 -1.04 0.00 0.00 56.93 53.77 1vve s PHE 20 Cb 0.00 -0.70 0.17 0.00 -1.21 0.00 0.00 43.02 41.29 1vve s PHE 20 CO 0.00 -0.91 0.39 0.66 -1.34 0.00 0.00 175.22 174.02 1vve n TYR 21 N 2.88 -2.39 0.02 3.49 4.01 0.71 -4.54 117.16 121.34 1vve n TYR 21 Ca 0.28 -0.05 0.00 0.00 -0.16 0.00 0.00 57.90 57.96 1vve n TYR 21 Cb 0.49 -1.21 0.00 0.00 -0.31 0.00 0.00 39.34 38.31 1vve n TYR 21 CO 0.00 0.00 0.00 2.41 -0.46 0.00 0.00 176.86 178.81 1vve n THR 22 N -4.24 0.00 -3.66 -0.72 -1.04 -1.26 0.37 114.28 103.73 1vve n THR 22 Ca 0.06 0.00 -0.14 0.00 -2.04 0.00 0.00 64.05 61.93 1vve n THR 22 Cb 0.27 -0.06 -0.08 0.00 -1.82 0.00 0.00 70.33 68.64 1vve n THR 22 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 1vve s ASP 23 N -3.75 -0.62 0.00 8.00 2.15 -1.25 -3.64 116.67 117.56 1vve s ASP 23 Ca 0.00 1.12 0.00 0.00 0.43 0.00 0.00 52.55 54.10 1vve s ASP 23 Cb 0.00 1.13 0.00 0.00 -0.30 0.00 0.00 42.92 43.75 1vve s ASP 23 CO 0.00 -0.26 0.00 0.61 -0.17 0.00 0.00 175.17 175.35 1vve n GLY 24 N 2.50 0.28 3.67 2.66 0.00 0.47 -4.92 105.19 109.85 1vve n GLY 24 Ca -0.15 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.58 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 -2.09 1.82 0.10 1.61 0.01 -0.82 -4.74 113.70 109.59 1vve s SER 25 Ca 0.00 0.77 -0.21 0.00 1.31 0.00 0.00 55.95 57.82 1vve s SER 25 Cb 0.00 -1.14 0.05 0.00 0.21 0.00 0.00 66.02 65.14 1vve s SER 25 CO 0.00 -3.58 0.51 -0.69 0.41 0.00 0.00 173.24 169.89 1vve s VAL 26 N -3.11 0.03 -0.10 3.43 1.01 -1.26 -0.93 120.40 119.48 1vve s VAL 26 Ca 0.69 -0.26 -0.04 0.00 0.00 0.00 0.00 61.98 62.37 1vve s VAL 26 Cb -0.12 -1.04 0.05 0.00 0.00 0.00 0.00 36.38 35.28 1vve s VAL 26 CO 0.56 -0.14 0.20 -0.69 0.00 0.00 0.00 175.10 175.02 1vve s VAL 27 N -3.18 -0.28 -0.60 2.92 1.01 -0.97 -4.84 120.40 114.47 1vve s VAL 27 Ca -0.01 0.31 -0.27 0.00 0.00 0.00 0.00 61.98 62.01 1vve s VAL 27 Cb -0.00 -0.34 -0.01 0.00 0.00 0.00 0.00 36.38 36.03 1vve s VAL 27 CO -0.08 0.13 1.68 -0.89 0.00 0.00 0.00 175.10 175.94 1vve s THR 28 N 2.20 3.50 0.68 3.92 2.01 -1.26 -0.57 115.64 126.13 1vve s THR 28 Ca 0.01 0.35 -0.15 0.00 0.31 0.00 0.00 61.69 62.21 1vve s THR 28 Cb -0.12 -4.16 0.01 0.00 0.01 0.00 0.00 72.50 68.24 1vve s THR 28 CO -0.07 -1.06 1.13 -0.31 -0.69 0.00 0.00 174.62 173.62 1vve s TYR 29 N 7.79 2.48 0.39 4.92 2.02 -1.26 -3.03 117.35 130.65 1vve s TYR 29 Ca 0.60 1.57 0.02 0.00 -0.37 0.00 0.00 57.07 58.89 1vve s TYR 29 Cb -0.12 -3.24 0.02 0.00 -0.40 0.00 0.00 41.96 38.22 1vve s TYR 29 CO 0.22 -1.91 0.17 0.45 -1.57 0.00 0.00 175.55 172.91 1vve n SER 30 N -2.52 2.63 -3.82 2.29 2.88 0.19 -4.85 113.62 110.42 1vve n SER 30 Ca 0.11 -2.51 -0.12 0.00 -1.33 0.00 0.00 58.87 55.02 1vve n SER 30 Cb 0.52 0.10 -0.09 0.00 -0.75 0.00 0.00 64.21 63.98 1vve n SER 30 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1vve n ASN 32 N 1.38 -0.12 -4.51 0.00 2.85 -0.93 -4.72 115.26 109.21 1vve n ASN 32 Ca -0.22 0.77 -0.46 0.00 -0.11 0.00 0.00 54.58 54.56 1vve n ASN 32 Cb 0.56 -1.29 -0.06 0.00 1.24 0.00 0.00 39.78 40.23 1vve n ASN 32 CO 0.00 0.00 0.00 -1.20 -2.11 0.00 0.00 177.26 173.95 1vve n SER 33 N -0.20 2.39 0.00 1.20 7.64 -1.26 -1.14 113.62 122.24 1vve n SER 33 Ca 0.13 0.20 0.00 0.00 1.01 0.00 0.00 58.87 60.21 1vve n SER 33 Cb 0.48 -1.38 0.00 0.00 -1.01 0.00 0.00 64.21 62.30 1vve n SER 33 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1vve n GLY 34 N 6.24 1.45 3.03 0.23 0.00 -1.26 -5.11 105.19 109.78 1vve n GLY 34 Ca 0.39 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 46.11 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 -2.00 2.19 0.25 1.61 2.02 -0.30 -4.66 117.35 116.46 1vve s TYR 35 Ca 0.00 -1.21 -0.30 0.00 -0.37 0.00 0.00 57.07 55.20 1vve s TYR 35 Cb 0.00 -1.60 -0.09 0.00 -0.40 0.00 0.00 41.96 39.87 1vve s TYR 35 CO 0.00 -0.65 1.15 0.45 -1.57 0.00 0.00 175.55 174.93 1vve s SER 36 N 1.39 7.16 -0.68 2.29 0.15 0.72 -4.67 113.70 120.06 1vve s SER 36 Ca 0.03 2.30 -0.21 0.00 0.70 0.00 0.00 55.95 58.77 1vve s SER 36 Cb -0.13 -2.62 0.09 0.00 -1.71 0.00 0.00 66.02 61.65 1vve s SER 36 CO -0.09 -0.26 0.91 -0.22 1.20 0.00 0.00 173.24 174.77 1vve s LEU 37 N -1.04 4.81 0.58 3.45 2.96 -1.24 -1.14 118.68 127.05 1vve s LEU 37 Ca 0.48 -1.28 0.00 0.00 -0.22 0.00 0.00 54.13 53.10 1vve s LEU 37 Cb -0.33 -2.38 0.04 0.00 0.50 0.00 0.00 46.19 44.03 1vve s LEU 37 CO 0.41 -1.29 0.82 -0.63 -1.32 0.00 0.00 176.35 174.34 1vve s ILE 38 N 3.42 2.58 0.00 6.68 -1.09 0.49 -4.76 121.20 128.52 1vve s ILE 38 Ca 0.20 -0.60 0.00 0.00 -2.23 0.00 0.00 60.65 58.02 1vve s ILE 38 Cb -0.17 -2.98 0.00 0.00 -1.58 0.00 0.00 42.46 37.73 1vve s ILE 38 CO 0.06 0.00 0.00 0.61 -1.23 0.00 0.00 174.94 174.38 1vve n GLY 39 N -2.45 -2.61 3.67 6.18 0.00 -1.26 0.24 105.19 108.94 1vve n GLY 39 Ca 0.08 -1.64 -0.42 0.00 0.00 0.00 0.00 46.02 44.04 1vve n GLY 39 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1vve s ASN 40 N -1.89 6.61 -0.36 1.61 0.01 -1.26 -4.78 114.94 114.88 1vve s ASN 40 Ca 0.00 2.39 -0.05 0.00 -0.71 0.00 0.00 52.86 54.49 1vve s ASN 40 Cb 0.00 -2.54 -0.14 0.00 0.41 0.00 0.00 41.25 38.98 1vve s ASN 40 CO 0.00 -0.93 2.46 -0.24 -1.51 0.00 0.00 177.10 176.88 1vve n SER 41 N 6.69 4.23 0.00 -1.22 2.88 -1.26 -3.62 113.62 121.32 1vve n SER 41 Ca 0.17 -2.22 0.00 0.00 -1.33 0.00 0.00 58.87 55.49 1vve n SER 41 Cb 0.42 -1.02 0.00 0.00 -0.75 0.00 0.00 64.21 62.86 1vve n SER 41 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1vve n GLY 42 N 3.03 -1.57 3.04 0.46 0.00 -1.24 -4.17 105.19 104.75 1vve n GLY 42 Ca 0.36 0.95 -0.27 0.00 0.00 0.00 0.00 46.02 47.06 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 -3.59 1.61 0.31 0.27 -4.29 118.33 112.64 1vve n VAL 43 Ca 0.00 -0.09 -0.27 0.00 -0.01 0.00 0.00 64.34 63.97 1vve n VAL 43 Cb 0.00 -0.27 -0.16 0.00 -0.91 0.00 0.00 33.84 32.50 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 3.84 0.47 -0.54 7.52 2.96 -0.86 -2.28 118.68 129.80 1vve s LEU 44 Ca 0.36 -0.88 -0.27 0.00 -0.22 0.00 0.00 54.13 53.11 1vve s LEU 44 Cb -0.00 -0.30 0.03 0.00 0.50 0.00 0.00 46.19 46.42 1vve s LEU 44 CO 0.50 -0.38 1.11 0.00 -1.32 0.00 0.00 176.35 176.25 1vve s SER 46 N 2.73 2.15 0.00 0.00 1.04 -0.52 0.18 113.70 119.28 1vve s SER 46 Ca 0.42 -0.31 0.00 0.00 0.48 0.00 0.00 55.95 56.53 1vve s SER 46 Cb -0.08 -0.86 0.00 0.00 0.10 0.00 0.00 66.02 65.18 1vve s SER 46 CO 0.26 -0.10 0.00 0.61 0.98 0.00 0.00 173.24 175.00 1vve n GLY 47 N 4.78 1.63 0.00 7.32 0.00 -1.26 -3.53 105.19 114.13 1vve n GLY 47 Ca -0.14 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.88 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 -2.00 1.52 3.03 -0.02 0.00 -1.26 -4.70 105.19 101.76 1vve n GLY 48 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.89 1vve n GLY 48 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1vve s GLU 49 N -0.13 0.19 0.17 1.61 2.02 -1.23 -4.84 118.70 116.48 1vve s GLU 49 Ca 0.00 0.27 -0.30 0.00 0.02 0.00 0.00 54.97 54.96 1vve s GLU 49 Cb 0.00 0.05 -0.07 0.00 0.10 0.00 0.00 34.13 34.21 1vve s GLU 49 CO 0.00 -0.05 1.02 -1.58 0.02 0.00 0.00 175.26 174.67 1vve s TRP 50 N 0.29 3.75 0.20 1.61 0.52 -1.26 -1.43 118.94 122.61 1vve s TRP 50 Ca -0.02 1.74 0.03 0.00 0.02 0.00 0.00 56.10 57.87 1vve s TRP 50 Cb -0.03 -3.14 -0.05 0.00 -1.15 0.00 0.00 33.47 29.10 1vve s TRP 50 CO -0.01 -0.11 -0.03 0.45 0.02 0.00 0.00 176.95 177.27 1vve s SER 51 N -0.31 1.68 -0.89 2.95 0.15 -0.26 -4.88 113.70 112.13 1vve s SER 51 Ca 0.47 -1.16 -0.06 0.00 0.70 0.00 0.00 55.95 55.90 1vve s SER 51 Cb -0.27 0.03 -0.01 0.00 -1.71 0.00 0.00 66.02 64.07 1vve s SER 51 CO 0.33 -0.48 0.71 0.47 1.20 0.00 0.00 173.24 175.47 1vve n ASP 52 N -0.32 -6.15 -4.80 5.45 8.00 -1.26 -2.02 116.55 115.45 1vve n ASP 52 Ca -0.07 -0.65 -0.38 0.00 0.71 0.00 0.00 54.79 54.40 1vve n ASP 52 Cb 0.63 -3.64 -0.06 0.00 -0.02 0.00 0.00 41.12 38.03 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 -4.51 4.17 1.07 -0.24 0.04 -1.26 -4.35 135.00 129.91 1vve s PRO 53 Ca 0.16 0.63 -0.17 0.00 0.04 0.00 0.00 61.00 61.65 1vve s PRO 53 Cb -0.05 -3.28 0.24 0.00 0.04 0.00 0.00 34.50 31.45 1vve s PRO 53 CO 0.83 0.54 1.23 -1.25 0.04 0.00 0.00 177.00 178.40 1vve s PRO 54 N -0.73 -0.17 0.08 0.56 0.04 -1.24 -4.71 135.00 128.84 1vve s PRO 54 Ca 0.28 -0.27 0.09 0.00 0.04 0.00 0.00 61.00 61.14 1vve s PRO 54 Cb -0.18 -1.74 -0.03 0.00 0.04 0.00 0.00 34.50 32.59 1vve s PRO 54 CO 0.16 -2.98 -0.24 0.95 0.04 0.00 0.00 177.00 174.93 1vve s THR 55 N -3.52 2.37 -0.89 1.26 -4.23 0.64 -4.87 115.64 106.41 1vve s THR 55 Ca 0.73 -1.49 -0.01 0.00 -1.18 0.00 0.00 61.69 59.74 1vve s THR 55 Cb -0.06 -2.00 0.25 0.00 1.34 0.00 0.00 72.50 72.02 1vve s THR 55 CO 0.54 0.24 0.92 0.00 -0.54 0.00 0.00 174.62 175.78 1vve s GLN 57 N -1.89 2.23 -0.05 0.00 -2.07 -0.29 -4.70 119.66 112.88 1vve s GLN 57 Ca 0.31 -2.23 -0.18 0.00 -1.82 0.00 0.00 55.36 51.45 1vve s GLN 57 Cb -0.00 -1.80 -0.05 0.00 -1.09 0.00 0.00 33.01 30.06 1vve s GLN 57 CO -0.06 -0.50 0.49 0.42 -1.32 0.00 0.00 175.29 174.33 1vve s ILE 58 N -2.83 5.05 -0.35 3.63 1.09 -1.26 0.26 121.20 126.78 1vve s ILE 58 Ca 0.19 1.01 0.06 0.00 -1.10 0.00 0.00 60.65 60.81 1vve s ILE 58 Cb -0.00 -3.82 0.45 0.00 -1.06 0.00 0.00 42.46 38.02 1vve s ILE 58 CO 0.11 0.43 1.17 1.33 -0.10 0.00 0.00 174.94 177.89 1vve n VAL 59 N 2.82 2.48 -2.55 2.92 0.24 -1.26 -3.61 118.33 119.37 1vve n VAL 59 Ca -0.09 -4.47 -0.41 0.00 -2.04 0.00 0.00 64.34 57.33 1vve n VAL 59 Cb 0.52 -1.19 -0.03 0.00 -1.47 0.00 0.00 33.84 31.67 1vve n VAL 59 CO 0.00 0.00 0.00 -0.54 -2.14 0.00 0.00 176.83 174.15 1vve s LYS 60 N -3.58 3.28 0.83 7.34 1.02 -1.26 -1.54 119.74 125.83 1vve s LYS 60 Ca 0.50 -0.45 -0.11 0.00 0.02 0.00 0.00 55.97 55.93 1vve s LYS 60 Cb 0.41 -4.46 0.09 0.00 -0.52 0.00 0.00 37.83 33.35 1vve s LYS 60 CO -0.04 -2.16 1.09 0.00 -0.92 0.00 0.00 175.35 173.32 1vve n PRO 62 N -3.71 0.00 -3.66 0.00 -0.04 -1.26 -4.27 135.00 122.05 1vve n PRO 62 Ca 0.08 0.00 -0.09 0.00 -0.04 0.00 0.00 63.50 63.46 1vve n PRO 62 Cb 0.54 -0.17 -0.08 0.00 -0.04 0.00 0.00 33.50 33.75 1vve n PRO 62 CO 0.00 0.00 0.00 -1.01 -0.04 0.00 0.00 175.50 174.45 1vve s HIS 63 N 0.00 -0.89 -1.29 0.54 3.76 -1.26 -4.80 115.29 111.34 1vve s HIS 63 Ca 0.00 1.85 -0.14 0.00 -0.15 0.00 0.00 55.06 56.63 1vve s HIS 63 Cb 0.00 0.48 -0.04 0.00 1.11 0.00 0.00 32.58 34.13 1vve s HIS 63 CO 0.00 -0.45 2.34 -0.35 -0.85 0.00 0.00 174.74 175.42 1vve n PRO 64 N 4.06 2.69 -1.31 8.40 -0.04 -1.26 -4.90 135.00 142.63 1vve n PRO 64 Ca -0.20 -2.19 -0.12 0.00 -0.04 0.00 0.00 63.50 60.95 1vve n PRO 64 Cb 0.58 -2.98 0.07 0.00 -0.04 0.00 0.00 33.50 31.13 1vve n PRO 64 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 1vve n THR 65 N 4.78 0.00 0.00 0.52 -2.24 -1.26 -4.47 114.28 111.61 1vve n THR 65 Ca 0.57 -0.65 0.00 0.00 -2.27 0.00 0.00 64.05 61.70 1vve n THR 65 Cb 0.32 -1.37 0.00 0.00 -2.10 0.00 0.00 70.33 67.17 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 -2.38 0.00 -2.04 2.28 3.06 -1.26 -4.72 119.36 114.30 1vve n ILE 66 Ca 0.08 0.00 -0.34 0.00 -2.50 0.00 0.00 62.75 59.99 1vve n ILE 66 Cb 0.28 0.00 -0.04 0.00 0.54 0.00 0.00 39.64 40.42 1vve n ILE 66 CO 0.00 0.00 0.00 -0.55 -2.50 0.00 0.00 176.55 173.50 1vve s SER 67 N 0.00 5.22 -1.65 9.51 0.15 -1.26 -3.74 113.70 121.94 1vve s SER 67 Ca 0.00 -0.07 -0.17 0.00 0.70 0.00 0.00 55.95 56.42 1vve s SER 67 Cb 0.00 -2.54 0.13 0.00 -1.71 0.00 0.00 66.02 61.90 1vve s SER 67 CO 0.00 -2.52 0.84 0.59 1.20 0.00 0.00 173.24 173.34 1vve n ASN 68 N 13.24 -3.66 -1.22 5.45 3.02 -1.26 -2.73 115.26 128.10 1vve n ASN 68 Ca 0.28 -0.94 0.00 0.00 -0.03 0.00 0.00 54.58 53.89 1vve n ASN 68 Cb 0.50 -3.10 -0.01 0.00 -0.61 0.00 0.00 39.78 36.56 1vve n ASN 68 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1vve n GLY 69 N -1.50 0.82 1.57 7.41 0.00 -1.25 0.76 105.19 113.00 1vve n GLY 69 Ca 0.05 -0.50 -0.04 0.00 0.00 0.00 0.00 46.02 45.53 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 0.29 -1.29 -4.19 1.61 4.11 -1.26 -3.27 117.16 113.16 1vve n TYR 70 Ca -0.04 0.16 -0.23 0.00 -0.00 0.00 0.00 57.90 57.79 1vve n TYR 70 Cb 0.96 -0.74 -0.06 0.00 -0.00 0.00 0.00 39.34 39.49 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 3.30 0.00 -3.48 -0.00 -1.25 0.32 118.68 117.57 1vve s LEU 71 Ca 0.10 -0.65 0.05 0.00 -0.00 0.00 0.00 54.13 53.63 1vve s LEU 71 Cb -0.02 -1.81 0.09 0.00 -0.00 0.00 0.00 46.19 44.46 1vve s LEU 71 CO 0.08 -0.13 0.95 -0.24 -0.00 0.00 0.00 176.35 177.01 1vve n SER 72 N -1.04 0.15 0.00 1.48 2.88 -0.79 -4.73 113.62 111.56 1vve n SER 72 Ca -0.05 -1.83 0.00 0.00 -1.33 0.00 0.00 58.87 55.66 1vve n SER 72 Cb 0.60 -0.16 0.00 0.00 -0.75 0.00 0.00 64.21 63.90 1vve n SER 72 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 1vve n SER 73 N 0.11 0.00 -3.56 -3.46 2.88 -1.26 -4.93 113.62 103.40 1vve n SER 73 Ca -0.01 0.00 -0.27 0.00 -1.33 0.00 0.00 58.87 57.27 1vve n SER 73 Cb 0.76 0.00 -0.10 0.00 -0.75 0.00 0.00 64.21 64.12 1vve n SER 73 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1vve n GLY 74 N 2.63 3.64 3.94 0.46 0.00 -1.26 -5.01 105.19 109.59 1vve n GLY 74 Ca 0.00 -2.20 -0.25 0.00 0.00 0.00 0.00 46.02 43.57 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 -1.36 3.49 0.21 1.61 2.19 -1.26 -4.68 117.98 118.17 1vve s PHE 75 Ca 0.32 0.31 -0.09 0.00 0.33 0.00 0.00 56.93 57.80 1vve s PHE 75 Cb 0.06 -1.84 -0.01 0.00 -1.31 0.00 0.00 43.02 39.91 1vve s PHE 75 CO -0.13 0.26 0.33 0.21 1.83 0.00 0.00 175.22 177.72 1vve s LYS 76 N -3.91 1.34 0.13 10.12 2.20 -1.26 -5.05 119.74 123.30 1vve s LYS 76 Ca 0.39 -1.32 -0.04 0.00 -0.36 0.00 0.00 55.97 54.64 1vve s LYS 76 Cb -0.10 0.39 -0.11 0.00 -1.51 0.00 0.00 37.83 36.50 1vve s LYS 76 CO 0.32 -0.51 1.29 0.00 -0.36 0.00 0.00 175.35 176.09 1vve h ARG 77 N 2.44 0.39 -5.08 4.03 3.08 -1.99 -3.44 114.38 113.80 1vve h ARG 77 Ca -0.30 -0.43 -0.59 0.00 0.07 0.00 0.00 59.98 58.73 1vve h ARG 77 Cb 1.24 0.13 -0.33 0.00 0.08 0.00 0.00 29.97 31.09 1vve h ARG 77 CO 0.44 1.11 -0.84 -1.54 -1.07 0.00 0.00 179.97 178.06 1vve s SER 78 N -7.08 2.34 0.42 7.04 1.04 -1.26 -5.00 113.70 111.20 1vve s SER 78 Ca -0.05 -0.40 0.07 0.00 0.48 0.00 0.00 55.95 56.04 1vve s SER 78 Cb 0.09 -0.93 -0.04 0.00 0.10 0.00 0.00 66.02 65.23 1vve s SER 78 CO 0.87 0.12 0.23 -0.31 0.98 0.00 0.00 173.24 175.12 1vve s TYR 79 N 0.34 2.54 -0.37 5.02 2.02 -1.26 -5.02 117.35 120.62 1vve s TYR 79 Ca -0.12 -0.60 0.02 0.00 -0.37 0.00 0.00 57.07 56.00 1vve s TYR 79 Cb -0.15 -1.99 0.18 0.00 -0.40 0.00 0.00 41.96 39.60 1vve s TYR 79 CO 0.05 0.09 0.77 -1.54 -1.57 0.00 0.00 175.55 173.34 1vve s SER 80 N -3.97 -1.13 0.34 2.29 1.04 -1.22 -3.54 113.70 107.50 1vve s SER 80 Ca 0.41 -0.49 0.00 0.00 0.48 0.00 0.00 55.95 56.35 1vve s SER 80 Cb 0.02 1.48 0.00 0.00 0.10 0.00 0.00 66.02 67.62 1vve s SER 80 CO 0.23 -0.14 0.00 0.00 0.98 0.00 0.00 173.24 174.31 1vve n TYR 81 N 4.31 -3.03 0.00 5.02 9.36 -0.59 -4.68 117.16 127.55 1vve n TYR 81 Ca 0.09 1.61 0.00 0.00 3.32 0.00 0.00 57.90 62.91 1vve n TYR 81 Cb 0.59 -2.54 0.00 0.00 -0.63 0.00 0.00 39.34 36.76 1vve n TYR 81 CO 0.00 0.00 0.00 -1.71 0.22 0.00 0.00 176.86 175.37 1vve n ASN 82 N -0.69 0.00 -3.27 2.98 2.85 0.80 -4.76 115.26 113.17 1vve n ASN 82 Ca 0.00 0.00 -0.14 0.00 -0.11 0.00 0.00 54.58 54.33 1vve n ASN 82 Cb 0.00 0.00 0.01 0.00 1.24 0.00 0.00 39.78 41.03 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 6.25 -6.72 -4.78 1.20 9.92 -1.26 0.27 116.55 121.44 1vve n ASP 83 Ca 0.00 -0.17 -0.37 0.00 -0.53 0.00 0.00 54.79 53.72 1vve n ASP 83 Cb 0.00 -3.82 -0.02 0.00 -0.64 0.00 0.00 41.12 36.64 1vve n ASP 83 CO 0.00 0.00 0.00 0.21 0.13 0.00 0.00 177.20 177.54 1vve s ASN 84 N -2.66 6.42 -0.08 -2.24 2.47 -1.26 -1.79 114.94 115.81 1vve s ASN 84 Ca 0.12 2.17 0.00 0.00 0.42 0.00 0.00 52.86 55.58 1vve s ASN 84 Cb -0.02 -2.59 0.02 0.00 -1.45 0.00 0.00 41.25 37.21 1vve s ASN 84 CO 0.81 -0.73 -0.06 0.68 -3.72 0.00 0.00 177.10 174.08 1vve s VAL 85 N -1.62 0.75 -0.15 -5.21 -7.23 0.22 -4.52 120.40 102.64 1vve s VAL 85 Ca 0.61 -0.18 -0.26 0.00 -1.81 0.00 0.00 61.98 60.35 1vve s VAL 85 Cb -0.25 -0.79 -0.02 0.00 0.56 0.00 0.00 36.38 35.88 1vve s VAL 85 CO 0.31 0.30 0.85 -0.62 -0.31 0.00 0.00 175.10 175.63 1vve s ASP 86 N 1.38 7.00 -0.24 4.85 2.15 -1.26 -0.24 116.67 130.32 1vve s ASP 86 Ca -0.03 1.23 -0.23 0.00 0.43 0.00 0.00 52.55 53.96 1vve s ASP 86 Cb -0.13 -2.47 -0.01 0.00 -0.30 0.00 0.00 42.92 40.00 1vve s ASP 86 CO -0.03 -0.39 0.73 -0.36 -0.17 0.00 0.00 175.17 174.95 1vve s PHE 87 N 2.06 3.32 -0.73 -5.34 0.40 -0.96 -1.89 117.98 114.84 1vve s PHE 87 Ca 0.40 1.00 -0.17 0.00 -0.60 0.00 0.00 56.93 57.56 1vve s PHE 87 Cb -0.17 -2.94 0.15 0.00 0.51 0.00 0.00 43.02 40.57 1vve s PHE 87 CO 0.13 -0.34 0.79 0.21 0.70 0.00 0.00 175.22 176.72 1vve s LYS 88 N 2.56 3.32 -0.15 0.44 2.20 0.97 -4.81 119.74 124.27 1vve s LYS 88 Ca 0.31 -1.80 -0.41 0.00 -0.36 0.00 0.00 55.97 53.72 1vve s LYS 88 Cb -0.15 -4.45 -0.18 0.00 -1.51 0.00 0.00 37.83 31.53 1vve s LYS 88 CO 0.08 -1.49 1.43 0.00 -0.36 0.00 0.00 175.35 175.01 1vve n LYS 90 N 3.31 -0.09 -3.63 0.00 4.76 0.23 -4.78 118.16 117.96 1vve n LYS 90 Ca 0.24 0.90 -0.06 0.00 -2.87 0.00 0.00 58.31 56.51 1vve n LYS 90 Cb 0.09 -1.34 -0.06 0.00 -1.84 0.00 0.00 35.03 31.88 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 -3.64 -0.24 -1.53 2.13 5.04 -1.26 -4.97 117.35 112.88 1vve s TYR 91 Ca -0.03 0.51 -0.05 0.00 -2.44 0.00 0.00 57.07 55.06 1vve s TYR 91 Cb 0.02 0.45 0.05 0.00 0.35 0.00 0.00 41.96 42.83 1vve s TYR 91 CO 0.13 -0.15 0.40 0.41 -1.34 0.00 0.00 175.55 175.00 1vve n GLY 92 N 1.35 -0.25 3.25 8.97 0.00 -1.26 -4.93 105.19 112.32 1vve n GLY 92 Ca -0.09 0.15 -0.12 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 -3.89 -0.12 -0.13 1.61 2.02 -1.26 -4.75 117.35 110.83 1vve s TYR 93 Ca 0.20 0.03 -0.00 0.00 -0.37 0.00 0.00 57.07 56.93 1vve s TYR 93 Cb -0.11 0.09 -0.02 0.00 -0.40 0.00 0.00 41.96 41.53 1vve s TYR 93 CO 0.93 -0.48 -0.13 -1.59 -1.57 0.00 0.00 175.55 172.71 1vve s LYS 94 N -2.30 3.38 -0.77 -0.62 -2.85 0.45 -4.80 119.74 112.23 1vve s LYS 94 Ca -0.07 -0.68 -0.25 0.00 -1.00 0.00 0.00 55.97 53.97 1vve s LYS 94 Cb -0.02 -2.63 -0.06 0.00 -2.06 0.00 0.00 37.83 33.06 1vve s LYS 94 CO -0.02 0.22 2.08 -0.51 0.10 0.00 0.00 175.35 177.22 1vve s LEU 95 N 0.33 3.15 -0.57 2.77 1.43 -1.25 -0.75 118.68 123.79 1vve s LEU 95 Ca -0.11 -0.12 -0.28 0.00 -1.03 0.00 0.00 54.13 52.60 1vve s LEU 95 Cb -0.16 -2.54 0.01 0.00 0.03 0.00 0.00 46.19 43.52 1vve s LEU 95 CO 0.06 -2.93 1.53 -0.55 0.23 0.00 0.00 176.35 174.68 1vve s SER 96 N 9.11 5.93 0.00 2.29 0.15 0.25 -4.03 113.70 127.40 1vve s SER 96 Ca 0.77 0.30 0.00 0.00 0.70 0.00 0.00 55.95 57.73 1vve s SER 96 Cb -0.10 -2.54 0.00 0.00 -1.71 0.00 0.00 66.02 61.66 1vve s SER 96 CO 0.09 -1.87 0.00 0.61 1.20 0.00 0.00 173.24 173.27 1vve n GLY 97 N 5.38 1.39 3.26 9.45 0.00 -1.26 -1.50 105.19 121.91 1vve n GLY 97 Ca 0.14 -0.30 0.03 0.00 0.00 0.00 0.00 46.02 45.89 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 -3.10 -0.47 0.00 1.61 0.01 -1.26 -4.92 113.70 105.58 1vve s SER 98 Ca 0.00 0.49 0.00 0.00 1.31 0.00 0.00 55.95 57.75 1vve s SER 98 Cb 0.00 1.47 0.00 0.00 0.21 0.00 0.00 66.02 67.70 1vve s SER 98 CO 0.00 -0.09 0.39 -1.54 0.41 0.00 0.00 173.24 172.41 1vve n SER 99 N 5.10 0.00 -4.57 2.44 3.41 -1.26 -3.07 113.62 115.66 1vve n SER 99 Ca -0.08 0.44 -0.41 0.00 -0.26 0.00 0.00 58.87 58.57 1vve n SER 99 Cb 0.53 -0.14 -0.03 0.00 -0.26 0.00 0.00 64.21 64.32 1vve n SER 99 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1vve s SER 100 N -1.83 5.57 0.04 4.04 1.04 -1.26 -2.26 113.70 119.04 1vve s SER 100 Ca 0.00 0.83 0.00 0.00 0.48 0.00 0.00 55.95 57.27 1vve s SER 100 Cb 0.00 -2.53 0.00 0.00 0.10 0.00 0.00 66.02 63.60 1vve s SER 100 CO 0.00 -2.05 0.04 -1.20 0.98 0.00 0.00 173.24 171.01 1vve n SER 101 N 11.57 0.89 -3.63 7.02 7.64 0.67 -4.72 113.62 133.05 1vve n SER 101 Ca 0.22 -1.14 -0.12 0.00 1.01 0.00 0.00 58.87 58.84 1vve n SER 101 Cb 0.50 -0.01 -0.07 0.00 -1.01 0.00 0.00 64.21 63.62 1vve n SER 101 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 1vve s THR 102 N 0.03 0.00 -0.35 0.44 2.01 0.12 0.69 115.64 118.57 1vve s THR 102 Ca 0.03 0.00 -0.27 0.00 0.31 0.00 0.00 61.69 61.76 1vve s THR 102 Cb -0.00 -1.00 -0.06 0.00 0.01 0.00 0.00 72.50 71.45 1vve s THR 102 CO 0.02 0.00 2.31 0.00 -0.69 0.00 0.00 174.62 176.26 1vve s SER 104 N 10.03 5.25 -0.03 0.00 0.15 -1.13 0.28 113.70 128.25 1vve s SER 104 Ca 1.00 0.35 -0.30 0.00 0.70 0.00 0.00 55.95 57.70 1vve s SER 104 Cb -0.29 -1.22 -0.03 0.00 -1.71 0.00 0.00 66.02 62.77 1vve s SER 104 CO 0.32 -1.23 1.15 -2.16 1.20 0.00 0.00 173.24 172.51 1vve s PRO 105 N -4.96 4.40 0.00 5.44 0.04 -1.26 -3.57 135.00 135.09 1vve s PRO 105 Ca 0.56 1.63 0.00 0.00 0.04 0.00 0.00 61.00 63.23 1vve s PRO 105 Cb -0.10 -3.50 0.00 0.00 0.04 0.00 0.00 34.50 30.94 1vve s PRO 105 CO 0.42 -0.34 0.00 0.41 0.04 0.00 0.00 177.00 177.53 1vve n GLY 106 N 3.24 0.93 1.68 0.56 0.00 -1.24 -4.88 105.19 105.47 1vve n GLY 106 Ca 0.10 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.11 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 0.00 -2.81 0.00 1.61 2.85 -1.23 -4.97 115.26 110.71 1vve n ASN 107 Ca 0.00 0.12 0.00 0.00 -0.11 0.00 0.00 54.58 54.59 1vve n ASN 107 Cb 0.00 -1.59 0.00 0.00 1.24 0.00 0.00 39.78 39.43 1vve n ASN 107 CO 0.00 0.00 0.00 0.35 -2.11 0.00 0.00 177.26 175.50 1vve n THR 108 N -0.27 0.00 -3.64 -0.44 -2.24 -1.25 -4.56 114.28 101.88 1vve n THR 108 Ca 0.01 0.00 -0.29 0.00 -2.27 0.00 0.00 64.05 61.50 1vve n THR 108 Cb 0.04 0.00 -0.14 0.00 -2.10 0.00 0.00 70.33 68.13 1vve n THR 108 CO 0.00 0.00 0.00 0.26 -0.57 0.00 0.00 175.07 174.76 1vve s TRP 109 N -3.00 1.39 -0.03 4.78 0.52 -1.26 -2.83 118.94 118.50 1vve s TRP 109 Ca 0.00 -1.79 -0.06 0.00 0.02 0.00 0.00 56.10 54.28 1vve s TRP 109 Cb 0.00 -1.48 -0.04 0.00 -1.15 0.00 0.00 33.47 30.79 1vve s TRP 109 CO 0.00 -0.83 0.21 0.15 0.02 0.00 0.00 176.95 176.49 1vve s LYS 110 N 1.22 3.50 1.02 4.98 1.02 -0.39 -3.51 119.74 127.57 1vve s LYS 110 Ca 0.14 -0.16 -0.14 0.00 0.02 0.00 0.00 55.97 55.82 1vve s LYS 110 Cb -0.20 -3.12 0.20 0.00 -0.52 0.00 0.00 37.83 34.18 1vve s LYS 110 CO -0.14 0.69 1.14 -1.25 -0.92 0.00 0.00 175.35 174.87 1vve s PRO 111 N -1.61 0.28 -0.09 -1.68 0.04 -1.26 0.12 135.00 130.80 1vve s PRO 111 Ca 0.24 0.19 -0.39 0.00 0.04 0.00 0.00 61.00 61.08 1vve s PRO 111 Cb -0.13 -1.75 -0.19 0.00 0.04 0.00 0.00 34.50 32.47 1vve s PRO 111 CO 0.14 -2.76 1.11 -1.91 0.04 0.00 0.00 177.00 173.62 1vve n GLU 112 N -4.14 0.00 -1.22 4.56 2.13 -1.23 -4.76 120.64 115.98 1vve n GLU 112 Ca 0.08 0.00 -0.38 0.00 0.66 0.00 0.00 57.16 57.52 1vve n GLU 112 Cb 0.59 -1.43 0.02 0.00 0.27 0.00 0.00 31.44 30.89 1vve n GLU 112 CO 0.00 0.00 0.00 1.28 -0.41 0.00 0.00 177.13 178.00 1vve n LEU 113 N 1.86 -3.49 -4.91 4.31 4.32 -1.23 -4.06 117.00 113.80 1vve n LEU 113 Ca 0.21 0.57 -0.28 0.00 -0.02 0.00 0.00 56.01 56.49 1vve n LEU 113 Cb 0.05 -0.88 0.06 0.00 -1.62 0.00 0.00 43.42 41.03 1vve n LEU 113 CO 0.63 -4.79 0.68 -2.16 -1.22 0.00 0.00 177.39 170.53 1vve s PRO 114 N -1.39 2.46 -0.25 3.23 0.04 -1.18 -4.43 135.00 133.49 1vve s PRO 114 Ca 0.55 0.07 0.01 0.00 0.04 0.00 0.00 61.00 61.67 1vve s PRO 114 Cb -0.43 -2.10 0.07 0.00 0.04 0.00 0.00 34.50 32.08 1vve s PRO 114 CO 0.68 -1.16 -0.02 0.21 0.04 0.00 0.00 177.00 176.75 1vve s LYS 115 N -5.30 1.42 -0.71 4.56 2.20 -0.56 -4.26 119.74 117.08 1vve s LYS 115 Ca 0.59 -1.02 -0.26 0.00 -0.36 0.00 0.00 55.97 54.91 1vve s LYS 115 Cb -0.11 -2.53 -0.23 0.00 -1.51 0.00 0.00 37.83 33.45 1vve s LYS 115 CO 0.48 -0.67 1.88 0.00 -0.36 0.00 0.00 175.35 176.67 1vve n VAL 117 N 7.56 0.00 -0.57 0.00 0.24 0.07 -4.62 118.33 121.02 1vve n VAL 117 Ca 0.45 -0.91 0.00 0.00 -2.04 0.00 0.00 64.34 61.85 1vve n VAL 117 Cb 0.44 -1.18 0.00 0.00 -1.47 0.00 0.00 33.84 31.63 1vve n VAL 117 CO 0.00 0.00 0.00 -2.11 -2.14 0.00 0.00 176.83 172.58