#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vvc s LYS 2 N 0.00 1.37 -0.41 5.55 1.02 -1.26 -4.85 119.74 121.15 1vvc s LYS 2 Ca 0.00 -1.75 0.01 0.00 0.02 0.00 0.00 55.97 54.26 1vvc s LYS 2 Cb 0.00 0.23 0.14 0.00 -0.52 0.00 0.00 37.83 37.68 1vvc s LYS 2 CO 0.00 -0.45 0.24 0.00 -0.92 0.00 0.00 175.35 174.23 1vvc s GLN 4 N 0.57 -0.44 0.32 0.00 -0.21 -1.26 0.27 119.66 118.92 1vvc s GLN 4 Ca 0.19 0.49 -0.25 0.00 0.02 0.00 0.00 55.36 55.81 1vvc s GLN 4 Cb -0.21 -1.64 -0.15 0.00 1.00 0.00 0.00 33.01 32.02 1vvc s GLN 4 CO -0.02 -3.31 0.53 0.45 -2.12 0.00 0.00 175.29 170.82 1vvc n SER 5 N -4.57 -1.01 -4.76 5.90 2.88 0.39 -4.63 113.62 107.82 1vvc n SER 5 Ca 0.06 1.01 -0.32 0.00 -1.33 0.00 0.00 58.87 58.29 1vvc n SER 5 Cb 0.57 -1.05 0.08 0.00 -0.75 0.00 0.00 64.21 63.07 1vvc n SER 5 CO 0.00 0.00 0.00 -2.16 -1.23 0.00 0.00 175.04 171.65 1vvc s PRO 6 N -1.28 2.32 0.94 -1.46 0.04 -1.26 -5.04 135.00 129.26 1vvc s PRO 6 Ca 0.62 1.27 -0.14 0.00 0.04 0.00 0.00 61.00 62.78 1vvc s PRO 6 Cb -0.73 -1.90 0.16 0.00 0.04 0.00 0.00 34.50 32.07 1vvc s PRO 6 CO 0.59 -1.61 1.20 -1.25 0.04 0.00 0.00 177.00 175.97 1vvc s PRO 7 N -4.65 0.88 1.13 0.56 0.04 -1.26 -4.87 135.00 126.83 1vvc s PRO 7 Ca 0.63 -0.02 -0.18 0.00 0.04 0.00 0.00 61.00 61.48 1vvc s PRO 7 Cb -0.19 -1.84 0.26 0.00 0.04 0.00 0.00 34.50 32.77 1vvc s PRO 7 CO 0.52 -2.31 1.13 -1.54 0.04 0.00 0.00 177.00 174.84 1vvc s SER 8 N -4.41 1.51 0.00 6.66 1.04 -1.26 -4.75 113.70 112.49 1vvc s SER 8 Ca 0.67 0.69 0.00 0.00 0.48 0.00 0.00 55.95 57.79 1vvc s SER 8 Cb -0.10 -0.99 0.00 0.00 0.10 0.00 0.00 66.02 65.03 1vvc s SER 8 CO 0.53 -3.76 0.00 2.30 0.98 0.00 0.00 173.24 173.28 1vvc n ILE 9 N -4.53 0.00 -1.45 -1.02 -5.35 -0.75 -5.00 119.36 101.26 1vvc n ILE 9 Ca 0.12 0.00 -0.26 0.00 -0.27 0.00 0.00 62.75 62.34 1vvc n ILE 9 Cb 0.59 0.00 -0.20 0.00 -1.74 0.00 0.00 39.64 38.29 1vvc n ILE 9 CO 0.00 0.00 0.00 -1.20 -1.76 0.00 0.00 176.55 173.59 1vvc n SER 10 N -2.37 -1.02 -1.94 7.28 7.64 -1.26 -0.95 113.62 121.00 1vvc n SER 10 Ca 0.00 -0.36 -0.02 0.00 1.01 0.00 0.00 58.87 59.49 1vvc n SER 10 Cb 0.00 -0.60 -0.00 0.00 -1.01 0.00 0.00 64.21 62.59 1vvc n SER 10 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 1vvc n ASN 11 N 6.49 -1.20 -4.38 6.43 4.13 -1.26 -3.83 115.26 121.63 1vvc n ASN 11 Ca 0.65 0.29 -0.20 0.00 1.68 0.00 0.00 54.58 57.01 1vvc n ASN 11 Cb 0.11 -1.27 -0.10 0.00 -1.54 0.00 0.00 39.78 36.98 1vvc n ASN 11 CO 0.00 0.00 0.00 -0.83 0.28 0.00 0.00 177.26 176.71 1vvc s GLY 12 N -1.69 1.57 0.00 7.41 0.00 -0.13 -2.65 107.32 111.84 1vvc s GLY 12 Ca 0.00 -1.73 0.00 0.00 0.00 0.00 0.00 44.72 42.99 1vvc s GLY 12 CO 0.00 -1.82 0.00 0.54 0.00 0.00 0.00 173.10 171.82 1vvc n ARG 13 N -0.46 1.62 -3.62 2.90 3.00 0.69 -1.81 116.66 118.97 1vvc n ARG 13 Ca -0.07 0.00 -0.09 0.00 -0.01 0.00 0.00 57.85 57.68 1vvc n ARG 13 Cb 0.60 0.00 -0.10 0.00 0.00 0.00 0.00 32.46 32.96 1vvc n ARG 13 CO 0.00 0.00 0.00 -3.38 0.00 0.00 0.00 177.63 174.25 1vvc s HIS 14 N 0.27 -0.73 -0.30 -1.55 -3.43 -1.26 0.28 115.29 108.57 1vvc s HIS 14 Ca 0.00 1.34 0.03 0.00 -0.80 0.00 0.00 55.06 55.64 1vvc s HIS 14 Cb 0.00 0.21 0.17 0.00 -1.43 0.00 0.00 32.58 31.53 1vvc s HIS 14 CO 0.00 -0.48 0.46 -0.80 -2.00 0.00 0.00 174.74 171.91 1vvc s ASN 15 N 2.57 -0.10 -0.04 7.38 0.01 -1.25 -4.88 114.94 118.64 1vvc s ASN 15 Ca 0.00 -0.33 -0.03 0.00 -0.71 0.00 0.00 52.86 51.79 1vvc s ASN 15 Cb -0.12 1.32 -0.01 0.00 0.41 0.00 0.00 41.25 42.85 1vvc s ASN 15 CO -0.12 -0.33 -0.05 0.61 -1.51 0.00 0.00 177.10 175.69 1vvc n GLY 16 N 5.28 -0.58 0.00 0.66 0.00 -1.26 -4.80 105.19 104.48 1vvc n GLY 16 Ca 0.03 -0.05 0.00 0.00 0.00 0.00 0.00 46.02 45.99 1vvc n GLY 16 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1vvc n TYR 17 N -2.85 0.00 -3.91 1.61 4.01 -1.26 -5.07 117.16 109.70 1vvc n TYR 17 Ca -0.02 0.00 -0.01 0.00 -0.16 0.00 0.00 57.90 57.71 1vvc n TYR 17 Cb 0.08 0.00 0.02 0.00 -0.31 0.00 0.00 39.34 39.13 1vvc n TYR 17 CO 0.00 0.00 0.00 -0.85 -0.46 0.00 0.00 176.86 175.55 1vvc n GLU 18 N 0.00 0.45 -0.02 -0.72 0.00 -1.26 -5.06 120.64 114.02 1vvc n GLU 18 Ca 0.00 -1.13 -0.03 0.00 0.00 0.00 0.00 57.16 56.00 1vvc n GLU 18 Cb 0.00 1.61 -0.03 0.00 0.00 0.00 0.00 31.44 33.01 1vvc n GLU 18 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.13 176.88 1vvc n ASP 19 N -1.16 3.76 -4.58 -1.84 8.00 -1.26 -4.73 116.55 114.75 1vvc n ASP 19 Ca 0.00 -0.01 -0.34 0.00 0.71 0.00 0.00 54.79 55.15 1vvc n ASP 19 Cb 0.53 0.42 -0.11 0.00 -0.02 0.00 0.00 41.12 41.94 1vvc n ASP 19 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 1vvc s PHE 20 N -2.12 2.94 0.00 1.24 0.40 -1.26 0.15 117.98 119.33 1vvc s PHE 20 Ca -0.04 0.01 0.00 0.00 -0.60 0.00 0.00 56.93 56.30 1vvc s PHE 20 Cb 0.02 -1.72 0.00 0.00 0.51 0.00 0.00 43.02 41.83 1vvc s PHE 20 CO 0.18 0.32 0.08 0.66 0.70 0.00 0.00 175.22 177.16 1vvc n TYR 21 N 2.26 0.00 0.00 0.36 4.01 0.77 -4.91 117.16 119.65 1vvc n TYR 21 Ca -0.18 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.56 1vvc n TYR 21 Cb 0.53 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.56 1vvc n TYR 21 CO 0.00 0.00 0.00 0.25 -0.46 0.00 0.00 176.86 176.65 1vvc n THR 22 N -0.48 0.00 -3.80 -0.72 -2.24 -1.17 -4.22 114.28 101.65 1vvc n THR 22 Ca 0.00 0.00 -0.09 0.00 -2.27 0.00 0.00 64.05 61.69 1vvc n THR 22 Cb 0.02 0.00 -0.06 0.00 -2.10 0.00 0.00 70.33 68.19 1vvc n THR 22 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1vvc s ASP 23 N -4.00 -0.02 -0.75 3.42 -1.08 -1.25 -3.07 116.67 109.91 1vvc s ASP 23 Ca 0.00 -0.57 0.00 0.00 -0.52 0.00 0.00 52.55 51.46 1vvc s ASP 23 Cb 0.00 0.40 0.00 0.00 -1.46 0.00 0.00 42.92 41.86 1vvc s ASP 23 CO 0.00 -0.81 0.00 0.61 0.52 0.00 0.00 175.17 175.49 1vvc n GLY 24 N -0.15 0.86 4.02 2.66 0.00 0.23 -4.90 105.19 107.91 1vvc n GLY 24 Ca -0.14 -0.27 -0.20 0.00 0.00 0.00 0.00 46.02 45.40 1vvc n GLY 24 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1vvc s SER 25 N -2.51 4.97 0.06 1.61 1.04 -1.01 -4.92 113.70 112.95 1vvc s SER 25 Ca 0.00 -0.63 -0.16 0.00 0.48 0.00 0.00 55.95 55.64 1vvc s SER 25 Cb 0.00 0.05 0.03 0.00 0.10 0.00 0.00 66.02 66.20 1vvc s SER 25 CO 0.00 -1.41 0.37 -0.69 0.98 0.00 0.00 173.24 172.49 1vvc s VAL 26 N -2.76 0.07 -0.06 5.02 1.01 -1.25 -1.64 120.40 120.78 1vvc s VAL 26 Ca 0.62 -0.57 -0.03 0.00 0.00 0.00 0.00 61.98 62.00 1vvc s VAL 26 Cb -0.06 -1.01 0.04 0.00 0.00 0.00 0.00 36.38 35.35 1vvc s VAL 26 CO 0.40 -0.32 0.12 -0.69 0.00 0.00 0.00 175.10 174.61 1vvc s VAL 27 N -2.81 -0.17 -0.58 2.92 1.01 -0.98 -4.70 120.40 115.09 1vvc s VAL 27 Ca -0.03 0.35 -0.28 0.00 0.00 0.00 0.00 61.98 62.02 1vvc s VAL 27 Cb -0.00 -0.22 0.01 0.00 0.00 0.00 0.00 36.38 36.16 1vvc s VAL 27 CO -0.05 0.15 1.51 -0.89 0.00 0.00 0.00 175.10 175.82 1vvc s THR 28 N 2.02 3.68 -0.05 3.92 2.01 -1.26 0.19 115.64 126.14 1vvc s THR 28 Ca 0.01 0.54 -0.30 0.00 0.31 0.00 0.00 61.69 62.25 1vvc s THR 28 Cb -0.12 -4.34 -0.05 0.00 0.01 0.00 0.00 72.50 67.99 1vvc s THR 28 CO -0.05 -1.15 1.61 -0.31 -0.69 0.00 0.00 174.62 174.04 1vvc s TYR 29 N 6.66 2.10 0.72 4.92 1.51 -1.26 -3.80 117.35 128.20 1vvc s TYR 29 Ca 0.55 0.28 -0.12 0.00 -1.01 0.00 0.00 57.07 56.77 1vvc s TYR 29 Cb -0.12 -3.88 0.03 0.00 -0.11 0.00 0.00 41.96 37.89 1vvc s TYR 29 CO 0.24 -3.64 1.10 -1.12 -1.11 0.00 0.00 175.55 171.02 1vvc s SER 30 N 3.14 4.75 0.16 2.29 0.01 0.78 -4.71 113.70 120.12 1vvc s SER 30 Ca 0.72 1.90 0.07 0.00 1.31 0.00 0.00 55.95 59.95 1vvc s SER 30 Cb -0.33 -2.53 -0.04 0.00 0.21 0.00 0.00 66.02 63.33 1vvc s SER 30 CO 0.28 -1.87 -0.16 0.00 0.41 0.00 0.00 173.24 171.91 1vvc n ASN 32 N 0.18 2.67 -4.51 0.00 4.13 -1.08 -4.79 115.26 111.86 1vvc n ASN 32 Ca -0.12 1.03 -0.51 0.00 1.68 0.00 0.00 54.58 56.66 1vvc n ASN 32 Cb 0.58 -1.55 -0.07 0.00 -1.54 0.00 0.00 39.78 37.20 1vvc n ASN 32 CO 0.00 0.00 0.00 -1.20 0.28 0.00 0.00 177.26 176.34 1vvc n SER 33 N -0.52 2.36 0.00 6.41 7.64 -1.26 -0.29 113.62 127.96 1vvc n SER 33 Ca 0.09 0.54 0.00 0.00 1.01 0.00 0.00 58.87 60.50 1vvc n SER 33 Cb 0.43 -1.27 0.00 0.00 -1.01 0.00 0.00 64.21 62.35 1vvc n SER 33 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1vvc n GLY 34 N 6.03 1.05 3.45 0.23 0.00 -1.26 -5.10 105.19 109.59 1vvc n GLY 34 Ca 0.37 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 46.06 1vvc n GLY 34 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1vvc s TYR 35 N -2.00 2.71 0.12 1.61 1.51 0.61 -4.72 117.35 117.19 1vvc s TYR 35 Ca 0.00 -0.26 -0.20 0.00 -1.01 0.00 0.00 57.07 55.60 1vvc s TYR 35 Cb 0.00 -1.67 -0.07 0.00 -0.11 0.00 0.00 41.96 40.11 1vvc s TYR 35 CO 0.00 0.10 0.63 0.45 -1.11 0.00 0.00 175.55 175.63 1vvc s SER 36 N -0.52 7.11 -0.60 2.29 0.15 0.76 -4.72 113.70 118.17 1vvc s SER 36 Ca 0.07 1.35 -0.21 0.00 0.70 0.00 0.00 55.95 57.86 1vvc s SER 36 Cb -0.12 -2.39 0.08 0.00 -1.71 0.00 0.00 66.02 61.88 1vvc s SER 36 CO 0.01 0.21 0.81 -0.22 1.20 0.00 0.00 173.24 175.25 1vvc s LEU 37 N -1.35 4.83 0.07 3.45 2.96 -1.24 -1.16 118.68 126.24 1vvc s LEU 37 Ca 0.34 -1.09 -0.16 0.00 -0.22 0.00 0.00 54.13 53.00 1vvc s LEU 37 Cb -0.19 -2.42 -0.06 0.00 0.50 0.00 0.00 46.19 44.02 1vvc s LEU 37 CO 0.21 -1.21 0.50 -0.63 -1.32 0.00 0.00 176.35 173.90 1vvc s ILE 38 N 3.30 4.88 0.00 6.68 -1.09 0.41 -4.76 121.20 130.62 1vvc s ILE 38 Ca 0.18 0.96 0.00 0.00 -2.23 0.00 0.00 60.65 59.56 1vvc s ILE 38 Cb -0.20 -3.79 0.00 0.00 -1.58 0.00 0.00 42.46 36.90 1vvc s ILE 38 CO 0.10 0.48 0.00 0.61 -1.23 0.00 0.00 174.94 174.90 1vvc n GLY 39 N 1.50 -0.19 3.77 6.18 0.00 -1.26 0.22 105.19 115.42 1vvc n GLY 39 Ca -0.10 -2.26 -0.38 0.00 0.00 0.00 0.00 46.02 43.28 1vvc n GLY 39 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1vvc s ASN 40 N -3.75 6.17 -0.58 1.61 0.01 -1.26 -4.84 114.94 112.30 1vvc s ASN 40 Ca 0.00 2.47 -0.05 0.00 -0.71 0.00 0.00 52.86 54.57 1vvc s ASN 40 Cb 0.00 -2.62 -0.12 0.00 0.41 0.00 0.00 41.25 38.92 1vvc s ASN 40 CO 0.00 -0.93 2.47 -1.54 -1.51 0.00 0.00 177.10 175.59 1vvc n SER 41 N -0.25 4.82 0.00 -1.22 3.41 -1.26 -4.57 113.62 114.55 1vvc n SER 41 Ca 0.06 -2.28 0.00 0.00 -0.26 0.00 0.00 58.87 56.39 1vvc n SER 41 Cb 0.46 -1.10 0.00 0.00 -0.26 0.00 0.00 64.21 63.31 1vvc n SER 41 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1vvc n GLY 42 N 3.21 3.28 2.91 5.00 0.00 -1.26 -4.48 105.19 113.87 1vvc n GLY 42 Ca 0.42 -0.09 -0.26 0.00 0.00 0.00 0.00 46.02 46.08 1vvc n GLY 42 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1vvc n VAL 43 N 0.00 0.00 -3.47 1.61 0.31 0.50 -4.41 118.33 112.87 1vvc n VAL 43 Ca 0.00 -0.21 -0.25 0.00 -0.01 0.00 0.00 64.34 63.87 1vvc n VAL 43 Cb 0.00 -1.03 -0.12 0.00 -0.91 0.00 0.00 33.84 31.77 1vvc n VAL 43 CO 0.00 0.00 0.00 -0.22 -1.32 0.00 0.00 176.83 175.29 1vvc s LEU 44 N 0.00 0.41 -0.55 7.52 2.96 -0.83 -2.31 118.68 125.88 1vvc s LEU 44 Ca 0.60 -1.43 -0.26 0.00 -0.22 0.00 0.00 54.13 52.82 1vvc s LEU 44 Cb -0.08 -0.08 0.04 0.00 0.50 0.00 0.00 46.19 46.56 1vvc s LEU 44 CO 0.48 -0.38 1.04 0.00 -1.32 0.00 0.00 176.35 176.17 1vvc s SER 46 N 2.84 4.09 0.00 0.00 0.15 -1.25 0.78 113.70 120.31 1vvc s SER 46 Ca 0.36 -1.67 0.00 0.00 0.70 0.00 0.00 55.95 55.34 1vvc s SER 46 Cb -0.10 -0.98 0.00 0.00 -1.71 0.00 0.00 66.02 63.22 1vvc s SER 46 CO 0.22 -0.40 0.00 0.61 1.20 0.00 0.00 173.24 174.87 1vvc n GLY 47 N 4.76 1.27 2.13 9.45 0.00 -1.26 -4.31 105.19 117.22 1vvc n GLY 47 Ca -0.02 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.94 1vvc n GLY 47 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1vvc n GLY 48 N -1.59 0.24 2.75 -0.02 0.00 -1.25 -4.92 105.19 100.40 1vvc n GLY 48 Ca 0.00 -0.65 -0.17 0.00 0.00 0.00 0.00 46.02 45.20 1vvc n GLY 48 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1vvc s GLU 49 N -4.01 0.60 0.22 1.61 2.02 -1.26 -4.92 118.70 112.96 1vvc s GLU 49 Ca 0.00 -0.81 -0.30 0.00 0.02 0.00 0.00 54.97 53.88 1vvc s GLU 49 Cb 0.00 -0.74 -0.16 0.00 0.10 0.00 0.00 34.13 33.33 1vvc s GLU 49 CO 0.00 -1.18 0.92 0.91 0.02 0.00 0.00 175.26 175.93 1vvc n TRP 50 N 4.34 0.76 -4.01 1.61 7.02 -1.26 -3.89 117.44 122.01 1vvc n TRP 50 Ca 0.10 0.79 -0.08 0.00 -1.02 0.00 0.00 57.50 57.29 1vvc n TRP 50 Cb 0.45 -2.17 -0.09 0.00 -2.42 0.00 0.00 31.31 27.08 1vvc n TRP 50 CO 0.00 0.00 0.00 0.45 -2.02 0.00 0.00 177.69 176.12 1vvc s SER 51 N -0.51 0.35 -0.74 -0.99 0.15 -0.64 -4.93 113.70 106.40 1vvc s SER 51 Ca 0.66 -0.85 -0.02 0.00 0.70 0.00 0.00 55.95 56.44 1vvc s SER 51 Cb -0.83 0.24 -0.02 0.00 -1.71 0.00 0.00 66.02 63.69 1vvc s SER 51 CO 0.57 -0.61 0.68 -0.67 1.20 0.00 0.00 173.24 174.41 1vvc n ASP 52 N 0.19 -6.87 -4.72 5.45 2.03 -1.26 -1.97 116.55 109.40 1vvc n ASP 52 Ca -0.15 -0.24 -0.38 0.00 0.52 0.00 0.00 54.79 54.54 1vvc n ASP 52 Cb 0.61 -4.81 -0.06 0.00 -0.72 0.00 0.00 41.12 36.14 1vvc n ASP 52 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 1vvc s PRO 53 N -3.38 4.35 0.99 -0.67 0.04 -1.26 -4.39 135.00 130.68 1vvc s PRO 53 Ca 0.13 0.53 -0.16 0.00 0.04 0.00 0.00 61.00 61.54 1vvc s PRO 53 Cb -0.02 -3.44 0.20 0.00 0.04 0.00 0.00 34.50 31.27 1vvc s PRO 53 CO 0.67 0.12 1.23 -1.25 0.04 0.00 0.00 177.00 177.81 1vvc s PRO 54 N 0.71 0.47 0.08 0.56 0.04 -1.26 -4.91 135.00 130.69 1vvc s PRO 54 Ca 0.28 -0.17 0.10 0.00 0.04 0.00 0.00 61.00 61.25 1vvc s PRO 54 Cb -0.16 -1.80 -0.03 0.00 0.04 0.00 0.00 34.50 32.55 1vvc s PRO 54 CO 0.12 -2.57 -0.26 0.95 0.04 0.00 0.00 177.00 175.28 1vvc s THR 55 N -3.57 2.24 -0.88 1.26 -4.23 0.61 -4.79 115.64 106.28 1vvc s THR 55 Ca 0.70 -1.52 -0.02 0.00 -1.18 0.00 0.00 61.69 59.68 1vvc s THR 55 Cb -0.08 -1.92 0.22 0.00 1.34 0.00 0.00 72.50 72.06 1vvc s THR 55 CO 0.53 0.26 0.76 0.00 -0.54 0.00 0.00 174.62 175.63 1vvc n GLN 57 N 2.46 3.96 -5.04 0.00 1.13 -0.31 -4.68 117.38 114.90 1vvc n GLN 57 Ca 0.20 0.00 -0.32 0.00 -1.94 0.00 0.00 57.00 54.94 1vvc n GLN 57 Cb 0.37 0.00 -0.16 0.00 0.11 0.00 0.00 30.24 30.56 1vvc n GLN 57 CO 0.00 0.00 0.00 0.42 -1.44 0.00 0.00 177.06 176.04 1vvc s ILE 58 N 2.12 2.47 -0.41 5.09 1.09 -1.26 0.27 121.20 130.56 1vvc s ILE 58 Ca 0.00 -0.87 0.06 0.00 -1.10 0.00 0.00 60.65 58.73 1vvc s ILE 58 Cb 0.00 -1.99 0.43 0.00 -1.06 0.00 0.00 42.46 39.84 1vvc s ILE 58 CO 0.00 0.55 1.12 1.33 -0.10 0.00 0.00 174.94 177.84 1vvc n VAL 59 N 3.52 2.37 -0.14 2.92 0.24 -1.26 -4.03 118.33 121.95 1vvc n VAL 59 Ca -0.19 -4.78 0.00 0.00 -2.04 0.00 0.00 64.34 57.34 1vvc n VAL 59 Cb 0.53 -1.20 0.00 0.00 -1.47 0.00 0.00 33.84 31.70 1vvc n VAL 59 CO 0.00 0.00 0.00 0.29 -2.14 0.00 0.00 176.83 174.98 1vvc n LYS 60 N -0.51 -1.16 -3.93 7.34 4.01 -1.26 -3.31 118.16 119.33 1vvc n LYS 60 Ca 0.39 0.00 -0.09 0.00 -0.51 0.00 0.00 58.31 58.10 1vvc n LYS 60 Cb 0.72 0.00 -0.07 0.00 -0.51 0.00 0.00 35.03 35.17 1vvc n LYS 60 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 1vvc h PRO 62 N 2.58 0.00 0.00 0.00 0.13 -1.85 -3.43 132.00 129.43 1vvc h PRO 62 Ca -0.32 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.81 1vvc h PRO 62 Cb 1.22 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.35 1vvc h PRO 62 CO 0.50 0.00 0.00 0.72 -0.23 0.00 0.00 178.00 178.99 1vvc n HIS 63 N -4.14 0.00 -1.46 1.56 8.25 -1.26 -4.98 115.22 113.18 1vvc n HIS 63 Ca -0.05 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 56.99 1vvc n HIS 63 Cb 0.20 0.00 -0.02 0.00 1.12 0.00 0.00 29.99 31.28 1vvc n HIS 63 CO 0.00 0.00 0.00 -0.35 0.64 0.00 0.00 176.34 176.63 1vvc n PRO 64 N 0.00 2.38 -1.80 -0.41 -0.04 -1.26 -4.91 135.00 128.96 1vvc n PRO 64 Ca 0.00 -2.27 -0.19 0.00 -0.04 0.00 0.00 63.50 61.00 1vvc n PRO 64 Cb 0.00 -3.10 0.11 0.00 -0.04 0.00 0.00 33.50 30.47 1vvc n PRO 64 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 1vvc n THR 65 N 5.31 0.00 0.00 0.52 -2.24 -1.26 -4.52 114.28 112.09 1vvc n THR 65 Ca 0.52 -0.99 0.00 0.00 -2.27 0.00 0.00 64.05 61.31 1vvc n THR 65 Cb 0.38 -1.26 0.00 0.00 -2.10 0.00 0.00 70.33 67.35 1vvc n THR 65 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1vvc n ILE 66 N -2.81 0.00 -2.06 2.28 3.06 -1.26 -4.75 119.36 113.81 1vvc n ILE 66 Ca 0.12 0.00 -0.41 0.00 -2.50 0.00 0.00 62.75 59.96 1vvc n ILE 66 Cb 0.43 0.00 -0.03 0.00 0.54 0.00 0.00 39.64 40.59 1vvc n ILE 66 CO 0.00 0.00 0.00 -0.55 -2.50 0.00 0.00 176.55 173.50 1vvc s SER 67 N 0.00 5.68 -1.76 9.51 0.15 -1.26 -3.73 113.70 122.28 1vvc s SER 67 Ca 0.00 0.81 -0.17 0.00 0.70 0.00 0.00 55.95 57.29 1vvc s SER 67 Cb 0.00 -2.53 0.17 0.00 -1.71 0.00 0.00 66.02 61.95 1vvc s SER 67 CO 0.00 -1.97 0.43 0.59 1.20 0.00 0.00 173.24 173.49 1vvc n ASN 68 N 11.18 -1.03 -1.29 5.45 4.13 -1.26 -2.71 115.26 129.73 1vvc n ASN 68 Ca 0.21 -1.24 -0.02 0.00 1.68 0.00 0.00 54.58 55.22 1vvc n ASN 68 Cb 0.49 -1.57 -0.02 0.00 -1.54 0.00 0.00 39.78 37.14 1vvc n ASN 68 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1vvc n GLY 69 N -1.47 0.78 1.00 7.41 0.00 -1.24 0.12 105.19 111.78 1vvc n GLY 69 Ca -0.01 -0.42 -0.02 0.00 0.00 0.00 0.00 46.02 45.57 1vvc n GLY 69 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 173.32 174.90 1vvc n TYR 70 N 0.21 -0.95 -4.15 1.61 4.11 -1.25 -3.21 117.16 113.52 1vvc n TYR 70 Ca -0.11 0.12 -0.23 0.00 -0.00 0.00 0.00 57.90 57.67 1vvc n TYR 70 Cb 0.92 -0.47 -0.06 0.00 -0.00 0.00 0.00 39.34 39.72 1vvc n TYR 70 CO 0.00 0.00 0.00 -0.48 -0.00 0.00 0.00 176.86 176.38 1vvc s LEU 71 N 0.00 3.28 0.00 -3.48 -0.00 -1.25 0.32 118.68 117.55 1vvc s LEU 71 Ca 0.05 -0.71 0.09 0.00 -0.00 0.00 0.00 54.13 53.57 1vvc s LEU 71 Cb -0.01 -1.77 0.16 0.00 -0.00 0.00 0.00 46.19 44.57 1vvc s LEU 71 CO 0.05 -0.20 0.99 -0.24 -0.00 0.00 0.00 176.35 176.94 1vvc n SER 72 N -1.09 0.21 0.00 1.48 2.88 -0.81 -4.73 113.62 111.57 1vvc n SER 72 Ca -0.04 -1.86 0.00 0.00 -1.33 0.00 0.00 58.87 55.64 1vvc n SER 72 Cb 0.60 -0.13 0.00 0.00 -0.75 0.00 0.00 64.21 63.93 1vvc n SER 72 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 1vvc n SER 73 N 0.18 0.00 -3.62 -3.46 2.88 -1.26 -4.94 113.62 103.40 1vvc n SER 73 Ca -0.02 0.00 -0.27 0.00 -1.33 0.00 0.00 58.87 57.25 1vvc n SER 73 Cb 0.84 -0.03 -0.10 0.00 -0.75 0.00 0.00 64.21 64.16 1vvc n SER 73 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1vvc n GLY 74 N 3.01 3.83 3.91 0.46 0.00 -1.26 -4.99 105.19 110.15 1vvc n GLY 74 Ca 0.00 -2.34 -0.21 0.00 0.00 0.00 0.00 46.02 43.47 1vvc n GLY 74 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1vvc s PHE 75 N -1.48 3.12 0.00 1.61 2.19 -1.26 -4.49 117.98 117.67 1vvc s PHE 75 Ca 0.31 -0.18 -0.28 0.00 0.33 0.00 0.00 56.93 57.12 1vvc s PHE 75 Cb 0.04 -1.71 0.09 0.00 -1.31 0.00 0.00 43.02 40.13 1vvc s PHE 75 CO -0.13 0.26 0.78 0.15 1.83 0.00 0.00 175.22 178.11 1vvc s LYS 76 N -4.00 0.97 0.56 10.12 1.02 -1.26 -5.00 119.74 122.14 1vvc s LYS 76 Ca 0.39 -0.13 0.30 0.00 0.02 0.00 0.00 55.97 56.54 1vvc s LYS 76 Cb -0.08 0.45 1.46 0.00 -0.52 0.00 0.00 37.83 39.14 1vvc s LYS 76 CO 0.28 -0.38 1.89 0.00 -0.92 0.00 0.00 175.35 176.22 1vvc h ARG 77 N 2.34 0.00 -3.80 1.68 3.08 -2.00 -3.42 114.38 112.27 1vvc h ARG 77 Ca -0.26 0.00 -0.11 0.00 0.07 0.00 0.00 59.98 59.68 1vvc h ARG 77 Cb 1.22 0.00 -0.16 0.00 0.08 0.00 0.00 29.97 31.11 1vvc h ARG 77 CO 0.35 0.00 -0.47 0.45 -1.07 0.00 0.00 179.97 179.23 1vvc s SER 78 N -5.48 0.17 0.00 7.04 0.15 -1.26 -4.93 113.70 109.39 1vvc s SER 78 Ca -0.05 -0.58 0.00 0.00 0.70 0.00 0.00 55.95 56.02 1vvc s SER 78 Cb 0.19 0.27 0.00 0.00 -1.71 0.00 0.00 66.02 64.77 1vvc s SER 78 CO 0.68 -0.59 0.00 -1.22 1.20 0.00 0.00 173.24 173.31 1vvc n TYR 79 N 0.46 0.00 0.00 3.44 4.02 -1.26 -4.98 117.16 118.84 1vvc n TYR 79 Ca -0.17 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.72 1vvc n TYR 79 Cb 0.60 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.92 1vvc n TYR 79 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 176.86 174.72 1vvc n SER 80 N 0.00 0.00 -1.49 7.72 3.41 -1.21 -4.05 113.62 118.00 1vvc n SER 80 Ca 0.00 0.00 0.08 0.00 -0.26 0.00 0.00 58.87 58.69 1vvc n SER 80 Cb 0.00 0.00 0.32 0.00 -0.26 0.00 0.00 64.21 64.27 1vvc n SER 80 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1vvc n TYR 81 N 0.00 1.42 0.00 7.33 4.19 -1.18 -4.07 117.16 124.85 1vvc n TYR 81 Ca 0.00 -0.54 0.00 0.00 3.31 0.00 0.00 57.90 60.67 1vvc n TYR 81 Cb 0.00 -0.28 0.00 0.00 0.49 0.00 0.00 39.34 39.55 1vvc n TYR 81 CO 0.00 0.00 0.00 0.27 0.91 0.00 0.00 176.86 178.04 1vvc n ASN 82 N 0.86 0.00 -3.47 2.98 0.23 0.65 -4.21 115.26 112.29 1vvc n ASN 82 Ca 0.23 0.00 -0.25 0.00 -0.53 0.00 0.00 54.58 54.03 1vvc n ASN 82 Cb 0.86 0.00 0.02 0.00 -2.08 0.00 0.00 39.78 38.57 1vvc n ASN 82 CO 0.00 0.00 0.00 -0.67 -0.93 0.00 0.00 177.26 175.66 1vvc n ASP 83 N 0.00 -5.87 -4.72 0.53 2.03 -1.26 0.26 116.55 107.52 1vvc n ASP 83 Ca 0.00 -0.35 -0.42 0.00 0.52 0.00 0.00 54.79 54.54 1vvc n ASP 83 Cb 0.00 -2.60 -0.03 0.00 -0.72 0.00 0.00 41.12 37.77 1vvc n ASP 83 CO 0.00 0.00 0.00 0.21 -1.92 0.00 0.00 177.20 175.49 1vvc s ASN 84 N -2.36 6.85 -0.20 1.67 3.84 -1.26 -3.00 114.94 120.49 1vvc s ASN 84 Ca 0.18 2.32 -0.02 0.00 0.21 0.00 0.00 52.86 55.55 1vvc s ASN 84 Cb -0.02 -2.59 0.00 0.00 -0.55 0.00 0.00 41.25 38.09 1vvc s ASN 84 CO 0.86 -0.62 -0.11 0.68 -2.79 0.00 0.00 177.10 175.11 1vvc s VAL 85 N 0.95 2.79 0.01 -5.21 -7.23 0.63 -4.18 120.40 108.15 1vvc s VAL 85 Ca 0.63 -0.69 -0.29 0.00 -1.81 0.00 0.00 61.98 59.81 1vvc s VAL 85 Cb -0.36 -2.23 -0.04 0.00 0.56 0.00 0.00 36.38 34.31 1vvc s VAL 85 CO 0.31 0.48 0.94 -1.81 -0.31 0.00 0.00 175.10 174.71 1vvc s ASP 86 N 1.35 7.34 -0.12 4.85 1.01 -1.26 -1.44 116.67 128.40 1vvc s ASP 86 Ca 0.05 1.62 -0.19 0.00 0.71 0.00 0.00 52.55 54.73 1vvc s ASP 86 Cb -0.14 -2.55 -0.04 0.00 1.01 0.00 0.00 42.92 41.20 1vvc s ASP 86 CO -0.07 -0.21 0.52 -0.36 0.21 0.00 0.00 175.17 175.26 1vvc s PHE 87 N 0.81 3.51 -0.61 4.23 0.08 0.71 -1.92 117.98 124.79 1vvc s PHE 87 Ca 0.49 0.94 -0.09 0.00 0.12 0.00 0.00 56.93 58.40 1vvc s PHE 87 Cb -0.21 -2.60 0.16 0.00 -0.57 0.00 0.00 43.02 39.80 1vvc s PHE 87 CO 0.27 0.13 0.49 0.21 -0.10 0.00 0.00 175.22 176.22 1vvc s LYS 88 N 0.75 2.81 0.08 0.44 2.20 0.97 -4.82 119.74 122.16 1vvc s LYS 88 Ca 0.28 -2.19 -0.36 0.00 -0.36 0.00 0.00 55.97 53.33 1vvc s LYS 88 Cb -0.16 -4.00 -0.18 0.00 -1.51 0.00 0.00 37.83 31.99 1vvc s LYS 88 CO 0.11 -1.22 1.12 0.00 -0.36 0.00 0.00 175.35 175.01 1vvc n LYS 90 N 1.82 0.00 -3.63 0.00 5.02 0.32 -4.83 118.16 116.87 1vvc n LYS 90 Ca 0.18 0.45 -0.12 0.00 -2.02 0.00 0.00 58.31 56.81 1vvc n LYS 90 Cb 0.17 -0.99 -0.07 0.00 -0.02 0.00 0.00 35.03 34.12 1vvc n LYS 90 CO 0.00 0.00 0.00 0.71 -0.52 0.00 0.00 177.40 177.59 1vvc s TYR 91 N -0.97 -0.78 -1.22 2.13 2.02 -1.26 -4.97 117.35 112.30 1vvc s TYR 91 Ca 0.00 1.81 -0.10 0.00 -0.37 0.00 0.00 57.07 58.41 1vvc s TYR 91 Cb 0.00 0.35 -0.01 0.00 -0.40 0.00 0.00 41.96 41.90 1vvc s TYR 91 CO 0.00 -0.38 0.72 0.41 -1.57 0.00 0.00 175.55 174.73 1vvc n GLY 92 N 2.93 -0.69 3.46 0.71 0.00 -1.26 -4.98 105.19 105.35 1vvc n GLY 92 Ca -0.15 0.33 -0.16 0.00 0.00 0.00 0.00 46.02 46.04 1vvc n GLY 92 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1vvc s TYR 93 N -3.59 -0.55 -0.14 1.61 2.02 -1.26 -4.76 117.35 110.68 1vvc s TYR 93 Ca 0.26 0.86 -0.04 0.00 -0.37 0.00 0.00 57.07 57.79 1vvc s TYR 93 Cb -0.08 0.37 -0.03 0.00 -0.40 0.00 0.00 41.96 41.82 1vvc s TYR 93 CO 0.84 -0.60 -0.02 0.21 -1.57 0.00 0.00 175.55 174.41 1vvc s LYS 94 N -1.59 3.55 -0.87 -0.62 2.20 0.71 -4.70 119.74 118.42 1vvc s LYS 94 Ca -0.10 -0.47 -0.25 0.00 -0.36 0.00 0.00 55.97 54.80 1vvc s LYS 94 Cb -0.01 -2.93 -0.02 0.00 -1.51 0.00 0.00 37.83 33.36 1vvc s LYS 94 CO 0.06 0.36 1.82 -0.51 -0.36 0.00 0.00 175.35 176.72 1vvc s LEU 95 N 0.07 3.24 -0.61 5.43 1.43 -1.24 0.13 118.68 127.14 1vvc s LEU 95 Ca 0.01 -0.63 -0.27 0.00 -1.03 0.00 0.00 54.13 52.22 1vvc s LEU 95 Cb -0.13 -2.56 -0.02 0.00 0.03 0.00 0.00 46.19 43.51 1vvc s LEU 95 CO 0.02 -2.44 1.86 -0.55 0.23 0.00 0.00 176.35 175.47 1vvc s SER 96 N 7.36 5.28 0.00 2.29 0.15 0.70 -4.10 113.70 125.39 1vvc s SER 96 Ca 0.64 0.35 0.00 0.00 0.70 0.00 0.00 55.95 57.64 1vvc s SER 96 Cb -0.07 -2.53 0.00 0.00 -1.71 0.00 0.00 66.02 61.71 1vvc s SER 96 CO 0.02 -2.37 0.00 0.61 1.20 0.00 0.00 173.24 172.70 1vvc n GLY 97 N 5.69 0.62 3.31 9.45 0.00 -1.26 -0.85 105.19 122.16 1vvc n GLY 97 Ca 0.20 -0.16 -0.03 0.00 0.00 0.00 0.00 46.02 46.03 1vvc n GLY 97 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1vvc s SER 98 N -4.00 -0.74 0.00 1.61 0.15 -1.26 -4.90 113.70 104.57 1vvc s SER 98 Ca 0.00 1.04 0.19 0.00 0.70 0.00 0.00 55.95 57.88 1vvc s SER 98 Cb 0.00 1.82 1.15 0.00 -1.71 0.00 0.00 66.02 67.29 1vvc s SER 98 CO 0.00 -0.25 1.57 -1.20 1.20 0.00 0.00 173.24 174.56 1vvc n SER 99 N 5.42 0.00 -3.45 5.45 7.64 -1.26 -3.37 113.62 124.05 1vvc n SER 99 Ca -0.07 -0.77 -0.17 0.00 1.01 0.00 0.00 58.87 58.86 1vvc n SER 99 Cb 0.50 0.00 -0.11 0.00 -1.01 0.00 0.00 64.21 63.58 1vvc n SER 99 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 1vvc s SER 100 N -1.92 1.42 0.42 6.43 1.04 -1.26 0.26 113.70 120.09 1vvc s SER 100 Ca 0.29 -0.37 0.05 0.00 0.48 0.00 0.00 55.95 56.39 1vvc s SER 100 Cb 0.13 0.48 -0.06 0.00 0.10 0.00 0.00 66.02 66.67 1vvc s SER 100 CO 0.22 -0.35 0.02 -0.44 0.98 0.00 0.00 173.24 173.68 1vvc s SER 101 N 2.35 3.59 -0.04 7.02 0.01 -0.52 -4.59 113.70 121.52 1vvc s SER 101 Ca 0.08 -1.45 -0.03 0.00 1.31 0.00 0.00 55.95 55.86 1vvc s SER 101 Cb -0.15 -0.08 0.01 0.00 0.21 0.00 0.00 66.02 66.01 1vvc s SER 101 CO -0.20 -0.60 0.11 -0.89 0.41 0.00 0.00 173.24 172.07 1vvc s THR 102 N -2.89 -0.01 -0.58 1.44 2.01 0.14 0.23 115.64 115.98 1vvc s THR 102 Ca 0.28 0.03 -0.26 0.00 0.31 0.00 0.00 61.69 62.05 1vvc s THR 102 Cb 0.07 -0.16 -0.04 0.00 0.01 0.00 0.00 72.50 72.38 1vvc s THR 102 CO 0.14 0.01 2.09 0.00 -0.69 0.00 0.00 174.62 176.18 1vvc s SER 104 N 9.80 3.63 -0.02 0.00 0.01 -1.25 0.24 113.70 126.10 1vvc s SER 104 Ca 0.80 0.47 -0.30 0.00 1.31 0.00 0.00 55.95 58.23 1vvc s SER 104 Cb -0.14 -0.69 -0.04 0.00 0.21 0.00 0.00 66.02 65.35 1vvc s SER 104 CO 0.22 -2.43 1.28 -2.16 0.41 0.00 0.00 173.24 170.56 1vvc s PRO 105 N -5.76 4.33 0.00 12.44 0.04 -1.26 -3.56 135.00 141.23 1vvc s PRO 105 Ca 0.69 1.80 0.00 0.00 0.04 0.00 0.00 61.00 63.53 1vvc s PRO 105 Cb -0.07 -3.55 0.00 0.00 0.04 0.00 0.00 34.50 30.93 1vvc s PRO 105 CO 0.51 -0.48 0.00 0.41 0.04 0.00 0.00 177.00 177.48 1vvc n GLY 106 N 3.47 0.39 1.64 0.56 0.00 -1.26 -4.93 105.19 105.05 1vvc n GLY 106 Ca 0.12 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.13 1vvc n GLY 106 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1vvc n ASN 107 N 0.00 -2.66 0.00 1.61 5.15 -1.21 -4.96 115.26 113.20 1vvc n ASN 107 Ca 0.00 0.13 0.00 0.00 -0.60 0.00 0.00 54.58 54.11 1vvc n ASN 107 Cb 0.00 -1.48 0.00 0.00 -0.53 0.00 0.00 39.78 37.77 1vvc n ASN 107 CO 0.00 0.00 0.00 0.35 1.40 0.00 0.00 177.26 179.01 1vvc n THR 108 N -0.05 0.00 -3.45 -0.44 -2.24 -1.26 -4.76 114.28 102.08 1vvc n THR 108 Ca 0.00 0.00 -0.25 0.00 -2.27 0.00 0.00 64.05 61.54 1vvc n THR 108 Cb 0.01 0.00 -0.12 0.00 -2.10 0.00 0.00 70.33 68.13 1vvc n THR 108 CO 0.00 0.00 0.00 0.26 -0.57 0.00 0.00 175.07 174.76 1vvc s TRP 109 N -3.00 0.21 -0.06 4.78 0.52 -1.26 -3.90 118.94 116.22 1vvc s TRP 109 Ca 0.00 -1.01 -0.03 0.00 0.02 0.00 0.00 56.10 55.08 1vvc s TRP 109 Cb 0.00 -0.73 -0.04 0.00 -1.15 0.00 0.00 33.47 31.55 1vvc s TRP 109 CO 0.00 -0.87 0.09 0.15 0.02 0.00 0.00 176.95 176.33 1vvc s LYS 110 N 1.65 3.19 1.04 4.98 1.02 -0.87 -3.39 119.74 127.36 1vvc s LYS 110 Ca 0.14 -0.34 -0.15 0.00 0.02 0.00 0.00 55.97 55.64 1vvc s LYS 110 Cb -0.18 -2.97 0.21 0.00 -0.52 0.00 0.00 37.83 34.37 1vvc s LYS 110 CO -0.16 0.71 1.13 -1.25 -0.92 0.00 0.00 175.35 174.85 1vvc s PRO 111 N -1.29 0.09 -0.11 -1.68 0.04 -1.26 0.24 135.00 131.02 1vvc s PRO 111 Ca 0.18 0.20 -0.41 0.00 0.04 0.00 0.00 61.00 61.01 1vvc s PRO 111 Cb -0.12 -1.73 -0.20 0.00 0.04 0.00 0.00 34.50 32.50 1vvc s PRO 111 CO 0.08 -2.89 1.23 -1.91 0.04 0.00 0.00 177.00 173.55 1vvc n GLU 112 N -4.23 0.12 -1.34 4.56 4.07 -1.22 -4.74 120.64 117.86 1vvc n GLU 112 Ca 0.09 0.04 -0.43 0.00 -0.06 0.00 0.00 57.16 56.80 1vvc n GLU 112 Cb 0.59 -1.56 -0.01 0.00 -0.06 0.00 0.00 31.44 30.40 1vvc n GLU 112 CO 0.00 0.00 0.00 1.28 -0.06 0.00 0.00 177.13 178.35 1vvc n LEU 113 N 2.23 -2.11 -4.73 4.31 4.32 -1.23 -4.02 117.00 115.77 1vvc n LEU 113 Ca 0.22 0.89 -0.29 0.00 -0.02 0.00 0.00 56.01 56.81 1vvc n LEU 113 Cb 0.06 -0.93 0.15 0.00 -1.62 0.00 0.00 43.42 41.08 1vvc n LEU 113 CO 0.68 -3.76 0.67 -2.16 -1.22 0.00 0.00 177.39 171.60 1vvc s PRO 114 N -1.09 0.92 -0.24 3.23 0.04 -1.22 -4.50 135.00 132.14 1vvc s PRO 114 Ca 0.61 0.52 -0.01 0.00 0.04 0.00 0.00 61.00 62.16 1vvc s PRO 114 Cb -0.69 -1.79 0.07 0.00 0.04 0.00 0.00 34.50 32.13 1vvc s PRO 114 CO 0.61 -2.40 0.01 0.21 0.04 0.00 0.00 177.00 175.47 1vvc s LYS 115 N -5.06 1.14 -0.73 4.56 2.20 -0.03 -4.38 119.74 117.44 1vvc s LYS 115 Ca 0.64 -0.85 -0.26 0.00 -0.36 0.00 0.00 55.97 55.15 1vvc s LYS 115 Cb -0.17 -2.36 -0.07 0.00 -1.51 0.00 0.00 37.83 33.72 1vvc s LYS 115 CO 0.56 -0.69 2.16 0.00 -0.36 0.00 0.00 175.35 177.02 1vvc n VAL 117 N 8.04 0.00 -0.38 0.00 0.24 0.36 -4.70 118.33 121.89 1vvc n VAL 117 Ca 0.37 -1.11 0.00 0.00 -2.04 0.00 0.00 64.34 61.57 1vvc n VAL 117 Cb 0.48 -0.31 0.00 0.00 -1.47 0.00 0.00 33.84 32.55 1vvc n VAL 117 CO 0.00 0.00 0.00 -2.11 -2.14 0.00 0.00 176.83 172.58