#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vyn s MET 5 N 0.00 4.04 -0.05 0.00 1.00 -0.37 -4.88 119.30 119.04 1vyn s MET 5 Ca 0.00 0.09 -0.36 0.00 0.00 0.00 0.00 55.69 55.42 1vyn s MET 5 Cb 0.00 -3.64 -0.14 0.00 0.00 0.00 0.00 34.83 31.05 1vyn s MET 5 CO 0.00 -0.26 1.70 -0.35 0.00 0.00 0.00 175.02 176.11 1vyn n PRO 6 N 5.25 1.78 0.20 2.03 -0.04 -1.26 0.34 135.00 143.30 1vyn n PRO 6 Ca -0.08 0.65 0.04 0.00 -0.04 0.00 0.00 63.50 64.07 1vyn n PRO 6 Cb 0.51 -2.41 0.46 0.00 -0.04 0.00 0.00 33.50 32.02 1vyn n PRO 6 CO 0.00 0.00 0.00 0.52 -0.04 0.00 0.00 175.50 175.98 1vyn h MET 7 N 7.29 0.04 -0.41 0.54 2.86 -1.51 -0.18 114.93 123.57 1vyn h MET 7 Ca -0.47 -0.01 -0.11 0.00 -2.06 0.00 0.00 59.70 57.05 1vyn h MET 7 Cb 1.29 -0.01 -0.02 0.00 0.06 0.00 0.00 31.60 32.93 1vyn h MET 7 CO 0.91 0.24 -0.19 0.82 1.06 0.00 0.00 176.91 179.75 1vyn h ILE 8 N 0.04 1.27 -0.39 -1.22 1.08 -1.78 0.21 117.51 116.71 1vyn h ILE 8 Ca 0.01 -1.29 -0.00 0.00 -0.39 0.00 0.00 64.86 63.18 1vyn h ILE 8 Cb 0.37 1.16 -0.02 0.00 -3.07 0.00 0.00 36.82 35.26 1vyn h ILE 8 CO 0.03 0.44 0.23 -0.08 -0.69 0.00 0.00 178.15 178.07 1vyn h GLU 9 N 0.69 0.54 -0.58 2.37 4.57 -1.53 0.74 114.58 121.39 1vyn h GLU 9 Ca 0.10 -0.05 0.02 0.00 -1.18 0.00 0.00 59.36 58.25 1vyn h GLU 9 Cb 0.70 -0.11 -0.04 0.00 -0.16 0.00 0.00 28.75 29.14 1vyn h GLU 9 CO 0.05 0.42 0.36 -0.92 -1.18 0.00 0.00 179.01 177.74 1vyn h TYR 10 N 0.51 0.67 -0.24 0.92 3.20 -0.75 -1.32 116.97 119.96 1vyn h TYR 10 Ca 0.14 0.02 -0.01 0.00 3.14 0.00 0.00 58.73 62.02 1vyn h TYR 10 Cb 0.02 -0.22 -0.01 0.00 1.54 0.00 0.00 36.73 38.06 1vyn h TYR 10 CO -0.03 0.39 0.12 -0.07 -1.64 0.00 0.00 178.16 176.93 1vyn h LEU 11 N 0.71 0.30 0.30 2.82 3.38 -0.19 0.89 115.31 123.51 1vyn h LEU 11 Ca 0.23 -0.10 -0.01 0.00 0.09 0.00 0.00 57.88 58.09 1vyn h LEU 11 Cb -0.00 -0.08 -0.00 0.00 0.09 0.00 0.00 40.66 40.67 1vyn h LEU 11 CO -0.09 0.32 -0.17 -0.08 0.09 0.00 0.00 178.44 178.51 1vyn h GLU 12 N 0.26 -0.43 -0.04 1.13 4.81 -0.56 0.71 114.58 120.47 1vyn h GLU 12 Ca 0.08 0.03 -0.09 0.00 -0.13 0.00 0.00 59.36 59.26 1vyn h GLU 12 Cb 0.09 0.10 0.01 0.00 0.63 0.00 0.00 28.75 29.57 1vyn h GLU 12 CO -0.01 -0.29 -0.31 0.00 -0.73 0.00 0.00 179.01 177.67 1vyn h ARG 13 N -0.44 0.28 0.00 1.92 3.08 -1.22 -1.96 114.38 116.03 1vyn h ARG 13 Ca -0.03 -0.25 -0.39 0.00 0.07 0.00 0.00 59.98 59.38 1vyn h ARG 13 Cb 0.36 0.06 -0.06 0.00 0.08 0.00 0.00 29.97 30.41 1vyn h ARG 13 CO 0.04 0.92 -2.34 1.19 -1.07 0.00 0.00 179.97 178.71 1vyn n PHE 14 N -4.45 0.00 0.14 3.04 3.72 0.29 -3.57 117.46 116.63 1vyn n PHE 14 Ca -0.09 0.00 -0.25 0.00 -0.05 0.00 0.00 57.45 57.06 1vyn n PHE 14 Cb 0.51 -0.88 -0.16 0.00 -0.94 0.00 0.00 39.48 38.02 1vyn n PHE 14 CO 0.00 0.00 0.00 1.03 -0.05 0.00 0.00 176.76 177.74 1vyn h SER 15 N -0.58 0.82 0.22 4.37 0.87 -1.10 -3.35 113.55 114.80 1vyn h SER 15 Ca -0.58 -0.92 -0.35 0.00 -1.23 0.00 0.00 61.79 58.71 1vyn h SER 15 Cb 1.63 -0.27 -0.03 0.00 -0.44 0.00 0.00 62.40 63.29 1vyn h SER 15 CO -0.27 1.73 -1.94 0.18 -0.53 0.00 0.00 176.83 176.00 1vyn n LEU 16 N -3.70 2.15 -3.38 2.23 4.77 0.24 -4.98 117.00 114.33 1vyn n LEU 16 Ca -0.18 0.25 -0.23 0.00 -0.03 0.00 0.00 56.01 55.82 1vyn n LEU 16 Cb 1.10 -0.75 0.07 0.00 -2.33 0.00 0.00 43.42 41.51 1vyn n LEU 16 CO 0.60 0.73 0.18 0.29 -1.33 0.00 0.00 177.39 177.86 1vyn n LYS 17 N -3.35 -7.05 0.00 3.23 5.02 -0.79 -4.93 118.16 110.30 1vyn n LYS 17 Ca -0.28 0.83 0.00 0.00 -2.02 0.00 0.00 58.31 56.84 1vyn n LYS 17 Cb 1.05 -5.79 0.00 0.00 -0.02 0.00 0.00 35.03 30.27 1vyn n LYS 17 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1vyn n ALA 18 N -4.59 0.00 -2.93 7.82 0.00 -0.92 -5.04 120.51 114.85 1vyn n ALA 18 Ca -0.02 0.00 -0.33 0.00 0.00 0.00 0.00 53.44 53.09 1vyn n ALA 18 Cb 0.57 0.00 -0.13 0.00 0.00 0.00 0.00 19.45 19.89 1vyn n ALA 18 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 1vyn s LYS 19 N 1.75 3.32 0.16 0.00 2.20 -1.26 -4.49 119.74 121.42 1vyn s LYS 19 Ca 0.00 -0.63 -0.26 0.00 -0.36 0.00 0.00 55.97 54.72 1vyn s LYS 19 Cb 0.00 -2.68 -0.08 0.00 -1.51 0.00 0.00 37.83 33.56 1vyn s LYS 19 CO 0.00 0.31 0.82 -1.50 -0.36 0.00 0.00 175.35 174.62 1vyn s ILE 20 N 0.13 4.36 0.38 5.43 -1.16 -1.26 -4.90 121.20 124.17 1vyn s ILE 20 Ca -0.05 1.79 -0.13 0.00 -0.51 0.00 0.00 60.65 61.75 1vyn s ILE 20 Cb -0.14 -4.18 0.05 0.00 0.61 0.00 0.00 42.46 38.79 1vyn s ILE 20 CO 0.04 0.49 0.73 0.20 -2.81 0.00 0.00 174.94 173.59 1vyn s ASN 21 N -0.94 0.17 0.29 4.50 0.02 -1.26 -5.01 114.94 112.70 1vyn s ASN 21 Ca 0.38 -1.20 0.15 0.00 -1.02 0.00 0.00 52.86 51.17 1vyn s ASN 21 Cb -0.23 0.82 0.14 0.00 0.02 0.00 0.00 41.25 41.99 1vyn s ASN 21 CO 0.27 -1.62 1.48 -1.13 0.02 0.00 0.00 177.10 176.12 1vyn h ASN 22 N 2.02 0.00 1.00 -1.22 -0.73 -1.96 -3.28 115.58 111.41 1vyn h ASN 22 Ca -0.31 0.00 0.00 0.00 1.87 0.00 0.00 56.30 57.86 1vyn h ASN 22 Cb 1.25 0.00 0.00 0.00 0.27 0.00 0.00 38.32 39.84 1vyn h ASN 22 CO 0.40 0.50 -0.15 0.35 -0.37 0.00 0.00 177.43 178.16 1vyn n THR 23 N -3.26 0.17 -1.86 -3.57 -2.24 -1.26 -4.80 114.28 97.46 1vyn n THR 23 Ca 0.02 -0.09 -0.29 0.00 -2.27 0.00 0.00 64.05 61.42 1vyn n THR 23 Cb 0.71 -0.35 0.11 0.00 -2.10 0.00 0.00 70.33 68.70 1vyn n THR 23 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 1vyn s THR 24 N -3.04 2.00 0.00 4.28 -1.32 -1.24 -4.89 115.64 111.43 1vyn s THR 24 Ca 0.12 0.00 -0.05 0.00 -1.21 0.00 0.00 61.69 60.55 1vyn s THR 24 Cb 0.17 -2.97 -0.24 0.00 -1.51 0.00 0.00 72.50 67.94 1vyn s THR 24 CO 0.59 0.00 3.37 -0.46 -2.21 0.00 0.00 174.62 175.92 1vyn n ASN 25 N -3.42 4.93 -0.24 8.08 0.23 -1.26 -4.60 115.26 118.97 1vyn n ASN 25 Ca 0.09 -2.42 -0.01 0.00 -0.53 0.00 0.00 54.58 51.71 1vyn n ASN 25 Cb 0.61 -1.32 0.11 0.00 -2.08 0.00 0.00 39.78 37.09 1vyn n ASN 25 CO 0.00 0.00 0.00 0.25 -0.93 0.00 0.00 177.26 176.58 1vyn h LEU 26 N 4.97 0.56 -0.34 -4.53 7.12 -1.87 0.21 115.31 121.43 1vyn h LEU 26 Ca 0.17 0.03 -0.19 0.00 0.13 0.00 0.00 57.88 58.02 1vyn h LEU 26 Cb 1.41 -0.07 -0.00 0.00 -0.53 0.00 0.00 40.66 41.46 1vyn h LEU 26 CO 0.24 0.35 -0.74 -2.24 -0.13 0.00 0.00 178.44 175.92 1vyn h ASP 27 N 0.69 0.60 -0.18 1.25 2.03 -1.81 -1.59 116.42 117.40 1vyn h ASP 27 Ca 0.31 -0.39 -0.05 0.00 -0.73 0.00 0.00 57.03 56.17 1vyn h ASP 27 Cb 0.22 -0.18 -0.02 0.00 -0.83 0.00 0.00 39.33 38.52 1vyn h ASP 27 CO -0.20 1.15 -0.04 1.88 -1.03 0.00 0.00 179.24 181.00 1vyn h TYR 28 N 0.34 0.51 0.00 4.15 0.05 -1.55 -1.36 116.97 119.12 1vyn h TYR 28 Ca -0.04 -0.06 -0.13 0.00 0.05 0.00 0.00 58.73 58.55 1vyn h TYR 28 Cb 1.33 -0.15 -0.02 0.00 1.01 0.00 0.00 36.73 38.91 1vyn h TYR 28 CO 0.05 0.53 -0.64 0.77 -1.05 0.00 0.00 178.16 177.83 1vyn h SER 29 N 0.47 0.00 0.24 3.88 0.02 -0.53 -2.92 113.55 114.71 1vyn h SER 29 Ca 0.10 0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 61.05 1vyn h SER 29 Cb 0.37 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.90 1vyn h SER 29 CO 0.02 0.64 -0.21 0.03 -1.14 0.00 0.00 176.83 176.17 1vyn h ARG 30 N 0.00 -0.45 0.00 3.45 -0.00 -0.23 0.68 114.38 117.83 1vyn h ARG 30 Ca -0.01 0.03 -0.05 0.00 -0.50 0.00 0.00 59.98 59.46 1vyn h ARG 30 Cb 1.30 0.10 -0.01 0.00 0.00 0.00 0.00 29.97 31.36 1vyn h ARG 30 CO 0.08 -0.30 -0.22 -0.09 0.00 0.00 0.00 179.97 179.45 1vyn h ARG 31 N -0.47 0.00 0.00 0.04 2.43 -1.54 -0.49 114.38 114.35 1vyn h ARG 31 Ca -0.01 0.00 -0.14 0.00 -0.81 0.00 0.00 59.98 59.02 1vyn h ARG 31 Cb 0.42 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 29.95 1vyn h ARG 31 CO -0.03 0.22 -0.66 0.35 -1.51 0.00 0.00 179.97 178.34 1vyn h PHE 32 N 0.00 0.00 -0.00 2.20 3.57 -1.20 -3.09 116.94 118.42 1vyn h PHE 32 Ca -0.00 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.50 1vyn h PHE 32 Cb 0.44 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.18 1vyn h PHE 32 CO 0.00 0.66 -0.30 1.28 -2.23 0.00 0.00 178.31 177.72 1vyn n LEU 33 N -3.36 0.45 -0.04 0.59 7.99 0.23 -4.39 117.00 118.47 1vyn n LEU 33 Ca 0.01 0.08 -0.08 0.00 -0.01 0.00 0.00 56.01 56.00 1vyn n LEU 33 Cb 0.76 -0.28 -0.02 0.00 -0.11 0.00 0.00 43.42 43.77 1vyn n LEU 33 CO 0.42 0.10 0.70 -0.08 -1.51 0.00 0.00 177.39 177.03 1vyn h GLU 34 N 0.23 -0.24 0.00 3.23 4.81 -1.06 0.11 114.58 121.67 1vyn h GLU 34 Ca 0.00 0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 59.24 1vyn h GLU 34 Cb 0.48 0.05 -0.00 0.00 0.63 0.00 0.00 28.75 29.91 1vyn h GLU 34 CO 0.00 -0.16 -0.04 -1.00 -0.73 0.00 0.00 179.01 177.08 1vyn h PRO 35 N -0.25 0.00 0.13 0.92 0.13 -1.81 0.15 132.00 131.27 1vyn h PRO 35 Ca 0.13 0.00 -0.31 0.00 -0.87 0.00 0.00 66.00 64.96 1vyn h PRO 35 Cb 0.45 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.57 1vyn h PRO 35 CO -0.37 0.04 -1.50 0.35 -0.23 0.00 0.00 178.00 176.30 1vyn h PHE 36 N 0.00 0.50 0.00 1.56 3.57 -1.39 -3.29 116.94 117.89 1vyn h PHE 36 Ca -0.00 -0.36 -0.10 0.00 3.53 0.00 0.00 57.97 61.03 1vyn h PHE 36 Cb 0.34 -0.02 -0.02 0.00 2.79 0.00 0.00 35.95 39.04 1vyn h PHE 36 CO 0.00 1.39 -0.52 -0.07 -2.23 0.00 0.00 178.31 176.88 1vyn h LEU 37 N 0.07 0.00 -8.33 0.59 4.07 -0.58 -3.44 115.31 107.70 1vyn h LEU 37 Ca -0.23 0.00 -0.24 0.00 0.08 0.00 0.00 57.88 57.49 1vyn h LEU 37 Cb 2.02 0.00 -0.02 0.00 1.08 0.00 0.00 40.66 43.74 1vyn h LEU 37 CO 0.17 0.49 0.96 -1.14 -1.08 0.00 0.00 178.44 177.85 1vyn n ARG 38 N -3.21 0.56 0.00 1.13 0.63 0.01 -2.03 116.66 113.75 1vyn n ARG 38 Ca 0.02 -0.40 0.00 0.00 -0.92 0.00 0.00 57.85 56.55 1vyn n ARG 38 Cb 0.73 -3.01 0.00 0.00 0.45 0.00 0.00 32.46 30.64 1vyn n ARG 38 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1vyn n GLY 39 N 6.35 1.06 3.66 5.14 0.00 0.93 -4.95 105.19 117.38 1vyn n GLY 39 Ca 0.49 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 46.22 1vyn n GLY 39 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1vyn s ILE 40 N -2.00 1.21 -0.03 -0.61 -4.36 -0.86 -4.94 121.20 109.60 1vyn s ILE 40 Ca 0.00 -2.00 0.04 0.00 -0.26 0.00 0.00 60.65 58.43 1vyn s ILE 40 Cb 0.00 -2.41 -0.00 0.00 1.25 0.00 0.00 42.46 41.30 1vyn s ILE 40 CO 0.00 0.00 -0.14 0.54 0.24 0.00 0.00 174.94 175.58 1vyn s ASN 41 N -3.76 1.79 0.04 4.36 2.20 -1.26 0.20 114.94 118.51 1vyn s ASN 41 Ca 0.18 -0.29 0.04 0.00 -0.94 0.00 0.00 52.86 51.84 1vyn s ASN 41 Cb 0.04 -0.46 -0.02 0.00 -2.00 0.00 0.00 41.25 38.81 1vyn s ASN 41 CO 0.09 0.12 -0.11 0.68 -2.94 0.00 0.00 177.10 174.95 1vyn s VAL 42 N 0.06 0.82 -0.45 3.54 -7.23 -0.09 -4.53 120.40 112.52 1vyn s VAL 42 Ca -0.03 -0.96 -0.22 0.00 -1.81 0.00 0.00 61.98 58.96 1vyn s VAL 42 Cb -0.10 -0.79 0.03 0.00 0.56 0.00 0.00 36.38 36.08 1vyn s VAL 42 CO 0.01 -0.14 0.74 -0.69 -0.31 0.00 0.00 175.10 174.72 1vyn s VAL 43 N -0.98 4.70 -0.48 1.32 1.01 0.12 -0.23 120.40 125.87 1vyn s VAL 43 Ca -0.03 0.31 -0.23 0.00 0.00 0.00 0.00 61.98 62.03 1vyn s VAL 43 Cb -0.08 -4.29 0.03 0.00 0.00 0.00 0.00 36.38 32.04 1vyn s VAL 43 CO 0.01 -0.69 0.79 -0.47 0.00 0.00 0.00 175.10 174.74 1vyn s TYR 44 N 3.15 2.96 -0.52 5.22 5.04 0.85 -0.23 117.35 133.82 1vyn s TYR 44 Ca 0.27 0.03 -0.20 0.00 -2.44 0.00 0.00 57.07 54.73 1vyn s TYR 44 Cb -0.13 -3.72 0.06 0.00 0.35 0.00 0.00 41.96 38.52 1vyn s TYR 44 CO 0.21 -1.07 0.67 0.99 -1.34 0.00 0.00 175.55 175.02 1vyn s THR 45 N 3.33 4.81 0.12 4.34 2.01 -0.51 -0.93 115.64 128.81 1vyn s THR 45 Ca 0.28 -0.41 -0.28 0.00 0.31 0.00 0.00 61.69 61.59 1vyn s THR 45 Cb -0.13 -4.34 -0.07 0.00 0.01 0.00 0.00 72.50 67.98 1vyn s THR 45 CO 0.20 -0.86 0.88 -2.84 -0.69 0.00 0.00 174.62 171.32 1vyn s PRO 46 N 2.81 4.65 0.54 4.92 0.02 -1.26 -4.84 135.00 141.84 1vyn s PRO 46 Ca 0.17 1.31 -0.21 0.00 0.02 0.00 0.00 61.00 62.29 1vyn s PRO 46 Cb -0.18 -3.34 -0.06 0.00 0.02 0.00 0.00 34.50 30.93 1vyn s PRO 46 CO 0.13 0.33 1.11 -2.30 -0.33 0.00 0.00 177.00 175.94 1vyn n PRO 47 N 2.40 1.29 0.13 5.54 -0.02 -1.26 -4.82 135.00 138.27 1vyn n PRO 47 Ca -0.01 0.48 0.10 0.00 -2.02 0.00 0.00 63.50 62.05 1vyn n PRO 47 Cb 0.49 -2.28 0.50 0.00 -0.02 0.00 0.00 33.50 32.19 1vyn n PRO 47 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 1vyn n GLN 48 N -0.71 0.13 0.01 -0.52 6.02 -1.26 -0.45 117.38 120.61 1vyn n GLN 48 Ca 0.11 0.56 0.11 0.00 -0.01 0.00 0.00 57.00 57.78 1vyn n GLN 48 Cb 0.44 -1.88 0.49 0.00 1.02 0.00 0.00 30.24 30.31 1vyn n GLN 48 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 177.06 174.92 1vyn n SER 49 N -2.16 0.04 0.06 1.08 3.41 -1.26 -2.69 113.62 112.10 1vyn n SER 49 Ca -0.00 0.51 0.07 0.00 -0.26 0.00 0.00 58.87 59.18 1vyn n SER 49 Cb 0.08 -0.52 -0.05 0.00 -0.26 0.00 0.00 64.21 63.46 1vyn n SER 49 CO 0.00 0.00 0.00 0.49 -0.16 0.00 0.00 175.04 175.37 1vyn n PHE 50 N -1.54 0.86 -2.79 7.33 3.01 0.41 -4.97 117.46 119.76 1vyn n PHE 50 Ca 0.05 0.26 -0.17 0.00 1.01 0.00 0.00 57.45 58.61 1vyn n PHE 50 Cb 0.27 -0.96 0.02 0.00 -0.01 0.00 0.00 39.48 38.81 1vyn n PHE 50 CO 0.00 0.00 0.00 0.94 1.01 0.00 0.00 176.76 178.71 1vyn n GLN 51 N -2.71 -3.50 -5.07 -1.08 7.27 -1.10 -5.01 117.38 106.17 1vyn n GLN 51 Ca -0.05 0.68 -0.29 0.00 0.07 0.00 0.00 57.00 57.42 1vyn n GLN 51 Cb 0.67 -5.06 -0.15 0.00 2.41 0.00 0.00 30.24 28.10 1vyn n GLN 51 CO 0.00 0.00 0.00 -1.12 0.07 0.00 0.00 177.06 176.01 1vyn s SER 52 N -2.75 2.83 0.16 1.69 0.01 -1.26 -5.13 113.70 109.25 1vyn s SER 52 Ca 0.21 -0.47 -0.18 0.00 1.31 0.00 0.00 55.95 56.82 1vyn s SER 52 Cb -0.09 -0.30 -0.07 0.00 0.21 0.00 0.00 66.02 65.77 1vyn s SER 52 CO 0.26 0.27 0.63 0.00 0.41 0.00 0.00 173.24 174.81 1vyn s ALA 53 N -0.63 3.51 -0.51 1.44 0.00 -1.26 -4.47 121.76 119.83 1vyn s ALA 53 Ca 0.09 0.03 -0.43 0.00 0.00 0.00 0.00 51.96 51.65 1vyn s ALA 53 Cb -0.09 -2.67 -0.19 0.00 0.00 0.00 0.00 23.12 20.17 1vyn s ALA 53 CO -0.00 0.39 2.16 -2.30 0.00 0.00 0.00 175.76 176.02 1vyn n PRO 54 N 0.96 0.05 -4.87 0.00 -0.02 -1.26 -4.78 135.00 125.08 1vyn n PRO 54 Ca -0.05 0.01 -0.33 0.00 -2.02 0.00 0.00 63.50 61.12 1vyn n PRO 54 Cb 0.51 -1.55 -0.14 0.00 -0.02 0.00 0.00 33.50 32.30 1vyn n PRO 54 CO 0.00 0.00 0.00 0.50 1.98 0.00 0.00 175.50 177.98 1vyn s ARG 55 N 6.13 3.03 -0.27 -0.52 3.00 -0.11 -4.87 118.95 125.34 1vyn s ARG 55 Ca 1.20 -0.71 -0.27 0.00 -1.00 0.00 0.00 55.73 54.95 1vyn s ARG 55 Cb -1.46 -2.50 0.01 0.00 0.00 0.00 0.00 34.95 30.99 1vyn s ARG 55 CO 0.65 0.36 0.95 0.14 0.00 0.00 0.00 175.30 177.40 1vyn s VAL 56 N -0.04 4.70 -0.03 7.11 -7.23 -1.26 -0.11 120.40 123.54 1vyn s VAL 56 Ca -0.04 1.71 0.03 0.00 -1.81 0.00 0.00 61.98 61.87 1vyn s VAL 56 Cb -0.14 -4.26 -0.03 0.00 0.56 0.00 0.00 36.38 32.51 1vyn s VAL 56 CO 0.04 -0.23 -0.09 -0.31 -0.31 0.00 0.00 175.10 174.20 1vyn s TYR 57 N 3.17 2.85 -0.26 2.82 2.02 0.68 -4.93 117.35 123.71 1vyn s TYR 57 Ca 0.40 -0.05 -0.15 0.00 -0.37 0.00 0.00 57.07 56.90 1vyn s TYR 57 Cb -0.14 -1.65 -0.04 0.00 -0.40 0.00 0.00 41.96 39.74 1vyn s TYR 57 CO 0.09 0.31 0.40 0.50 -1.57 0.00 0.00 175.55 175.29 1vyn s ARG 58 N -1.04 4.04 -0.31 -0.62 3.00 -1.26 -0.91 118.95 121.85 1vyn s ARG 58 Ca 0.14 0.10 -0.27 0.00 -1.00 0.00 0.00 55.73 54.71 1vyn s ARG 58 Cb -0.11 -3.64 0.01 0.00 0.00 0.00 0.00 34.95 31.21 1vyn s ARG 58 CO 0.04 -0.27 0.95 0.08 0.00 0.00 0.00 175.30 176.09 1vyn s VAL 59 N 2.04 4.65 0.16 7.11 1.01 0.13 -0.43 120.40 135.07 1vyn s VAL 59 Ca 0.16 1.52 0.03 0.00 0.00 0.00 0.00 61.98 63.69 1vyn s VAL 59 Cb -0.16 -4.29 -0.16 0.00 0.00 0.00 0.00 36.38 31.78 1vyn s VAL 59 CO 0.10 -0.35 1.37 -1.13 0.00 0.00 0.00 175.10 175.08 1vyn h ASN 60 N 8.05 0.24 0.00 3.32 -0.73 -1.57 0.27 115.58 125.16 1vyn h ASN 60 Ca -0.22 -0.20 0.00 0.00 1.87 0.00 0.00 56.30 57.75 1vyn h ASN 60 Cb 1.08 -0.08 0.00 0.00 0.27 0.00 0.00 38.32 39.59 1vyn h ASN 60 CO 0.96 1.01 0.00 0.61 -0.37 0.00 0.00 177.43 179.65 1vyn n GLY 61 N 0.91 -0.55 3.40 1.57 0.00 -1.01 -4.07 105.19 105.43 1vyn n GLY 61 Ca -0.04 -0.58 -0.24 0.00 0.00 0.00 0.00 46.02 45.17 1vyn n GLY 61 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1vyn s LEU 62 N 0.00 2.49 0.83 0.99 1.43 -1.26 -1.38 118.68 121.77 1vyn s LEU 62 Ca 0.00 -0.92 -0.09 0.00 -1.03 0.00 0.00 54.13 52.09 1vyn s LEU 62 Cb 0.00 -0.98 0.15 0.00 0.03 0.00 0.00 46.19 45.38 1vyn s LEU 62 CO 0.00 0.02 1.16 -0.94 0.23 0.00 0.00 176.35 176.81 1vyn s SER 63 N -2.94 3.88 0.14 2.29 1.04 -0.22 -4.81 113.70 113.07 1vyn s SER 63 Ca 0.21 0.13 -0.13 0.00 0.48 0.00 0.00 55.95 56.64 1vyn s SER 63 Cb -0.06 -0.41 -0.01 0.00 0.10 0.00 0.00 66.02 65.64 1vyn s SER 63 CO 0.10 -2.21 1.56 0.08 0.98 0.00 0.00 173.24 173.74 1vyn h ARG 64 N -1.08 0.81 -4.72 4.02 0.11 -2.00 -3.43 114.38 108.09 1vyn h ARG 64 Ca -0.42 -0.29 -0.25 0.00 0.10 0.00 0.00 59.98 59.13 1vyn h ARG 64 Cb 1.26 -0.06 -0.15 0.00 1.11 0.00 0.00 29.97 32.13 1vyn h ARG 64 CO 0.44 0.90 -0.70 0.00 0.10 0.00 0.00 179.97 180.71 1vyn s ALA 65 N -4.88 1.03 0.71 0.08 0.00 -1.26 -5.04 121.76 112.40 1vyn s ALA 65 Ca -0.12 -1.33 -0.16 0.00 0.00 0.00 0.00 51.96 50.35 1vyn s ALA 65 Cb 0.11 0.13 0.03 0.00 0.00 0.00 0.00 23.12 23.39 1vyn s ALA 65 CO 0.82 -0.19 1.22 -2.14 0.00 0.00 0.00 175.76 175.47 1vyn s PRO 66 N -3.64 2.22 0.66 0.00 0.02 -1.26 -3.41 135.00 129.59 1vyn s PRO 66 Ca 0.11 1.81 0.44 0.00 0.02 0.00 0.00 61.00 63.38 1vyn s PRO 66 Cb 0.04 -1.84 2.40 0.00 0.02 0.00 0.00 34.50 35.12 1vyn s PRO 66 CO -0.03 -1.79 2.36 0.00 -0.33 0.00 0.00 177.00 177.21 1vyn h ALA 67 N -0.14 1.00 0.00 -1.55 0.00 -1.22 0.39 119.26 117.74 1vyn h ALA 67 Ca -0.48 0.00 -0.06 0.00 0.00 0.00 0.00 54.91 54.37 1vyn h ALA 67 Cb 1.30 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 19.08 1vyn h ALA 67 CO 0.50 0.00 -0.29 0.77 0.00 0.00 0.00 179.25 180.24 1vyn h SER 68 N 0.00 0.00 0.00 0.00 0.02 -1.81 -0.82 113.55 110.95 1vyn h SER 68 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1vyn h SER 68 Cb 0.02 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.56 1vyn h SER 68 CO 0.00 0.29 -0.10 -0.24 -1.14 0.00 0.00 176.83 175.64 1vyn n SER 69 N -3.47 0.50 -4.64 3.07 2.88 -0.27 -4.83 113.62 106.86 1vyn n SER 69 Ca -0.00 -0.40 -0.43 0.00 -1.33 0.00 0.00 58.87 56.71 1vyn n SER 69 Cb 0.46 0.89 -0.02 0.00 -0.75 0.00 0.00 64.21 64.79 1vyn n SER 69 CO 0.00 0.00 0.00 -0.70 -1.23 0.00 0.00 175.04 173.11 1vyn s GLU 70 N -0.99 4.02 -0.01 -1.46 2.56 -0.03 -4.98 118.70 117.81 1vyn s GLU 70 Ca 0.00 1.43 -0.03 0.00 0.00 0.00 0.00 54.97 56.37 1vyn s GLU 70 Cb 0.00 -3.85 -0.04 0.00 2.00 0.00 0.00 34.13 32.24 1vyn s GLU 70 CO 0.00 -0.98 0.19 0.95 -0.56 0.00 0.00 175.26 174.85 1vyn s THR 71 N 4.11 5.43 -0.02 -1.70 -4.23 -1.26 -2.58 115.64 115.40 1vyn s THR 71 Ca 0.57 -0.15 -0.15 0.00 -1.18 0.00 0.00 61.69 60.77 1vyn s THR 71 Cb -0.19 -3.54 0.03 0.00 1.34 0.00 0.00 72.50 70.13 1vyn s THR 71 CO 0.20 0.32 0.33 0.72 -0.54 0.00 0.00 174.62 175.66 1vyn s PHE 72 N -1.33 -0.21 -0.45 3.99 -0.71 -0.54 -4.94 117.98 113.80 1vyn s PHE 72 Ca 0.27 0.34 -0.22 0.00 -1.04 0.00 0.00 56.93 56.29 1vyn s PHE 72 Cb -0.13 0.11 0.03 0.00 -1.21 0.00 0.00 43.02 41.82 1vyn s PHE 72 CO 0.19 -0.39 0.70 -2.00 -1.34 0.00 0.00 175.22 172.37 1vyn s GLU 73 N -1.25 3.32 -0.12 1.99 2.12 -1.26 -1.89 118.70 121.61 1vyn s GLU 73 Ca -0.13 -0.28 -0.00 0.00 0.36 0.00 0.00 54.97 54.92 1vyn s GLU 73 Cb -0.05 -3.95 0.02 0.00 0.26 0.00 0.00 34.13 30.42 1vyn s GLU 73 CO 0.04 -1.06 -0.09 -1.58 -0.54 0.00 0.00 175.26 172.04 1vyn s HIS 74 N 3.00 1.60 -1.57 5.30 2.46 0.10 -4.65 115.29 121.53 1vyn s HIS 74 Ca 0.25 -0.83 0.00 0.00 0.47 0.00 0.00 55.06 54.96 1vyn s HIS 74 Cb -0.13 -1.29 0.00 0.00 -0.13 0.00 0.00 32.58 31.02 1vyn s HIS 74 CO 0.20 -0.54 0.00 -0.25 -2.47 0.00 0.00 174.74 171.68 1vyn n ASP 75 N 4.91 -4.80 0.00 9.88 9.92 -1.26 -1.25 116.55 133.95 1vyn n ASP 75 Ca -0.13 0.33 0.00 0.00 -0.53 0.00 0.00 54.79 54.45 1vyn n ASP 75 Cb 0.50 -3.67 0.00 0.00 -0.64 0.00 0.00 41.12 37.31 1vyn n ASP 75 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1vyn n GLY 76 N -1.10 0.93 3.46 0.44 0.00 -1.26 -5.03 105.19 102.62 1vyn n GLY 76 Ca -0.16 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.53 1vyn n GLY 76 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1vyn s LYS 77 N -0.38 3.52 -0.36 1.61 -0.14 -0.38 -5.05 119.74 118.56 1vyn s LYS 77 Ca 0.00 -0.58 -0.20 0.00 -1.36 0.00 0.00 55.97 53.83 1vyn s LYS 77 Cb 0.00 -2.80 0.00 0.00 -1.68 0.00 0.00 37.83 33.36 1vyn s LYS 77 CO 0.00 0.26 0.63 0.15 -0.76 0.00 0.00 175.35 175.64 1vyn s LYS 78 N 0.27 3.67 0.44 1.68 1.02 -1.25 0.01 119.74 125.58 1vyn s LYS 78 Ca -0.05 0.04 0.03 0.00 0.02 0.00 0.00 55.97 56.01 1vyn s LYS 78 Cb -0.15 -3.81 -0.03 0.00 -0.52 0.00 0.00 37.83 33.33 1vyn s LYS 78 CO 0.04 -0.74 0.07 0.14 -0.92 0.00 0.00 175.35 173.94 1vyn s VAL 79 N 2.70 0.93 -0.05 3.17 -7.23 -0.79 -4.85 120.40 114.28 1vyn s VAL 79 Ca 0.24 -2.00 -0.02 0.00 -1.81 0.00 0.00 61.98 58.39 1vyn s VAL 79 Cb -0.14 -2.35 -0.04 0.00 0.56 0.00 0.00 36.38 34.41 1vyn s VAL 79 CO 0.15 0.00 0.09 0.42 -0.31 0.00 0.00 175.10 175.45 1vyn s THR 80 N -3.07 4.89 0.44 5.32 -4.23 -1.26 -1.47 115.64 116.26 1vyn s THR 80 Ca 0.19 -0.20 0.10 0.00 -1.18 0.00 0.00 61.69 60.59 1vyn s THR 80 Cb 0.03 -3.18 0.26 0.00 1.34 0.00 0.00 72.50 70.95 1vyn s THR 80 CO 0.11 0.47 2.07 0.40 -0.54 0.00 0.00 174.62 177.12 1vyn h ILE 81 N 3.56 1.08 0.14 2.99 2.04 -1.22 0.18 117.51 126.28 1vyn h ILE 81 Ca -0.51 -0.20 -0.01 0.00 1.00 0.00 0.00 64.86 65.15 1vyn h ILE 81 Cb 1.20 0.70 0.00 0.00 -0.74 0.00 0.00 36.82 37.98 1vyn h ILE 81 CO 0.60 0.09 -0.07 0.00 0.00 0.00 0.00 178.15 178.77 1vyn h ALA 82 N 1.80 -0.19 0.00 1.87 0.00 -1.47 -0.50 119.26 120.77 1vyn h ALA 82 Ca 0.10 -0.13 -0.11 0.00 0.00 0.00 0.00 54.91 54.77 1vyn h ALA 82 Cb -0.00 0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 1vyn h ALA 82 CO -0.02 -0.50 -0.51 0.77 0.00 0.00 0.00 179.25 178.99 1vyn h SER 83 N -0.41 0.00 -0.35 0.00 0.02 -1.74 -0.74 113.55 110.32 1vyn h SER 83 Ca -0.02 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 60.92 1vyn h SER 83 Cb 0.33 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 62.85 1vyn h SER 83 CO 0.03 0.51 0.17 0.22 -1.14 0.00 0.00 176.83 176.63 1vyn h TYR 84 N 0.00 0.51 -0.09 3.45 3.20 -0.51 -0.39 116.97 123.13 1vyn h TYR 84 Ca -0.01 -0.02 -0.22 0.00 3.14 0.00 0.00 58.73 61.62 1vyn h TYR 84 Cb 0.92 -0.16 0.01 0.00 1.54 0.00 0.00 36.73 39.04 1vyn h TYR 84 CO 0.00 0.44 -0.83 0.74 -1.64 0.00 0.00 178.16 176.86 1vyn h PHE 85 N 0.43 0.91 -0.25 -3.82 -1.00 -0.91 -2.27 116.94 110.04 1vyn h PHE 85 Ca 0.12 -0.43 0.05 0.00 2.81 0.00 0.00 57.97 60.53 1vyn h PHE 85 Cb 0.12 -0.13 -0.05 0.00 3.61 0.00 0.00 35.95 39.50 1vyn h PHE 85 CO -0.02 1.24 -0.09 0.45 -1.61 0.00 0.00 178.31 178.29 1vyn h HIS 86 N 0.43 -0.20 0.00 -0.55 3.86 -0.96 0.24 115.15 117.97 1vyn h HIS 86 Ca -0.07 0.02 -0.02 0.00 -1.16 0.00 0.00 60.37 59.15 1vyn h HIS 86 Cb 1.46 0.13 -0.00 0.00 1.06 0.00 0.00 27.41 30.05 1vyn h HIS 86 CO 0.08 -0.14 -0.08 0.77 0.86 0.00 0.00 177.93 179.42 1vyn h SER 87 N -0.04 0.00 -0.18 2.45 0.02 -1.13 -1.92 113.55 112.76 1vyn h SER 87 Ca 0.12 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.07 1vyn h SER 87 Cb 0.23 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.77 1vyn h SER 87 CO -0.28 0.08 0.00 -1.14 -1.14 0.00 0.00 176.83 174.35 1vyn n ARG 88 N -3.16 1.64 -2.66 3.45 3.00 -0.57 -4.87 116.66 113.49 1vyn n ARG 88 Ca 0.02 -0.73 -0.11 0.00 -0.00 0.00 0.00 57.85 57.03 1vyn n ARG 88 Cb 0.43 -1.34 0.02 0.00 0.00 0.00 0.00 32.46 31.56 1vyn n ARG 88 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.63 177.72 1vyn n ASN 89 N 0.09 -3.83 -3.50 6.15 5.03 -0.72 -4.66 115.26 113.81 1vyn n ASN 89 Ca 0.07 -0.15 -0.29 0.00 0.87 0.00 0.00 54.58 55.08 1vyn n ASN 89 Cb 0.28 -2.71 -0.14 0.00 -1.02 0.00 0.00 39.78 36.19 1vyn n ASN 89 CO 0.00 0.00 0.00 -0.47 -1.83 0.00 0.00 177.26 174.96 1vyn s TYR 90 N -2.86 0.52 -0.39 3.10 5.04 0.75 -4.97 117.35 118.53 1vyn s TYR 90 Ca 0.16 -1.24 -0.28 0.00 -2.44 0.00 0.00 57.07 53.26 1vyn s TYR 90 Cb -0.07 -0.91 -0.00 0.00 0.35 0.00 0.00 41.96 41.32 1vyn s TYR 90 CO 0.20 -0.83 1.59 -1.25 -1.34 0.00 0.00 175.55 173.91 1vyn s PRO 91 N 1.60 3.43 0.20 4.97 0.04 -1.26 -2.96 135.00 141.02 1vyn s PRO 91 Ca 0.13 1.11 -0.32 0.00 0.04 0.00 0.00 61.00 61.95 1vyn s PRO 91 Cb -0.19 -4.11 -0.13 0.00 0.04 0.00 0.00 34.50 30.10 1vyn s PRO 91 CO -0.19 -1.75 1.53 1.28 0.04 0.00 0.00 177.00 177.92 1vyn n LEU 92 N 9.60 3.26 0.18 -3.56 4.77 -1.26 -4.88 117.00 125.11 1vyn n LEU 92 Ca 0.19 1.11 0.09 0.00 -0.03 0.00 0.00 56.01 57.37 1vyn n LEU 92 Cb 0.48 -1.45 0.10 0.00 -2.33 0.00 0.00 43.42 40.22 1vyn n LEU 92 CO 0.70 -0.29 0.59 0.11 -1.33 0.00 0.00 177.39 177.17 1vyn h LYS 93 N 5.28 0.00 -1.91 3.23 1.57 -2.02 -3.37 116.57 119.34 1vyn h LYS 93 Ca -0.45 0.00 -0.53 0.00 -1.87 0.00 0.00 60.65 57.80 1vyn h LYS 93 Cb 1.26 0.00 -0.37 0.00 0.08 0.00 0.00 32.23 33.20 1vyn h LYS 93 CO 0.84 0.15 -1.03 1.19 -0.57 0.00 0.00 179.45 180.03 1vyn n PHE 94 N -3.08 -0.75 0.26 -1.35 3.72 -1.26 -4.82 117.46 110.17 1vyn n PHE 94 Ca 0.03 -3.34 0.15 0.00 -0.05 0.00 0.00 57.45 54.23 1vyn n PHE 94 Cb 0.60 -0.06 0.61 0.00 -0.94 0.00 0.00 39.48 39.69 1vyn n PHE 94 CO 0.00 0.00 0.00 -1.35 -0.05 0.00 0.00 176.76 175.36 1vyn h PRO 95 N 4.33 0.00 -0.93 -1.08 0.11 -1.98 -3.22 132.00 129.23 1vyn h PRO 95 Ca 0.09 0.00 -0.17 0.00 0.11 0.00 0.00 66.00 66.03 1vyn h PRO 95 Cb 0.90 0.00 -0.10 0.00 0.11 0.00 0.00 31.00 31.91 1vyn h PRO 95 CO 0.43 0.08 0.21 1.04 -0.21 0.00 0.00 178.00 179.55 1vyn n GLN 96 N -3.23 2.07 -4.06 1.05 6.02 -1.26 -2.74 117.38 115.24 1vyn n GLN 96 Ca 0.00 -1.52 -0.24 0.00 -0.01 0.00 0.00 57.00 55.23 1vyn n GLN 96 Cb 0.35 -1.69 -0.04 0.00 1.02 0.00 0.00 30.24 29.88 1vyn n GLN 96 CO 0.00 0.00 0.00 -0.48 -1.01 0.00 0.00 177.06 175.57 1vyn s LEU 97 N -1.54 3.96 0.34 1.08 0.05 -1.22 -4.49 118.68 116.86 1vyn s LEU 97 Ca 0.28 -0.09 -0.29 0.00 0.05 0.00 0.00 54.13 54.08 1vyn s LEU 97 Cb 0.23 -2.53 -0.11 0.00 -2.05 0.00 0.00 46.19 41.73 1vyn s LEU 97 CO 0.06 0.02 1.47 -1.00 -0.55 0.00 0.00 176.35 176.35 1vyn s HIS 98 N -1.88 2.74 0.11 3.48 3.76 -1.26 -1.87 115.29 120.37 1vyn s HIS 98 Ca 0.32 1.13 -0.30 0.00 -0.15 0.00 0.00 55.06 56.07 1vyn s HIS 98 Cb -0.09 -3.95 -0.06 0.00 1.11 0.00 0.00 32.58 29.59 1vyn s HIS 98 CO 0.25 -2.85 1.00 0.00 -0.85 0.00 0.00 174.74 172.29 1vyn s LEU 100 N 0.12 4.36 -0.52 0.00 2.96 0.11 -1.06 118.68 124.66 1vyn s LEU 100 Ca 0.49 2.49 -0.03 0.00 -0.22 0.00 0.00 54.13 56.86 1vyn s LEU 100 Cb -0.24 -3.58 0.13 0.00 0.50 0.00 0.00 46.19 43.00 1vyn s LEU 100 CO 0.30 -0.82 0.33 0.21 -1.32 0.00 0.00 176.35 175.05 1vyn s ASN 101 N 1.69 5.30 0.32 3.68 2.47 -0.48 -1.46 114.94 126.46 1vyn s ASN 101 Ca 0.70 -2.40 0.05 0.00 0.42 0.00 0.00 52.86 51.64 1vyn s ASN 101 Cb -0.40 -1.86 -0.02 0.00 -1.45 0.00 0.00 41.25 37.52 1vyn s ASN 101 CO 0.31 -0.48 0.46 0.68 -3.72 0.00 0.00 177.10 174.35 1vyn s VAL 102 N 0.61 4.44 0.00 -5.21 -7.23 -0.25 -2.26 120.40 110.50 1vyn s VAL 102 Ca 0.12 -0.94 0.00 0.00 -1.81 0.00 0.00 61.98 59.36 1vyn s VAL 102 Cb -0.22 -3.56 0.00 0.00 0.56 0.00 0.00 36.38 33.16 1vyn s VAL 102 CO -0.04 -0.23 0.00 0.61 -0.31 0.00 0.00 175.10 175.13 1vyn n GLY 103 N -1.62 -1.82 3.90 2.32 0.00 0.43 -1.35 105.19 107.05 1vyn n GLY 103 Ca -0.03 -1.78 -0.29 0.00 0.00 0.00 0.00 46.02 43.92 1vyn n GLY 103 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1vyn s SER 104 N -4.00 6.47 0.00 1.61 0.01 -1.25 -3.93 113.70 112.61 1vyn s SER 104 Ca 0.00 0.67 0.09 0.00 1.31 0.00 0.00 55.95 58.01 1vyn s SER 104 Cb 0.00 -2.12 0.41 0.00 0.21 0.00 0.00 66.02 64.51 1vyn s SER 104 CO 0.00 -0.11 1.19 -1.54 0.41 0.00 0.00 173.24 173.19 1vyn n SER 105 N -0.60 0.00 0.07 2.44 3.41 -1.26 -0.79 113.62 116.89 1vyn n SER 105 Ca -0.02 0.29 -0.08 0.00 -0.26 0.00 0.00 58.87 58.80 1vyn n SER 105 Cb 0.53 -0.36 -0.09 0.00 -0.26 0.00 0.00 64.21 64.02 1vyn n SER 105 CO 0.00 0.00 0.00 0.16 -0.16 0.00 0.00 175.04 175.04 1vyn h ILE 106 N 0.00 1.66 -3.05 -1.33 3.07 -1.99 -3.42 117.51 112.44 1vyn h ILE 106 Ca 0.00 -3.23 -0.50 0.00 1.55 0.00 0.00 64.86 62.68 1vyn h ILE 106 Cb 0.10 2.79 -0.40 0.00 -0.27 0.00 0.00 36.82 39.04 1vyn h ILE 106 CO 0.00 0.93 -0.76 -0.54 -1.05 0.00 0.00 178.15 176.73 1vyn s LYS 107 N -2.80 0.27 -0.19 0.16 -0.14 0.03 -5.12 119.74 111.95 1vyn s LYS 107 Ca -0.00 -0.33 -0.23 0.00 -1.36 0.00 0.00 55.97 54.05 1vyn s LYS 107 Cb 0.10 -1.75 -0.02 0.00 -1.68 0.00 0.00 37.83 34.48 1vyn s LYS 107 CO 0.83 -0.77 0.71 -1.54 -0.76 0.00 0.00 175.35 173.82 1vyn s SER 108 N 2.03 6.79 -0.40 2.83 1.04 -1.25 -3.80 113.70 120.93 1vyn s SER 108 Ca 0.03 0.96 -0.16 0.00 0.48 0.00 0.00 55.95 57.27 1vyn s SER 108 Cb -0.16 -2.39 0.01 0.00 0.10 0.00 0.00 66.02 63.58 1vyn s SER 108 CO -0.16 -0.33 0.36 -0.63 0.98 0.00 0.00 173.24 173.46 1vyn s ILE 109 N 2.03 5.18 -0.22 -1.02 1.01 -0.46 -4.98 121.20 122.75 1vyn s ILE 109 Ca 0.32 -0.40 -0.08 0.00 0.00 0.00 0.00 60.65 60.49 1vyn s ILE 109 Cb -0.16 -3.94 -0.04 0.00 0.01 0.00 0.00 42.46 38.34 1vyn s ILE 109 CO 0.11 -0.30 0.07 -0.76 0.00 0.00 0.00 174.94 174.07 1vyn s LEU 110 N 1.91 3.65 -0.01 2.97 1.43 -1.26 -1.09 118.68 126.27 1vyn s LEU 110 Ca 0.09 -0.06 -0.18 0.00 -1.03 0.00 0.00 54.13 52.94 1vyn s LEU 110 Cb -0.18 -1.95 0.03 0.00 0.03 0.00 0.00 46.19 44.12 1vyn s LEU 110 CO 0.12 0.06 0.40 -1.48 0.23 0.00 0.00 176.35 175.67 1vyn s LEU 111 N 1.06 0.50 0.38 1.79 2.34 -0.53 -4.95 118.68 119.27 1vyn s LEU 111 Ca 0.04 0.20 -0.24 0.00 0.06 0.00 0.00 54.13 54.19 1vyn s LEU 111 Cb -0.14 1.58 -0.10 0.00 -0.56 0.00 0.00 46.19 46.97 1vyn s LEU 111 CO 0.03 -0.51 0.98 -2.16 -1.06 0.00 0.00 176.35 173.63 1vyn s PRO 112 N -1.45 4.34 0.07 1.48 0.04 -1.26 0.09 135.00 138.30 1vyn s PRO 112 Ca -0.12 1.33 0.20 0.00 0.04 0.00 0.00 61.00 62.45 1vyn s PRO 112 Cb -0.04 -2.54 0.82 0.00 0.04 0.00 0.00 34.50 32.79 1vyn s PRO 112 CO 0.05 0.05 1.62 1.51 0.04 0.00 0.00 177.00 180.27 1vyn n ILE 113 N 0.00 0.76 0.16 0.56 0.13 -1.26 -2.64 119.36 117.08 1vyn n ILE 113 Ca 0.04 0.16 0.07 0.00 -1.10 0.00 0.00 62.75 61.93 1vyn n ILE 113 Cb 0.51 -0.92 0.56 0.00 -0.84 0.00 0.00 39.64 38.95 1vyn n ILE 113 CO 0.00 0.00 0.00 -0.08 2.80 0.00 0.00 176.55 179.27 1vyn h GLU 114 N 0.00 0.20 -0.66 9.51 4.57 -1.95 -1.46 114.58 124.78 1vyn h GLU 114 Ca 0.00 -0.01 -0.01 0.00 -1.18 0.00 0.00 59.36 58.16 1vyn h GLU 114 Cb 0.35 -0.04 -0.01 0.00 -0.16 0.00 0.00 28.75 28.89 1vyn h GLU 114 CO 0.00 0.13 0.02 1.28 -1.18 0.00 0.00 179.01 179.26 1vyn n LEU 115 N -4.51 4.97 -4.25 1.64 4.77 -1.08 -4.84 117.00 113.70 1vyn n LEU 115 Ca -0.00 -2.52 -0.29 0.00 -0.03 0.00 0.00 56.01 53.16 1vyn n LEU 115 Cb 0.09 -0.66 -0.16 0.00 -2.33 0.00 0.00 43.42 40.36 1vyn n LEU 115 CO 0.34 0.57 -0.54 0.00 -1.33 0.00 0.00 177.39 176.43 1vyn s SER 117 N -0.45 3.32 -0.08 0.00 0.01 0.67 -1.47 113.70 115.71 1vyn s SER 117 Ca 0.06 -0.51 -0.10 0.00 1.31 0.00 0.00 55.95 56.71 1vyn s SER 117 Cb -0.10 -0.40 -0.05 0.00 0.21 0.00 0.00 66.02 65.69 1vyn s SER 117 CO -0.00 0.28 0.25 -0.51 0.41 0.00 0.00 173.24 173.66 1vyn s ILE 118 N -0.78 5.32 -0.19 1.44 2.07 0.15 0.13 121.20 129.34 1vyn s ILE 118 Ca 0.12 0.46 -0.29 0.00 -1.41 0.00 0.00 60.65 59.53 1vyn s ILE 118 Cb -0.10 -3.53 -0.03 0.00 0.13 0.00 0.00 42.46 38.93 1vyn s ILE 118 CO 0.02 0.59 1.65 -0.70 -1.91 0.00 0.00 174.94 174.59 1vyn s GLU 119 N -0.95 3.82 0.00 3.50 -6.30 -1.26 -1.24 118.70 116.27 1vyn s GLU 119 Ca 0.18 1.76 0.22 0.00 -2.50 0.00 0.00 54.97 54.64 1vyn s GLU 119 Cb -0.14 -4.05 1.31 0.00 0.00 0.00 0.00 34.13 31.26 1vyn s GLU 119 CO 0.07 -1.26 1.69 -0.85 0.02 0.00 0.00 175.26 174.93