#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 3.49 -0.37 0.00 -1.94 0.93 -4.90 119.30 116.52 1vyn s MET 5 Ca 0.00 -0.58 -0.42 0.00 -1.71 0.00 0.00 55.69 52.98 1vyn s MET 5 Cb 0.00 -2.99 -0.17 0.00 2.01 0.00 0.00 34.83 33.68 1vyn s MET 5 CO 0.00 -0.04 1.80 -2.30 -0.01 0.00 0.00 175.02 174.47 1vyn n PRO 6 N 4.36 0.73 0.14 2.03 -0.02 -1.26 0.19 135.00 141.17 1vyn n PRO 6 Ca -0.18 0.26 0.00 0.00 -2.02 0.00 0.00 63.50 61.57 1vyn n PRO 6 Cb 0.52 -1.93 0.29 0.00 -0.02 0.00 0.00 33.50 32.36 1vyn n PRO 6 CO 0.00 0.00 0.00 1.98 1.98 0.00 0.00 175.50 179.46 1vyn h MET 7 N 7.37 0.12 -0.59 -0.52 4.05 -1.54 0.15 114.93 123.98 1vyn h MET 7 Ca -0.40 -0.05 -0.04 0.00 -0.28 0.00 0.00 59.70 58.92 1vyn h MET 7 Cb 1.34 -0.00 -0.03 0.00 -0.80 0.00 0.00 31.60 32.11 1vyn h MET 7 CO 0.99 0.49 0.19 0.82 0.23 0.00 0.00 176.91 179.63 1vyn h ILE 8 N 0.10 1.24 -0.08 1.77 1.08 -1.77 0.22 117.51 120.07 1vyn h ILE 8 Ca 0.01 -0.80 -0.10 0.00 -0.39 0.00 0.00 64.86 63.58 1vyn h ILE 8 Cb 0.73 0.65 -0.01 0.00 -3.07 0.00 0.00 36.82 35.11 1vyn h ILE 8 CO 0.05 0.30 -0.42 -0.08 -0.69 0.00 0.00 178.15 177.32 1vyn h GLU 9 N 0.83 0.18 -0.70 2.37 4.81 -1.66 -0.76 114.58 119.64 1vyn h GLU 9 Ca 0.19 -0.08 -0.07 0.00 -0.13 0.00 0.00 59.36 59.27 1vyn h GLU 9 Cb 0.27 -0.00 -0.03 0.00 0.63 0.00 0.00 28.75 29.62 1vyn h GLU 9 CO -0.01 0.57 0.17 -0.92 -0.73 0.00 0.00 179.01 178.10 1vyn h TYR 10 N 0.15 1.18 -0.27 0.92 3.20 -0.17 0.30 116.97 122.27 1vyn h TYR 10 Ca 0.01 -0.14 0.00 0.00 3.14 0.00 0.00 58.73 61.75 1vyn h TYR 10 Cb 0.81 -0.33 -0.01 0.00 1.54 0.00 0.00 36.73 38.73 1vyn h TYR 10 CO 0.01 0.96 0.17 -0.07 -1.64 0.00 0.00 178.16 177.59 1vyn h LEU 11 N 1.06 0.30 0.32 2.82 3.38 -0.07 0.22 115.31 123.33 1vyn h LEU 11 Ca 0.22 -0.01 -0.02 0.00 0.09 0.00 0.00 57.88 58.17 1vyn h LEU 11 Cb 0.37 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.05 1vyn h LEU 11 CO 0.00 0.21 -0.15 -0.08 0.09 0.00 0.00 178.44 178.52 1vyn h GLU 12 N 0.36 -0.41 0.03 1.13 4.81 -0.78 0.50 114.58 120.22 1vyn h GLU 12 Ca 0.10 0.03 -0.06 0.00 -0.13 0.00 0.00 59.36 59.30 1vyn h GLU 12 Cb -0.03 0.09 0.01 0.00 0.63 0.00 0.00 28.75 29.45 1vyn h GLU 12 CO -0.03 -0.14 -0.25 0.00 -0.73 0.00 0.00 179.01 177.86 1vyn h ARG 13 N -0.65 0.12 0.03 1.92 3.08 -0.41 -0.63 114.38 117.83 1vyn h ARG 13 Ca -0.04 -0.17 -0.38 0.00 0.07 0.00 0.00 59.98 59.46 1vyn h ARG 13 Cb 0.46 0.06 -0.05 0.00 0.08 0.00 0.00 29.97 30.51 1vyn h ARG 13 CO 0.07 1.01 -2.32 1.19 -1.07 0.00 0.00 179.97 178.86 1vyn n PHE 14 N -4.48 0.37 0.06 3.04 3.01 0.68 -2.86 117.46 117.28 1vyn n PHE 14 Ca -0.11 0.09 -0.22 0.00 1.01 0.00 0.00 57.45 58.21 1vyn n PHE 14 Cb 0.56 -1.05 -0.15 0.00 -0.01 0.00 0.00 39.48 38.83 1vyn n PHE 14 CO 0.00 0.00 0.00 0.77 1.01 0.00 0.00 176.76 178.54 1vyn h SER 15 N -0.10 0.57 0.33 4.37 0.02 -0.93 -3.36 113.55 114.46 1vyn h SER 15 Ca -0.54 -0.91 -0.32 0.00 -0.84 0.00 0.00 61.79 59.18 1vyn h SER 15 Cb 1.89 -0.19 -0.05 0.00 0.14 0.00 0.00 62.40 64.20 1vyn h SER 15 CO -0.07 1.66 -1.90 0.18 -1.14 0.00 0.00 176.83 175.56 1vyn n LEU 16 N -3.81 1.07 -1.60 5.07 4.77 0.17 -4.98 117.00 117.71 1vyn n LEU 16 Ca -0.22 0.29 -0.15 0.00 -0.03 0.00 0.00 56.01 55.90 1vyn n LEU 16 Cb 0.99 -0.01 -0.02 0.00 -2.33 0.00 0.00 43.42 42.04 1vyn n LEU 16 CO 0.50 0.50 -0.18 0.29 -1.33 0.00 0.00 177.39 177.16 1vyn n LYS 17 N -3.07 -1.18 0.00 3.23 5.02 -0.56 -4.89 118.16 116.71 1vyn n LYS 17 Ca -0.23 0.83 0.00 0.00 -2.02 0.00 0.00 58.31 56.89 1vyn n LYS 17 Cb 1.07 -5.13 0.00 0.00 -0.02 0.00 0.00 35.03 30.95 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 -0.91 0.00 -2.58 7.82 0.00 -0.35 -4.97 120.51 119.52 1vyn n ALA 18 Ca -0.17 0.00 -0.31 0.00 0.00 0.00 0.00 53.44 52.95 1vyn n ALA 18 Cb 0.60 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.95 1vyn n ALA 18 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1vyn s LYS 19 N 4.24 2.36 -0.04 0.00 1.02 -1.26 -4.31 119.74 121.75 1vyn s LYS 19 Ca 0.00 -0.85 0.01 0.00 0.02 0.00 0.00 55.97 55.15 1vyn s LYS 19 Cb 0.00 -2.40 -0.03 0.00 -0.52 0.00 0.00 37.83 34.87 1vyn s LYS 19 CO 0.00 0.56 -0.04 -1.50 -0.92 0.00 0.00 175.35 173.45 1vyn s ILE 20 N -1.07 3.90 0.00 2.17 -1.16 -1.26 -4.92 121.20 118.86 1vyn s ILE 20 Ca 0.18 -0.52 0.00 0.00 -0.51 0.00 0.00 60.65 59.81 1vyn s ILE 20 Cb -0.11 -2.66 0.00 0.00 0.61 0.00 0.00 42.46 40.30 1vyn s ILE 20 CO 0.10 0.51 0.00 -3.20 -2.81 0.00 0.00 174.94 169.54 1vyn n ASN 21 N 1.90 0.00 -0.10 4.50 2.85 -1.26 -5.00 115.26 118.14 1vyn n ASN 21 Ca -0.17 -0.29 -0.12 0.00 -0.11 0.00 0.00 54.58 53.89 1vyn n ASN 21 Cb 0.53 0.00 0.01 0.00 1.24 0.00 0.00 39.78 41.56 1vyn n ASN 21 CO 0.00 0.00 0.00 0.78 -2.11 0.00 0.00 177.26 175.93 1vyn h ASN 22 N 0.00 0.93 -0.55 1.20 2.35 -1.99 -3.23 115.58 114.29 1vyn h ASN 22 Ca 0.00 -0.41 0.00 0.00 -0.55 0.00 0.00 56.30 55.34 1vyn h ASN 22 Cb 0.00 -0.26 0.00 0.00 0.05 0.00 0.00 38.32 38.11 1vyn h ASN 22 CO 0.00 1.18 0.00 0.35 -1.65 0.00 0.00 177.43 177.31 1vyn n THR 23 N -4.06 2.23 -1.92 2.81 -2.24 -1.26 -4.52 114.28 105.31 1vyn n THR 23 Ca -0.02 -1.38 -0.40 0.00 -2.27 0.00 0.00 64.05 59.99 1vyn n THR 23 Cb 0.52 -0.07 0.04 0.00 -2.10 0.00 0.00 70.33 68.73 1vyn n THR 23 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1vyn n THR 24 N 0.65 3.61 -4.14 4.28 -2.24 -1.22 -4.87 114.28 110.36 1vyn n THR 24 Ca 0.25 -4.29 -0.44 0.00 -2.27 0.00 0.00 64.05 57.30 1vyn n THR 24 Cb 0.99 -1.25 -0.01 0.00 -2.10 0.00 0.00 70.33 67.97 1vyn n THR 24 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 1vyn n ASN 25 N -0.52 -2.99 0.29 3.42 6.94 -1.26 -4.78 115.26 116.36 1vyn n ASN 25 Ca 0.54 -1.30 0.15 0.00 -0.02 0.00 0.00 54.58 53.94 1vyn n ASN 25 Cb 0.23 -1.62 0.90 0.00 -2.36 0.00 0.00 39.78 36.93 1vyn n ASN 25 CO 0.00 0.00 0.00 0.17 -1.03 0.00 0.00 177.26 176.40 1vyn h LEU 26 N -2.48 0.00 0.08 -4.53 8.10 -1.82 -0.12 115.31 114.53 1vyn h LEU 26 Ca -0.71 0.00 -0.00 0.00 0.11 0.00 0.00 57.88 57.28 1vyn h LEU 26 Cb 1.41 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 41.63 1vyn h LEU 26 CO 0.56 0.01 -0.04 0.44 -4.11 0.00 0.00 178.44 175.31 1vyn h ASP 27 N 0.00 -0.09 0.48 0.17 5.19 -1.88 -3.00 116.42 117.30 1vyn h ASP 27 Ca -0.00 -0.24 -0.09 0.00 -0.62 0.00 0.00 57.03 56.08 1vyn h ASP 27 Cb 0.04 0.02 -0.01 0.00 0.18 0.00 0.00 39.33 39.56 1vyn h ASP 27 CO 0.00 0.19 -0.44 1.88 -3.12 0.00 0.00 179.24 177.75 1vyn h TYR 28 N -0.37 0.00 0.70 4.55 0.05 -1.41 0.30 116.97 120.79 1vyn h TYR 28 Ca -0.01 0.00 -0.03 0.00 0.05 0.00 0.00 58.73 58.74 1vyn h TYR 28 Cb 0.32 0.00 0.01 0.00 1.01 0.00 0.00 36.73 38.06 1vyn h TYR 28 CO 0.01 0.44 -0.34 0.77 -1.05 0.00 0.00 178.16 178.00 1vyn h SER 29 N 0.00 -0.80 -0.49 3.88 0.02 -1.38 -1.92 113.55 112.87 1vyn h SER 29 Ca -0.00 -0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 60.94 1vyn h SER 29 Cb 0.80 0.21 -0.02 0.00 0.14 0.00 0.00 62.40 63.52 1vyn h SER 29 CO 0.06 -0.47 0.30 0.03 -1.14 0.00 0.00 176.83 175.61 1vyn h ARG 30 N -1.12 0.66 -0.63 3.45 -0.00 -1.34 0.39 114.38 115.78 1vyn h ARG 30 Ca -0.10 -0.05 -0.07 0.00 -0.50 0.00 0.00 59.98 59.26 1vyn h ARG 30 Cb 0.75 -0.14 -0.03 0.00 0.00 0.00 0.00 29.97 30.55 1vyn h ARG 30 CO 0.16 0.47 0.12 -0.09 0.00 0.00 0.00 179.97 180.63 1vyn h ARG 31 N 0.65 1.02 0.00 0.04 2.43 -1.01 -2.11 114.38 115.40 1vyn h ARG 31 Ca 0.18 -0.25 0.00 0.00 -0.81 0.00 0.00 59.98 59.10 1vyn h ARG 31 Cb -0.02 -0.13 0.00 0.00 -0.42 0.00 0.00 29.97 29.39 1vyn h ARG 31 CO -0.03 0.92 -0.25 0.35 -1.51 0.00 0.00 179.97 179.45 1vyn h PHE 32 N 0.96 0.00 0.00 2.20 3.57 -1.01 -3.10 116.94 119.56 1vyn h PHE 32 Ca 0.20 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.70 1vyn h PHE 32 Cb 0.38 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.12 1vyn h PHE 32 CO 0.03 0.00 0.00 1.28 -2.23 0.00 0.00 178.31 177.39 1vyn n LEU 33 N -2.88 0.26 0.31 0.59 7.99 0.13 -4.13 117.00 119.27 1vyn n LEU 33 Ca 0.03 0.53 -0.17 0.00 -0.01 0.00 0.00 56.01 56.40 1vyn n LEU 33 Cb 0.52 -0.46 -0.09 0.00 -0.11 0.00 0.00 43.42 43.28 1vyn n LEU 33 CO 0.35 -0.14 0.68 -0.08 -1.51 0.00 0.00 177.39 176.70 1vyn h GLU 34 N 0.00 -0.73 0.00 3.23 4.81 -1.35 -1.14 114.58 119.39 1vyn h GLU 34 Ca 0.00 0.05 -0.01 0.00 -0.13 0.00 0.00 59.36 59.27 1vyn h GLU 34 Cb 0.50 0.17 -0.00 0.00 0.63 0.00 0.00 28.75 30.05 1vyn h GLU 34 CO 0.00 -0.49 -0.03 -1.00 -0.73 0.00 0.00 179.01 176.77 1vyn h PRO 35 N -0.76 0.00 0.07 0.92 0.13 -1.81 -1.54 132.00 129.01 1vyn h PRO 35 Ca -0.07 0.00 -0.24 0.00 -0.87 0.00 0.00 66.00 64.82 1vyn h PRO 35 Cb 0.59 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.72 1vyn h PRO 35 CO 0.11 0.03 -1.09 0.35 -0.23 0.00 0.00 178.00 177.16 1vyn h PHE 36 N 0.00 0.43 0.00 1.56 3.57 -1.64 -3.31 116.94 117.54 1vyn h PHE 36 Ca -0.00 -0.28 -0.11 0.00 3.53 0.00 0.00 57.97 61.11 1vyn h PHE 36 Cb 0.18 -0.03 -0.02 0.00 2.79 0.00 0.00 35.95 38.87 1vyn h PHE 36 CO 0.00 1.17 -0.76 -0.07 -2.23 0.00 0.00 178.31 176.42 1vyn h LEU 37 N 0.10 0.00 -8.41 0.59 4.07 -0.25 -3.45 115.31 107.97 1vyn h LEU 37 Ca -0.09 0.00 -0.52 0.00 0.08 0.00 0.00 57.88 57.34 1vyn h LEU 37 Cb 1.79 0.00 -0.03 0.00 1.08 0.00 0.00 40.66 43.50 1vyn h LEU 37 CO 0.18 0.49 1.62 -1.14 -1.08 0.00 0.00 178.44 178.51 1vyn n ARG 38 N -3.11 0.74 -0.69 1.13 0.63 -0.83 -1.77 116.66 112.76 1vyn n ARG 38 Ca -0.01 0.07 0.00 0.00 -0.92 0.00 0.00 57.85 56.99 1vyn n ARG 38 Cb 0.75 -2.61 0.00 0.00 0.45 0.00 0.00 32.46 31.05 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 6.29 0.96 3.65 5.14 0.00 0.67 -5.01 105.19 116.89 1vyn n GLY 39 Ca 0.47 -0.19 -0.29 0.00 0.00 0.00 0.00 46.02 46.01 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 -2.24 1.24 -0.04 -0.61 -4.36 -0.73 -4.97 121.20 109.49 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 -2.46 -0.00 0.00 1.25 0.00 0.00 42.46 41.25 1vyn s ILE 40 CO 0.00 0.00 -0.17 0.54 0.24 0.00 0.00 174.94 175.55 1vyn s ASN 41 N -3.74 2.12 0.04 4.36 2.20 -1.26 -0.19 114.94 118.47 1vyn s ASN 41 Ca 0.19 -0.34 0.02 0.00 -0.94 0.00 0.00 52.86 51.79 1vyn s ASN 41 Cb 0.04 -0.53 -0.02 0.00 -2.00 0.00 0.00 41.25 38.74 1vyn s ASN 41 CO 0.10 0.16 -0.08 0.68 -2.94 0.00 0.00 177.10 175.02 1vyn s VAL 42 N -0.03 0.60 -0.30 3.54 -7.23 -0.83 -4.19 120.40 111.96 1vyn s VAL 42 Ca -0.02 -1.00 -0.13 0.00 -1.81 0.00 0.00 61.98 59.01 1vyn s VAL 42 Cb -0.11 -0.63 -0.03 0.00 0.56 0.00 0.00 36.38 36.16 1vyn s VAL 42 CO 0.02 -0.30 0.28 0.68 -0.31 0.00 0.00 175.10 175.46 1vyn s VAL 43 N -1.22 5.25 -0.28 1.32 -7.23 0.48 -0.38 120.40 118.34 1vyn s VAL 43 Ca -0.08 0.19 -0.21 0.00 -1.81 0.00 0.00 61.98 60.07 1vyn s VAL 43 Cb -0.09 -3.66 -0.01 0.00 0.56 0.00 0.00 36.38 33.18 1vyn s VAL 43 CO 0.01 0.12 0.68 -0.47 -0.31 0.00 0.00 175.10 175.13 1vyn s TYR 44 N 1.88 3.25 -0.49 2.82 5.04 0.92 -0.14 117.35 130.63 1vyn s TYR 44 Ca 0.10 0.77 -0.19 0.00 -2.44 0.00 0.00 57.07 55.31 1vyn s TYR 44 Cb -0.16 -2.98 0.05 0.00 0.35 0.00 0.00 41.96 39.22 1vyn s TYR 44 CO 0.11 -0.43 0.62 0.99 -1.34 0.00 0.00 175.55 175.50 1vyn s THR 45 N 2.66 4.88 -0.07 4.34 2.01 0.62 -1.94 115.64 128.13 1vyn s THR 45 Ca 0.28 -0.39 -0.30 0.00 0.31 0.00 0.00 61.69 61.59 1vyn s THR 45 Cb -0.15 -4.27 -0.02 0.00 0.01 0.00 0.00 72.50 68.07 1vyn s THR 45 CO 0.10 -0.76 1.03 -2.84 -0.69 0.00 0.00 174.62 171.47 1vyn s PRO 46 N 2.64 4.44 0.61 4.92 0.02 -1.26 -4.87 135.00 141.50 1vyn s PRO 46 Ca 0.16 1.45 -0.18 0.00 0.02 0.00 0.00 61.00 62.45 1vyn s PRO 46 Cb -0.18 -3.52 -0.05 0.00 0.02 0.00 0.00 34.50 30.76 1vyn s PRO 46 CO 0.13 -0.27 0.79 -2.30 -0.33 0.00 0.00 177.00 175.02 1vyn n PRO 47 N 4.75 0.69 0.27 5.54 -0.02 -1.26 -4.73 135.00 140.24 1vyn n PRO 47 Ca 0.08 0.27 0.18 0.00 -2.02 0.00 0.00 63.50 62.02 1vyn n PRO 47 Cb 0.49 -2.00 0.95 0.00 -0.02 0.00 0.00 33.50 32.92 1vyn n PRO 47 CO 0.00 0.00 0.00 -0.56 1.98 0.00 0.00 175.50 176.92 1vyn h GLN 48 N 0.27 0.00 0.00 -0.52 3.07 -1.94 0.37 115.11 116.35 1vyn h GLN 48 Ca -0.47 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.27 1vyn h GLN 48 Cb 1.37 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.93 1vyn h GLN 48 CO 0.49 0.00 0.00 1.03 0.09 0.00 0.00 178.83 180.44 1vyn h SER 49 N 0.00 0.00 1.29 0.06 0.87 -1.88 -2.83 113.55 111.05 1vyn h SER 49 Ca 0.00 0.00 -0.10 0.00 -1.23 0.00 0.00 61.79 60.46 1vyn h SER 49 Cb 0.05 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 61.99 1vyn h SER 49 CO 0.00 0.00 -0.74 -0.26 -0.53 0.00 0.00 176.83 175.30 1vyn h PHE 50 N 0.00 0.00 -3.79 2.24 -1.00 -0.52 -3.48 116.94 110.39 1vyn h PHE 50 Ca 0.00 0.00 -0.30 0.00 2.81 0.00 0.00 57.97 60.48 1vyn h PHE 50 Cb 0.59 0.00 0.06 0.00 3.61 0.00 0.00 35.95 40.22 1vyn h PHE 50 CO 0.00 0.40 -0.47 1.04 -1.61 0.00 0.00 178.31 177.68 1vyn n GLN 51 N -3.06 -4.36 -4.18 1.51 1.13 -1.07 -5.00 117.38 102.36 1vyn n GLN 51 Ca -0.01 0.66 -0.18 0.00 -1.94 0.00 0.00 57.00 55.53 1vyn n GLN 51 Cb 0.72 -5.04 -0.12 0.00 0.11 0.00 0.00 30.24 25.91 1vyn n GLN 51 CO 0.00 0.00 0.00 -1.12 -1.44 0.00 0.00 177.06 174.50 1vyn s SER 52 N -2.93 1.56 0.18 1.08 0.01 -1.26 -5.14 113.70 107.20 1vyn s SER 52 Ca 0.29 -0.58 -0.18 0.00 1.31 0.00 0.00 55.95 56.78 1vyn s SER 52 Cb -0.13 -0.04 -0.08 0.00 0.21 0.00 0.00 66.02 65.98 1vyn s SER 52 CO 0.36 -0.08 0.66 0.00 0.41 0.00 0.00 173.24 174.59 1vyn s ALA 53 N -1.23 3.49 -0.18 1.44 0.00 -1.26 -4.49 121.76 119.52 1vyn s ALA 53 Ca -0.03 0.07 -0.40 0.00 0.00 0.00 0.00 51.96 51.61 1vyn s ALA 53 Cb -0.10 -2.72 -0.17 0.00 0.00 0.00 0.00 23.12 20.14 1vyn s ALA 53 CO 0.02 0.37 1.58 -2.30 0.00 0.00 0.00 175.76 175.43 1vyn n PRO 54 N 0.92 0.98 -4.50 0.00 -0.02 -1.26 -4.81 135.00 126.32 1vyn n PRO 54 Ca -0.04 0.36 -0.32 0.00 -2.02 0.00 0.00 63.50 61.48 1vyn n PRO 54 Cb 0.51 -2.00 -0.11 0.00 -0.02 0.00 0.00 33.50 31.88 1vyn n PRO 54 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 1vyn s ARG 55 N 2.45 2.48 -0.33 -0.52 1.81 -0.82 -4.86 118.95 119.16 1vyn s ARG 55 Ca 0.95 -0.76 -0.17 0.00 -1.72 0.00 0.00 55.73 54.03 1vyn s ARG 55 Cb -1.09 -2.45 -0.01 0.00 -0.45 0.00 0.00 34.95 30.95 1vyn s ARG 55 CO 0.61 0.59 0.47 0.54 -0.68 0.00 0.00 175.30 176.84 1vyn s VAL 56 N -0.98 5.07 0.02 3.52 0.11 -1.26 -0.05 120.40 126.83 1vyn s VAL 56 Ca 0.17 0.36 0.02 0.00 -2.93 0.00 0.00 61.98 59.60 1vyn s VAL 56 Cb -0.11 -3.89 -0.04 0.00 -1.53 0.00 0.00 36.38 30.81 1vyn s VAL 56 CO 0.07 -0.12 -0.00 -0.31 -3.33 0.00 0.00 175.10 171.41 1vyn s TYR 57 N 2.27 3.05 -0.37 1.54 2.02 0.49 -4.92 117.35 121.44 1vyn s TYR 57 Ca 0.17 0.05 -0.26 0.00 -0.37 0.00 0.00 57.07 56.66 1vyn s TYR 57 Cb -0.16 -1.63 0.02 0.00 -0.40 0.00 0.00 41.96 39.78 1vyn s TYR 57 CO 0.12 0.46 0.94 0.50 -1.57 0.00 0.00 175.55 176.00 1vyn s ARG 58 N -1.74 3.86 -0.42 -0.62 6.06 -1.26 -1.97 118.95 122.85 1vyn s ARG 58 Ca 0.21 0.61 -0.29 0.00 -2.50 0.00 0.00 55.73 53.76 1vyn s ARG 58 Cb -0.12 -3.80 0.02 0.00 0.06 0.00 0.00 34.95 31.12 1vyn s ARG 58 CO 0.12 -0.95 1.15 0.08 -2.50 0.00 0.00 175.30 173.21 1vyn s VAL 59 N 3.50 4.26 -0.07 7.11 1.01 0.73 -2.33 120.40 134.61 1vyn s VAL 59 Ca 0.39 1.35 -0.08 0.00 0.00 0.00 0.00 61.98 63.63 1vyn s VAL 59 Cb -0.12 -4.49 -0.29 0.00 0.00 0.00 0.00 36.38 31.48 1vyn s VAL 59 CO 0.19 -0.81 0.59 0.78 0.00 0.00 0.00 175.10 175.84 1vyn h ASN 60 N 9.04 0.50 0.00 3.32 4.21 -1.64 0.20 115.58 131.21 1vyn h ASN 60 Ca -0.23 -0.86 0.00 0.00 1.21 0.00 0.00 56.30 56.42 1vyn h ASN 60 Cb 1.07 -0.16 0.00 0.00 -1.12 0.00 0.00 38.32 38.10 1vyn h ASN 60 CO 1.09 1.75 0.00 0.61 -1.29 0.00 0.00 177.43 179.59 1vyn n GLY 61 N 1.88 -0.60 3.23 2.83 0.00 -1.04 -4.11 105.19 107.37 1vyn n GLY 61 Ca -0.26 -0.60 -0.16 0.00 0.00 0.00 0.00 46.02 45.00 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 2.44 -0.23 0.99 1.43 -1.26 -0.93 118.68 121.12 1vyn s LEU 62 Ca 0.00 -0.87 -0.15 0.00 -1.03 0.00 0.00 54.13 52.08 1vyn s LEU 62 Cb 0.00 -0.45 -0.04 0.00 0.03 0.00 0.00 46.19 45.74 1vyn s LEU 62 CO 0.00 -0.22 0.39 -0.55 0.23 0.00 0.00 176.35 176.20 1vyn s SER 63 N -2.66 6.37 0.10 2.29 0.15 0.06 -4.87 113.70 115.14 1vyn s SER 63 Ca 0.10 0.43 0.05 0.00 0.70 0.00 0.00 55.95 57.24 1vyn s SER 63 Cb -0.02 -2.22 0.29 0.00 -1.71 0.00 0.00 66.02 62.36 1vyn s SER 63 CO 0.02 -0.11 1.09 0.54 1.20 0.00 0.00 173.24 175.97 1vyn n ARG 64 N 4.78 0.04 -3.59 5.44 3.00 -1.26 -3.62 116.66 121.44 1vyn n ARG 64 Ca -0.08 0.47 -0.37 0.00 -0.01 0.00 0.00 57.85 57.86 1vyn n ARG 64 Cb 0.51 -1.72 -0.09 0.00 0.00 0.00 0.00 32.46 31.16 1vyn n ARG 64 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1vyn s ALA 65 N -3.01 3.61 0.80 7.54 0.00 -1.26 -4.99 121.76 124.44 1vyn s ALA 65 Ca -0.01 -0.74 -0.12 0.00 0.00 0.00 0.00 51.96 51.09 1vyn s ALA 65 Cb 0.02 -2.39 0.08 0.00 0.00 0.00 0.00 23.12 20.83 1vyn s ALA 65 CO 0.05 -0.16 1.16 -2.14 0.00 0.00 0.00 175.76 174.67 1vyn s PRO 66 N 0.99 1.79 0.53 0.00 0.02 -1.26 -3.27 135.00 133.80 1vyn s PRO 66 Ca 0.11 1.57 0.36 0.00 0.02 0.00 0.00 61.00 63.06 1vyn s PRO 66 Cb -0.13 -1.81 1.85 0.00 0.02 0.00 0.00 34.50 34.42 1vyn s PRO 66 CO 0.04 -2.06 2.09 0.00 -0.33 0.00 0.00 177.00 176.74 1vyn h ALA 67 N -0.98 1.00 0.00 -1.55 0.00 -0.71 0.13 119.26 117.15 1vyn h ALA 67 Ca -0.45 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.46 1vyn h ALA 67 Cb 1.27 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.06 1vyn h ALA 67 CO 0.47 0.00 -0.13 0.66 0.00 0.00 0.00 179.25 180.25 1vyn h SER 68 N 0.00 0.00 -0.00 0.00 4.64 -1.71 -2.40 113.55 114.08 1vyn h SER 68 Ca 0.00 -0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.30 1vyn h SER 68 Cb 0.11 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.20 1vyn h SER 68 CO 0.00 0.01 -0.20 -1.20 -0.87 0.00 0.00 176.83 174.57 1vyn n SER 69 N -2.64 0.61 -4.59 4.97 7.64 0.32 -4.89 113.62 115.04 1vyn n SER 69 Ca 0.04 -0.81 -0.41 0.00 1.01 0.00 0.00 58.87 58.71 1vyn n SER 69 Cb 0.48 0.74 -0.07 0.00 -1.01 0.00 0.00 64.21 64.35 1vyn n SER 69 CO 0.00 0.00 0.00 -1.61 -3.01 0.00 0.00 175.04 170.42 1vyn s GLU 70 N -1.29 3.84 -0.26 1.43 0.41 -0.46 -4.94 118.70 117.44 1vyn s GLU 70 Ca 0.04 0.17 -0.09 0.00 -0.41 0.00 0.00 54.97 54.68 1vyn s GLU 70 Cb 0.05 -3.74 -0.04 0.00 -1.78 0.00 0.00 34.13 28.62 1vyn s GLU 70 CO 0.20 -0.57 0.11 0.95 -0.49 0.00 0.00 175.26 175.46 1vyn s THR 71 N 2.52 4.63 0.30 3.63 -4.23 -1.26 -3.10 115.64 118.14 1vyn s THR 71 Ca 0.23 -0.06 0.09 0.00 -1.18 0.00 0.00 61.69 60.76 1vyn s THR 71 Cb -0.15 -3.18 -0.04 0.00 1.34 0.00 0.00 72.50 70.46 1vyn s THR 71 CO 0.12 0.31 0.08 0.72 -0.54 0.00 0.00 174.62 175.31 1vyn s PHE 72 N 1.66 2.73 -0.29 3.99 -0.71 -0.75 -4.84 117.98 119.78 1vyn s PHE 72 Ca 0.07 -0.30 -0.20 0.00 -1.04 0.00 0.00 56.93 55.46 1vyn s PHE 72 Cb -0.15 -1.43 -0.01 0.00 -1.21 0.00 0.00 43.02 40.21 1vyn s PHE 72 CO 0.06 0.48 0.61 -2.00 -1.34 0.00 0.00 175.22 173.02 1vyn s GLU 73 N -3.77 3.96 -0.13 1.99 2.12 -1.26 -2.25 118.70 119.37 1vyn s GLU 73 Ca 0.35 0.34 -0.01 0.00 0.36 0.00 0.00 54.97 56.00 1vyn s GLU 73 Cb -0.04 -3.70 0.04 0.00 0.26 0.00 0.00 34.13 30.68 1vyn s GLU 73 CO 0.22 -0.50 -0.03 -1.58 -0.54 0.00 0.00 175.26 172.83 1vyn s HIS 74 N 2.53 1.23 -1.73 5.30 2.46 0.19 -4.70 115.29 120.58 1vyn s HIS 74 Ca 0.24 -0.70 -0.01 0.00 0.47 0.00 0.00 55.06 55.06 1vyn s HIS 74 Cb -0.15 -1.09 0.00 0.00 -0.13 0.00 0.00 32.58 31.21 1vyn s HIS 74 CO 0.11 -0.51 0.18 -0.25 -2.47 0.00 0.00 174.74 171.80 1vyn n ASP 75 N 5.00 -6.01 -0.05 9.88 8.00 -1.26 -1.39 116.55 130.71 1vyn n ASP 75 Ca -0.10 -0.10 -0.01 0.00 0.71 0.00 0.00 54.79 55.30 1vyn n ASP 75 Cb 0.49 -4.96 -0.00 0.00 -0.02 0.00 0.00 41.12 36.62 1vyn n ASP 75 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1vyn n GLY 76 N -1.17 0.45 3.44 0.44 0.00 -1.26 -5.02 105.19 102.08 1vyn n GLY 76 Ca -0.21 -0.15 -0.30 0.00 0.00 0.00 0.00 46.02 45.35 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 -0.70 1.96 -0.18 1.61 -0.14 -0.49 -5.06 119.74 116.73 1vyn s LYS 77 Ca 0.00 -1.05 -0.13 0.00 -1.36 0.00 0.00 55.97 53.44 1vyn s LYS 77 Cb 0.00 -2.13 -0.05 0.00 -1.68 0.00 0.00 37.83 33.97 1vyn s LYS 77 CO 0.00 0.52 0.25 0.15 -0.76 0.00 0.00 175.35 175.51 1vyn s LYS 78 N -1.53 4.23 0.09 1.68 1.02 -1.26 0.57 119.74 124.54 1vyn s LYS 78 Ca 0.15 -0.00 -0.03 0.00 0.02 0.00 0.00 55.97 56.10 1vyn s LYS 78 Cb -0.10 -3.43 -0.03 0.00 -0.52 0.00 0.00 37.83 33.74 1vyn s LYS 78 CO 0.05 0.23 0.06 0.14 -0.92 0.00 0.00 175.35 174.92 1vyn s VAL 79 N 0.51 0.16 0.08 3.17 -7.23 -0.95 -4.94 120.40 111.20 1vyn s VAL 79 Ca 0.14 -1.68 -0.13 0.00 -1.81 0.00 0.00 61.98 58.51 1vyn s VAL 79 Cb -0.12 -1.64 -0.06 0.00 0.56 0.00 0.00 36.38 35.11 1vyn s VAL 79 CO 0.02 -0.74 0.46 0.42 -0.31 0.00 0.00 175.10 174.95 1vyn s THR 80 N -3.94 4.99 0.55 5.32 -4.23 -1.26 -1.80 115.64 115.27 1vyn s THR 80 Ca 0.12 0.69 0.23 0.00 -1.18 0.00 0.00 61.69 61.55 1vyn s THR 80 Cb 0.07 -3.70 0.31 0.00 1.34 0.00 0.00 72.50 70.52 1vyn s THR 80 CO -0.06 0.35 2.20 0.40 -0.54 0.00 0.00 174.62 176.96 1vyn h ILE 81 N 3.05 0.76 0.04 2.99 2.04 -1.38 0.37 117.51 125.38 1vyn h ILE 81 Ca -0.49 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.36 1vyn h ILE 81 Cb 1.20 0.99 0.00 0.00 -0.74 0.00 0.00 36.82 38.27 1vyn h ILE 81 CO 0.65 0.00 -0.02 0.00 0.00 0.00 0.00 178.15 178.78 1vyn h ALA 82 N 1.99 -0.05 -0.02 1.87 0.00 -1.78 -0.74 119.26 120.54 1vyn h ALA 82 Ca 0.00 -0.08 -0.17 0.00 0.00 0.00 0.00 54.91 54.67 1vyn h ALA 82 Cb 0.02 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 1vyn h ALA 82 CO -0.00 -0.46 -0.74 1.03 0.00 0.00 0.00 179.25 179.08 1vyn h SER 83 N -0.20 0.18 -0.23 0.00 0.87 -1.64 -2.03 113.55 110.49 1vyn h SER 83 Ca -0.01 -0.12 0.01 0.00 -1.23 0.00 0.00 61.79 60.44 1vyn h SER 83 Cb 0.18 -0.05 -0.01 0.00 -0.44 0.00 0.00 62.40 62.07 1vyn h SER 83 CO 0.01 0.85 0.14 0.22 -0.53 0.00 0.00 176.83 177.52 1vyn h TYR 84 N 0.09 0.27 -0.04 2.24 3.20 -0.15 0.90 116.97 123.48 1vyn h TYR 84 Ca -0.02 0.01 -0.23 0.00 3.14 0.00 0.00 58.73 61.63 1vyn h TYR 84 Cb 1.30 -0.09 0.01 0.00 1.54 0.00 0.00 36.73 39.49 1vyn h TYR 84 CO 0.02 0.17 -0.89 0.74 -1.64 0.00 0.00 178.16 176.55 1vyn h PHE 85 N 0.29 0.77 -0.34 -3.82 -1.00 -1.17 -2.99 116.94 108.70 1vyn h PHE 85 Ca 0.09 -0.39 0.02 0.00 2.81 0.00 0.00 57.97 60.49 1vyn h PHE 85 Cb -0.02 -0.10 -0.02 0.00 3.61 0.00 0.00 35.95 39.42 1vyn h PHE 85 CO -0.07 1.20 0.19 1.25 -1.61 0.00 0.00 178.31 179.27 1vyn h HIS 86 N 0.33 0.35 0.00 -0.55 2.76 -1.02 0.27 115.15 117.30 1vyn h HIS 86 Ca -0.08 0.01 -0.07 0.00 -2.20 0.00 0.00 60.37 58.04 1vyn h HIS 86 Cb 1.52 -0.11 -0.01 0.00 1.55 0.00 0.00 27.41 30.36 1vyn h HIS 86 CO 0.07 0.20 -0.33 0.66 -1.30 0.00 0.00 177.93 177.23 1vyn h SER 87 N 0.39 0.00 -0.26 3.26 4.64 -0.92 -1.49 113.55 119.17 1vyn h SER 87 Ca 0.14 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.46 1vyn h SER 87 Cb 0.02 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.11 1vyn h SER 87 CO -0.07 0.33 0.00 0.54 -0.87 0.00 0.00 176.83 176.76 1vyn n ARG 88 N -3.85 2.02 -2.45 4.77 3.00 -0.59 -4.89 116.66 114.68 1vyn n ARG 88 Ca -0.01 -1.12 -0.06 0.00 -0.01 0.00 0.00 57.85 56.65 1vyn n ARG 88 Cb 0.41 -1.46 0.01 0.00 0.00 0.00 0.00 32.46 31.41 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 0.31 -2.68 -3.56 0.55 3.02 -0.56 -4.66 115.26 107.68 1vyn n ASN 89 Ca 0.10 -0.07 -0.29 0.00 -0.03 0.00 0.00 54.58 54.29 1vyn n ASN 89 Cb 0.40 -1.61 -0.15 0.00 -0.61 0.00 0.00 39.78 37.81 1vyn n ASN 89 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 1vyn s TYR 90 N -2.69 0.50 -0.05 3.10 5.04 0.87 -4.93 117.35 119.19 1vyn s TYR 90 Ca 0.08 -1.01 -0.30 0.00 -2.44 0.00 0.00 57.07 53.40 1vyn s TYR 90 Cb -0.03 -1.00 -0.03 0.00 0.35 0.00 0.00 41.96 41.25 1vyn s TYR 90 CO 0.09 -0.84 1.14 -1.25 -1.34 0.00 0.00 175.55 173.36 1vyn s PRO 91 N 2.00 4.39 0.24 4.97 0.04 -1.26 -2.90 135.00 142.48 1vyn s PRO 91 Ca 0.09 1.60 -0.30 0.00 0.04 0.00 0.00 61.00 62.44 1vyn s PRO 91 Cb -0.16 -3.53 -0.09 0.00 0.04 0.00 0.00 34.50 30.76 1vyn s PRO 91 CO -0.34 -0.37 1.13 -0.51 0.04 0.00 0.00 177.00 176.95 1vyn s LEU 92 N 1.97 4.51 0.45 -3.56 1.43 -1.26 -4.92 118.68 117.30 1vyn s LEU 92 Ca 0.54 2.25 0.25 0.00 -1.03 0.00 0.00 54.13 56.14 1vyn s LEU 92 Cb -0.23 -3.62 0.68 0.00 0.03 0.00 0.00 46.19 43.05 1vyn s LEU 92 CO 0.22 -0.23 1.73 0.11 0.23 0.00 0.00 176.35 178.41 1vyn h LYS 93 N 4.38 0.00 -2.16 1.70 1.57 -1.99 -3.33 116.57 116.74 1vyn h LYS 93 Ca -0.46 0.00 -0.57 0.00 -1.87 0.00 0.00 60.65 57.75 1vyn h LYS 93 Cb 1.21 0.00 -0.39 0.00 0.08 0.00 0.00 32.23 33.13 1vyn h LYS 93 CO 0.70 0.09 -1.02 1.19 -0.57 0.00 0.00 179.45 179.84 1vyn n PHE 94 N -3.15 -0.16 0.09 -1.35 3.72 -1.26 -4.83 117.46 110.52 1vyn n PHE 94 Ca 0.02 -3.55 0.20 0.00 -0.05 0.00 0.00 57.45 54.08 1vyn n PHE 94 Cb 0.48 -0.18 0.71 0.00 -0.94 0.00 0.00 39.48 39.54 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 4.57 0.00 -0.87 -1.08 0.11 -1.98 -0.44 132.00 132.30 1vyn h PRO 95 Ca 0.14 0.00 -0.22 0.00 0.11 0.00 0.00 66.00 66.03 1vyn h PRO 95 Cb 0.87 0.00 -0.13 0.00 0.11 0.00 0.00 31.00 31.85 1vyn h PRO 95 CO 0.47 0.00 0.28 1.04 -0.21 0.00 0.00 178.00 179.58 1vyn n GLN 96 N -3.54 2.74 -3.22 1.05 6.02 -1.26 -2.29 117.38 116.87 1vyn n GLN 96 Ca 0.08 -2.24 -0.34 0.00 -0.01 0.00 0.00 57.00 54.49 1vyn n GLN 96 Cb 0.71 -1.95 -0.06 0.00 1.02 0.00 0.00 30.24 29.96 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 -2.24 4.22 0.22 1.08 0.05 -0.18 -4.56 118.68 117.26 1vyn s LEU 97 Ca 0.41 1.21 -0.30 0.00 0.05 0.00 0.00 54.13 55.50 1vyn s LEU 97 Cb 0.33 -3.70 -0.10 0.00 -2.05 0.00 0.00 46.19 40.68 1vyn s LEU 97 CO 0.10 -0.05 1.45 -1.00 -0.55 0.00 0.00 176.35 176.30 1vyn s HIS 98 N -1.71 3.06 0.17 3.48 3.76 -1.26 -0.24 115.29 122.55 1vyn s HIS 98 Ca 0.46 0.95 -0.32 0.00 -0.15 0.00 0.00 55.06 56.00 1vyn s HIS 98 Cb -0.13 -3.82 -0.10 0.00 1.11 0.00 0.00 32.58 29.64 1vyn s HIS 98 CO 0.19 -2.75 1.59 0.00 -0.85 0.00 0.00 174.74 172.92 1vyn s LEU 100 N 1.17 4.38 -0.43 0.00 2.96 -0.88 -0.76 118.68 125.12 1vyn s LEU 100 Ca 0.71 1.88 -0.06 0.00 -0.22 0.00 0.00 54.13 56.43 1vyn s LEU 100 Cb -0.44 -3.58 0.11 0.00 0.50 0.00 0.00 46.19 42.77 1vyn s LEU 100 CO 0.31 -0.36 0.26 0.21 -1.32 0.00 0.00 176.35 175.45 1vyn s ASN 101 N 0.94 5.47 0.34 3.68 3.84 -0.11 -1.21 114.94 127.89 1vyn s ASN 101 Ca 0.55 -1.87 0.09 0.00 0.21 0.00 0.00 52.86 51.84 1vyn s ASN 101 Cb -0.26 -1.92 -0.05 0.00 -0.55 0.00 0.00 41.25 38.47 1vyn s ASN 101 CO 0.29 -0.59 0.03 0.68 -2.79 0.00 0.00 177.10 174.73 1vyn s VAL 102 N 1.27 2.69 0.00 -5.21 -7.23 -0.07 -1.93 120.40 109.93 1vyn s VAL 102 Ca 0.06 -1.92 0.00 0.00 -1.81 0.00 0.00 61.98 58.31 1vyn s VAL 102 Cb -0.24 -2.83 0.00 0.00 0.56 0.00 0.00 36.38 33.87 1vyn s VAL 102 CO -0.02 -0.19 0.00 0.61 -0.31 0.00 0.00 175.10 175.19 1vyn n GLY 103 N -0.99 1.18 3.51 2.32 0.00 -0.98 -0.39 105.19 109.84 1vyn n GLY 103 Ca -0.04 -0.84 -0.12 0.00 0.00 0.00 0.00 46.02 45.02 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 0.41 0.09 1.61 0.01 -1.04 -4.87 113.70 105.91 1vyn s SER 104 Ca 0.00 -1.25 -0.13 0.00 1.31 0.00 0.00 55.95 55.89 1vyn s SER 104 Cb 0.00 0.61 -0.19 0.00 0.21 0.00 0.00 66.02 66.65 1vyn s SER 104 CO 0.00 -1.20 1.25 0.77 0.41 0.00 0.00 173.24 174.47 1vyn h SER 105 N 2.22 0.92 0.47 2.44 4.64 -2.00 -3.21 113.55 119.02 1vyn h SER 105 Ca -0.28 -0.67 -0.10 0.00 -0.47 0.00 0.00 61.79 60.27 1vyn h SER 105 Cb 1.25 -0.28 -0.01 0.00 -0.31 0.00 0.00 62.40 63.05 1vyn h SER 105 CO 0.39 1.47 -0.45 0.16 -0.87 0.00 0.00 176.83 177.52 1vyn h ILE 106 N 0.46 1.31 -3.05 0.95 3.07 -2.01 -3.38 117.51 114.85 1vyn h ILE 106 Ca -0.09 -1.56 -0.49 0.00 1.55 0.00 0.00 64.86 64.26 1vyn h ILE 106 Cb 1.55 1.85 -0.41 0.00 -0.27 0.00 0.00 36.82 39.54 1vyn h ILE 106 CO 0.18 0.44 -0.76 -0.75 -1.05 0.00 0.00 178.15 176.22 1vyn s LYS 107 N -3.97 0.25 -0.15 0.16 2.36 -1.23 -5.13 119.74 112.03 1vyn s LYS 107 Ca -0.02 -0.30 -0.19 0.00 -2.55 0.00 0.00 55.97 52.92 1vyn s LYS 107 Cb 0.14 -1.76 -0.04 0.00 -1.05 0.00 0.00 37.83 35.12 1vyn s LYS 107 CO 0.74 -0.75 0.51 -1.54 1.55 0.00 0.00 175.35 175.85 1vyn s SER 108 N 2.05 6.65 -0.41 1.43 1.04 -1.21 -2.49 113.70 120.76 1vyn s SER 108 Ca 0.03 0.78 -0.16 0.00 0.48 0.00 0.00 55.95 57.09 1vyn s SER 108 Cb -0.16 -2.30 0.02 0.00 0.10 0.00 0.00 66.02 63.68 1vyn s SER 108 CO -0.15 -0.08 0.35 -0.63 0.98 0.00 0.00 173.24 173.71 1vyn s ILE 109 N 1.04 5.19 -0.39 -1.02 1.01 0.48 -4.94 121.20 122.57 1vyn s ILE 109 Ca 0.26 -0.47 -0.17 0.00 0.00 0.00 0.00 60.65 60.27 1vyn s ILE 109 Cb -0.15 -3.95 0.01 0.00 0.01 0.00 0.00 42.46 38.37 1vyn s ILE 109 CO 0.10 -0.32 0.43 -0.76 0.00 0.00 0.00 174.94 174.39 1vyn s LEU 110 N 1.89 4.66 -0.01 2.97 1.02 -1.25 -0.89 118.68 127.07 1vyn s LEU 110 Ca 0.08 -0.45 0.00 0.00 0.02 0.00 0.00 54.13 53.78 1vyn s LEU 110 Cb -0.18 -2.41 0.01 0.00 0.02 0.00 0.00 46.19 43.64 1vyn s LEU 110 CO 0.12 -0.50 0.00 -1.48 0.02 0.00 0.00 176.35 174.51 1vyn s LEU 111 N 2.15 1.63 0.27 1.79 0.05 -0.35 -4.88 118.68 119.34 1vyn s LEU 111 Ca 0.13 0.00 -0.30 0.00 0.05 0.00 0.00 54.13 54.01 1vyn s LEU 111 Cb -0.17 -0.07 -0.11 0.00 -2.05 0.00 0.00 46.19 43.79 1vyn s LEU 111 CO 0.13 -0.04 1.62 -2.84 -0.55 0.00 0.00 176.35 174.66 1vyn s PRO 112 N 0.43 4.13 0.13 1.48 0.02 -1.26 -2.07 135.00 137.85 1vyn s PRO 112 Ca -0.04 2.56 0.12 0.00 0.02 0.00 0.00 61.00 63.67 1vyn s PRO 112 Cb -0.06 -3.04 0.57 0.00 0.02 0.00 0.00 34.50 31.99 1vyn s PRO 112 CO -0.01 -0.65 1.36 1.51 -0.33 0.00 0.00 177.00 178.88 1vyn n ILE 113 N 2.65 1.40 -0.32 2.83 0.13 -1.26 -2.20 119.36 122.59 1vyn n ILE 113 Ca 0.10 0.49 0.15 0.00 -1.10 0.00 0.00 62.75 62.39 1vyn n ILE 113 Cb 0.37 -1.44 0.37 0.00 -0.84 0.00 0.00 39.64 38.10 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 0.65 -0.23 9.51 4.57 -1.96 -0.91 114.58 126.21 1vyn h GLU 114 Ca 0.00 -0.04 0.00 0.00 -1.18 0.00 0.00 59.36 58.14 1vyn h GLU 114 Cb 0.09 -0.15 0.00 0.00 -0.16 0.00 0.00 28.75 28.53 1vyn h GLU 114 CO 0.00 0.43 0.00 1.28 -1.18 0.00 0.00 179.01 179.54 1vyn n LEU 115 N -4.68 2.81 -4.91 1.64 4.32 -0.94 -4.69 117.00 110.56 1vyn n LEU 115 Ca 0.22 -1.13 -0.31 0.00 -0.02 0.00 0.00 56.01 54.77 1vyn n LEU 115 Cb 0.60 -0.14 -0.04 0.00 -1.62 0.00 0.00 43.42 42.22 1vyn n LEU 115 CO 0.24 0.56 -0.16 0.00 -1.22 0.00 0.00 177.39 176.82 1vyn s SER 117 N -2.50 2.43 -0.03 0.00 0.01 0.80 -1.55 113.70 112.85 1vyn s SER 117 Ca 0.35 -0.47 -0.09 0.00 1.31 0.00 0.00 55.95 57.04 1vyn s SER 117 Cb -0.13 -0.22 -0.05 0.00 0.21 0.00 0.00 66.02 65.83 1vyn s SER 117 CO 0.28 0.19 0.27 -0.51 0.41 0.00 0.00 173.24 173.88 1vyn s ILE 118 N -0.70 5.28 -0.05 1.44 2.07 0.13 -0.39 121.20 128.98 1vyn s ILE 118 Ca 0.07 0.40 -0.30 0.00 -1.41 0.00 0.00 60.65 59.42 1vyn s ILE 118 Cb -0.08 -3.56 -0.03 0.00 0.13 0.00 0.00 42.46 38.92 1vyn s ILE 118 CO 0.01 0.51 1.10 -0.70 -1.91 0.00 0.00 174.94 173.95 1vyn s GLU 119 N -1.31 4.42 0.00 3.50 2.56 -1.26 -0.05 118.70 126.56 1vyn s GLU 119 Ca 0.22 1.55 0.32 0.00 0.00 0.00 0.00 54.97 57.06 1vyn s GLU 119 Cb -0.14 -3.51 1.88 0.00 2.00 0.00 0.00 34.13 34.36 1vyn s GLU 119 CO 0.11 -0.31 2.22 -0.85 -0.56 0.00 0.00 175.26 175.86