#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 4.16 -0.24 0.00 -2.45 0.33 -4.79 119.30 116.31 1vyn s MET 5 Ca 0.00 -0.10 -0.40 0.00 -1.25 0.00 0.00 55.69 53.94 1vyn s MET 5 Cb 0.00 -3.48 -0.16 0.00 1.25 0.00 0.00 34.83 32.44 1vyn s MET 5 CO 0.00 0.15 1.70 -0.35 1.05 0.00 0.00 175.02 177.57 1vyn n PRO 6 N 3.94 1.16 0.26 4.11 -0.04 -1.26 0.46 135.00 143.63 1vyn n PRO 6 Ca -0.14 0.42 0.12 0.00 -0.04 0.00 0.00 63.50 63.87 1vyn n PRO 6 Cb 0.52 -2.10 0.77 0.00 -0.04 0.00 0.00 33.50 32.64 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 6.92 0.00 -0.86 0.54 2.86 -1.23 0.14 114.93 123.29 1vyn h MET 7 Ca -0.47 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.17 1vyn h MET 7 Cb 1.32 0.00 -0.04 0.00 0.06 0.00 0.00 31.60 32.94 1vyn h MET 7 CO 0.94 0.00 0.51 0.82 1.06 0.00 0.00 176.91 180.24 1vyn h ILE 8 N 0.00 1.24 -0.52 -1.22 1.08 -1.80 0.17 117.51 116.46 1vyn h ILE 8 Ca 0.02 -0.55 0.00 0.00 -0.39 0.00 0.00 64.86 63.94 1vyn h ILE 8 Cb 0.08 0.04 -0.03 0.00 -3.07 0.00 0.00 36.82 33.85 1vyn h ILE 8 CO -0.00 0.26 0.33 -0.08 -0.69 0.00 0.00 178.15 177.97 1vyn h GLU 9 N 1.19 0.70 -0.19 2.37 4.57 -1.09 0.17 114.58 122.30 1vyn h GLU 9 Ca 0.31 -0.06 0.00 0.00 -1.18 0.00 0.00 59.36 58.43 1vyn h GLU 9 Cb -0.03 -0.15 -0.01 0.00 -0.16 0.00 0.00 28.75 28.40 1vyn h GLU 9 CO -0.06 0.49 0.12 -0.92 -1.18 0.00 0.00 179.01 177.47 1vyn h TYR 10 N 0.71 0.24 -0.34 0.92 3.20 -1.04 -1.56 116.97 119.10 1vyn h TYR 10 Ca 0.19 0.00 -0.00 0.00 3.14 0.00 0.00 58.73 62.06 1vyn h TYR 10 Cb -0.04 -0.08 -0.02 0.00 1.54 0.00 0.00 36.73 38.13 1vyn h TYR 10 CO -0.03 0.18 0.20 -0.07 -1.64 0.00 0.00 178.16 176.80 1vyn h LEU 11 N 0.24 0.41 -0.16 2.82 3.38 -0.37 0.15 115.31 121.77 1vyn h LEU 11 Ca 0.07 -0.06 0.02 0.00 0.09 0.00 0.00 57.88 58.00 1vyn h LEU 11 Cb 0.00 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 40.63 1vyn h LEU 11 CO -0.01 0.35 0.05 -0.08 0.09 0.00 0.00 178.44 178.83 1vyn h GLU 12 N 0.44 0.12 0.12 1.13 4.81 -0.48 0.33 114.58 121.05 1vyn h GLU 12 Ca 0.12 -0.01 -0.23 0.00 -0.13 0.00 0.00 59.36 59.11 1vyn h GLU 12 Cb 0.02 -0.03 0.02 0.00 0.63 0.00 0.00 28.75 29.39 1vyn h GLU 12 CO -0.02 0.08 -0.99 0.00 -0.73 0.00 0.00 179.01 177.34 1vyn h ARG 13 N 0.12 0.45 0.00 1.92 3.08 -1.16 -2.26 114.38 116.54 1vyn h ARG 13 Ca 0.07 -0.65 -0.30 0.00 0.07 0.00 0.00 59.98 59.17 1vyn h ARG 13 Cb 0.05 0.23 -0.05 0.00 0.08 0.00 0.00 29.97 30.28 1vyn h ARG 13 CO -0.08 1.29 -2.12 1.19 -1.07 0.00 0.00 179.97 179.17 1vyn n PHE 14 N -3.99 0.00 0.02 3.04 3.72 0.50 -4.07 117.46 116.68 1vyn n PHE 14 Ca -0.14 0.00 -0.22 0.00 -0.05 0.00 0.00 57.45 57.04 1vyn n PHE 14 Cb 0.88 -0.75 -0.14 0.00 -0.94 0.00 0.00 39.48 38.53 1vyn n PHE 14 CO 0.00 0.00 0.00 0.77 -0.05 0.00 0.00 176.76 177.48 1vyn h SER 15 N -0.10 0.44 0.52 4.37 0.02 -0.86 -3.36 113.55 114.58 1vyn h SER 15 Ca -0.45 -0.90 -0.23 0.00 -0.84 0.00 0.00 61.79 59.37 1vyn h SER 15 Cb 1.65 -0.14 -0.04 0.00 0.14 0.00 0.00 62.40 64.00 1vyn h SER 15 CO -0.10 1.77 -1.65 0.18 -1.14 0.00 0.00 176.83 175.89 1vyn n LEU 16 N -3.68 0.74 -2.00 5.07 4.32 0.92 -4.94 117.00 117.44 1vyn n LEU 16 Ca -0.28 0.34 -0.20 0.00 -0.02 0.00 0.00 56.01 55.85 1vyn n LEU 16 Cb 1.00 0.15 -0.04 0.00 -1.62 0.00 0.00 43.42 42.92 1vyn n LEU 16 CO 0.43 0.27 -0.23 0.29 -1.22 0.00 0.00 177.39 176.93 1vyn n LYS 17 N -2.91 -1.50 -3.53 3.23 4.76 -1.17 -4.95 118.16 112.09 1vyn n LYS 17 Ca -0.15 1.04 -0.11 0.00 -2.87 0.00 0.00 58.31 56.22 1vyn n LYS 17 Cb 0.94 -5.54 -0.03 0.00 -1.84 0.00 0.00 35.03 28.56 1vyn n LYS 17 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1vyn s ALA 18 N -2.90 -1.31 0.34 7.82 0.00 -0.86 -5.02 121.76 119.83 1vyn s ALA 18 Ca 0.00 0.23 -0.27 0.00 0.00 0.00 0.00 51.96 51.92 1vyn s ALA 18 Cb 0.00 0.82 -0.09 0.00 0.00 0.00 0.00 23.12 23.85 1vyn s ALA 18 CO 0.00 -0.74 1.13 -1.59 0.00 0.00 0.00 175.76 174.57 1vyn s LYS 19 N -3.78 4.36 -0.01 0.00 -2.85 -1.26 -4.48 119.74 111.72 1vyn s LYS 19 Ca 0.03 1.81 -0.18 0.00 -1.00 0.00 0.00 55.97 56.63 1vyn s LYS 19 Cb -0.00 -2.92 -0.06 0.00 -2.06 0.00 0.00 37.83 32.79 1vyn s LYS 19 CO -0.11 -0.04 0.49 0.42 0.10 0.00 0.00 175.35 176.20 1vyn s ILE 20 N -1.32 4.97 0.33 3.79 -1.09 -1.26 -4.98 121.20 121.64 1vyn s ILE 20 Ca 0.51 1.02 -0.18 0.00 -2.23 0.00 0.00 60.65 59.77 1vyn s ILE 20 Cb -0.31 -3.82 0.04 0.00 -1.58 0.00 0.00 42.46 36.80 1vyn s ILE 20 CO 0.39 0.49 0.78 0.21 -1.23 0.00 0.00 174.94 175.59 1vyn s ASN 21 N -0.59 -0.10 0.26 3.58 3.84 -1.26 -5.03 114.94 115.64 1vyn s ASN 21 Ca 0.27 -0.91 0.02 0.00 0.21 0.00 0.00 52.86 52.45 1vyn s ASN 21 Cb -0.17 0.78 0.32 0.00 -0.55 0.00 0.00 41.25 41.64 1vyn s ASN 21 CO 0.15 -1.52 1.65 -1.13 -2.79 0.00 0.00 177.10 173.46 1vyn h ASN 22 N 2.00 0.45 -0.17 -4.21 -0.73 -1.98 -3.04 115.58 107.91 1vyn h ASN 22 Ca -0.27 -0.19 -0.04 0.00 1.87 0.00 0.00 56.30 57.67 1vyn h ASN 22 Cb 1.25 -0.13 -0.02 0.00 0.27 0.00 0.00 38.32 39.69 1vyn h ASN 22 CO 0.33 0.80 0.05 0.35 -0.37 0.00 0.00 177.43 178.60 1vyn n THR 23 N -4.04 0.95 -3.72 -3.57 -2.24 -1.26 -4.77 114.28 95.63 1vyn n THR 23 Ca -0.01 -0.37 -0.24 0.00 -2.27 0.00 0.00 64.05 61.15 1vyn n THR 23 Cb 0.49 -0.59 -0.01 0.00 -2.10 0.00 0.00 70.33 68.12 1vyn n THR 23 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1vyn s THR 24 N -1.21 1.99 -1.04 4.28 -4.23 -1.15 -5.00 115.64 109.29 1vyn s THR 24 Ca 0.13 -1.41 -0.09 0.00 -1.18 0.00 0.00 61.69 59.15 1vyn s THR 24 Cb 0.10 -2.40 -0.15 0.00 1.34 0.00 0.00 72.50 71.39 1vyn s THR 24 CO 0.03 0.00 3.21 0.59 -0.54 0.00 0.00 174.62 177.91 1vyn n ASN 25 N -1.74 7.50 0.18 3.99 4.13 -1.26 -4.62 115.26 123.45 1vyn n ASN 25 Ca 0.02 -2.54 0.03 0.00 1.68 0.00 0.00 54.58 53.77 1vyn n ASN 25 Cb 0.63 -1.51 0.41 0.00 -1.54 0.00 0.00 39.78 37.77 1vyn n ASN 25 CO 0.00 0.00 0.00 0.17 0.28 0.00 0.00 177.26 177.71 1vyn h LEU 26 N 6.27 0.06 -0.43 3.41 8.10 -1.86 -2.14 115.31 128.72 1vyn h LEU 26 Ca 0.63 -0.01 -0.17 0.00 0.11 0.00 0.00 57.88 58.43 1vyn h LEU 26 Cb 0.73 -0.02 -0.01 0.00 -0.44 0.00 0.00 40.66 40.92 1vyn h LEU 26 CO 1.22 0.32 -0.78 -2.24 -4.11 0.00 0.00 178.44 172.86 1vyn h ASP 27 N 0.05 0.19 0.21 0.17 2.03 -1.82 -0.87 116.42 116.39 1vyn h ASP 27 Ca 0.01 -0.14 -0.18 0.00 -0.73 0.00 0.00 57.03 55.99 1vyn h ASP 27 Cb 0.50 -0.06 -0.01 0.00 -0.83 0.00 0.00 39.33 38.93 1vyn h ASP 27 CO 0.04 0.89 -0.68 1.88 -1.03 0.00 0.00 179.24 180.34 1vyn h TYR 28 N 0.10 0.56 -0.04 4.15 0.05 -1.80 -2.26 116.97 117.72 1vyn h TYR 28 Ca -0.03 -0.23 -0.18 0.00 0.05 0.00 0.00 58.73 58.34 1vyn h TYR 28 Cb 1.36 -0.09 0.01 0.00 1.01 0.00 0.00 36.73 39.02 1vyn h TYR 28 CO 0.02 0.97 -0.68 0.77 -1.05 0.00 0.00 178.16 178.19 1vyn h SER 29 N 0.30 0.66 0.19 3.88 0.02 -1.33 -3.11 113.55 114.16 1vyn h SER 29 Ca -0.02 -0.72 -0.03 0.00 -0.84 0.00 0.00 61.79 60.19 1vyn h SER 29 Cb 1.24 -0.20 -0.00 0.00 0.14 0.00 0.00 62.40 63.57 1vyn h SER 29 CO 0.12 1.28 -0.12 0.03 -1.14 0.00 0.00 176.83 177.00 1vyn h ARG 30 N 0.10 0.00 -0.06 3.45 -0.00 -1.18 -1.00 114.38 115.68 1vyn h ARG 30 Ca -0.07 0.00 -0.16 0.00 -0.50 0.00 0.00 59.98 59.25 1vyn h ARG 30 Cb 1.36 0.00 -0.01 0.00 0.00 0.00 0.00 29.97 31.32 1vyn h ARG 30 CO 0.14 0.12 -0.66 -0.09 0.00 0.00 0.00 179.97 179.48 1vyn h ARG 31 N 0.00 0.27 -0.01 0.04 2.43 -1.37 -2.83 114.38 112.90 1vyn h ARG 31 Ca -0.00 -0.20 0.00 0.00 -0.81 0.00 0.00 59.98 58.97 1vyn h ARG 31 Cb 0.25 0.04 0.00 0.00 -0.42 0.00 0.00 29.97 29.84 1vyn h ARG 31 CO 0.02 0.83 -0.18 1.97 -1.51 0.00 0.00 179.97 181.10 1vyn n PHE 32 N -3.84 0.00 0.97 2.20 1.16 -0.88 -3.85 117.46 113.22 1vyn n PHE 32 Ca -0.03 0.00 0.13 0.00 -1.87 0.00 0.00 57.45 55.68 1vyn n PHE 32 Cb 0.66 -0.05 0.39 0.00 -1.61 0.00 0.00 39.48 38.87 1vyn n PHE 32 CO 0.00 0.00 0.00 -0.11 -1.87 0.00 0.00 176.76 174.78 1vyn n LEU 33 N -0.03 0.33 0.21 5.98 7.94 -0.43 -4.15 117.00 126.85 1vyn n LEU 33 Ca 0.14 0.22 -0.15 0.00 -1.11 0.00 0.00 56.01 55.11 1vyn n LEU 33 Cb 0.40 -0.34 -0.07 0.00 0.53 0.00 0.00 43.42 43.94 1vyn n LEU 33 CO 0.22 0.06 0.69 -0.08 -1.11 0.00 0.00 177.39 177.17 1vyn h GLU 34 N 0.00 -0.58 -0.10 1.96 4.81 -1.66 -0.39 114.58 118.63 1vyn h GLU 34 Ca 0.00 0.04 -0.07 0.00 -0.13 0.00 0.00 59.36 59.20 1vyn h GLU 34 Cb 0.52 0.13 -0.01 0.00 0.63 0.00 0.00 28.75 30.02 1vyn h GLU 34 CO 0.00 -0.38 -0.26 -1.35 -0.73 0.00 0.00 179.01 176.29 1vyn h PRO 35 N -0.60 0.17 -0.32 0.92 0.11 -1.88 -2.09 132.00 128.31 1vyn h PRO 35 Ca -0.02 -0.05 -0.11 0.00 0.11 0.00 0.00 66.00 65.92 1vyn h PRO 35 Cb 0.52 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 31.60 1vyn h PRO 35 CO -0.01 0.42 -0.25 0.35 -0.21 0.00 0.00 178.00 178.31 1vyn h PHE 36 N 0.15 0.73 0.00 0.65 3.57 -1.65 -3.12 116.94 117.27 1vyn h PHE 36 Ca 0.02 -0.16 0.00 0.00 3.53 0.00 0.00 57.97 61.36 1vyn h PHE 36 Cb 0.54 -0.17 0.00 0.00 2.79 0.00 0.00 35.95 39.11 1vyn h PHE 36 CO 0.01 0.83 -0.83 -0.07 -2.23 0.00 0.00 178.31 176.02 1vyn h LEU 37 N 0.56 0.00 -9.23 0.59 4.07 -0.82 -3.46 115.31 107.02 1vyn h LEU 37 Ca 0.08 -0.08 -0.55 0.00 0.08 0.00 0.00 57.88 57.41 1vyn h LEU 37 Cb 0.72 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 42.45 1vyn h LEU 37 CO 0.06 0.04 1.09 -0.60 -1.08 0.00 0.00 178.44 177.94 1vyn s ARG 38 N -3.29 4.13 0.00 1.13 3.52 -0.81 -2.70 118.95 120.93 1vyn s ARG 38 Ca 0.02 2.11 0.00 0.00 -0.13 0.00 0.00 55.73 57.73 1vyn s ARG 38 Cb 0.10 -3.99 0.00 0.00 -1.56 0.00 0.00 34.95 29.51 1vyn s ARG 38 CO 0.76 -0.91 0.00 0.41 -0.81 0.00 0.00 175.30 174.76 1vyn n GLY 39 N 4.19 1.00 3.76 8.12 0.00 0.14 -4.95 105.19 117.45 1vyn n GLY 39 Ca 0.17 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.96 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 2.62 -0.06 -0.61 -4.36 -1.10 -4.93 121.20 110.76 1vyn s ILE 40 Ca 0.00 -1.63 0.06 0.00 -0.26 0.00 0.00 60.65 58.81 1vyn s ILE 40 Cb 0.00 -2.99 -0.01 0.00 1.25 0.00 0.00 42.46 40.71 1vyn s ILE 40 CO 0.00 -0.07 -0.24 0.54 0.24 0.00 0.00 174.94 175.41 1vyn s ASN 41 N -3.92 2.98 0.07 4.36 2.20 -1.26 0.12 114.94 119.48 1vyn s ASN 41 Ca 0.41 -0.51 0.07 0.00 -0.94 0.00 0.00 52.86 51.90 1vyn s ASN 41 Cb 0.00 -0.93 -0.03 0.00 -2.00 0.00 0.00 41.25 38.30 1vyn s ASN 41 CO 0.24 0.22 -0.19 0.68 -2.94 0.00 0.00 177.10 175.10 1vyn s VAL 42 N -0.04 1.54 -0.59 3.54 -7.23 -0.19 -4.48 120.40 112.95 1vyn s VAL 42 Ca -0.07 -1.32 -0.22 0.00 -1.81 0.00 0.00 61.98 58.56 1vyn s VAL 42 Cb -0.14 -1.38 0.06 0.00 0.56 0.00 0.00 36.38 35.47 1vyn s VAL 42 CO 0.05 0.02 0.89 -0.69 -0.31 0.00 0.00 175.10 175.05 1vyn s VAL 43 N -1.01 4.46 -0.44 1.32 1.01 0.14 -1.28 120.40 124.60 1vyn s VAL 43 Ca 0.05 -0.17 -0.22 0.00 0.00 0.00 0.00 61.98 61.63 1vyn s VAL 43 Cb -0.09 -4.56 0.02 0.00 0.00 0.00 0.00 36.38 31.75 1vyn s VAL 43 CO 0.03 -1.21 0.75 -0.47 0.00 0.00 0.00 175.10 174.20 1vyn s TYR 44 N 3.72 3.02 -0.46 5.22 5.04 0.69 -0.34 117.35 134.25 1vyn s TYR 44 Ca 0.24 0.14 -0.14 0.00 -2.44 0.00 0.00 57.07 54.87 1vyn s TYR 44 Cb -0.16 -3.56 0.07 0.00 0.35 0.00 0.00 41.96 38.66 1vyn s TYR 44 CO 0.14 -0.94 0.37 0.99 -1.34 0.00 0.00 175.55 174.77 1vyn s THR 45 N 3.16 5.07 0.20 4.34 2.01 -0.72 -0.56 115.64 129.14 1vyn s THR 45 Ca 0.28 -1.10 -0.30 0.00 0.31 0.00 0.00 61.69 60.89 1vyn s THR 45 Cb -0.13 -4.03 -0.08 0.00 0.01 0.00 0.00 72.50 68.28 1vyn s THR 45 CO 0.21 -0.55 1.16 -2.84 -0.69 0.00 0.00 174.62 171.91 1vyn s PRO 46 N 1.61 4.54 0.39 4.92 0.02 -1.26 -4.78 135.00 140.45 1vyn s PRO 46 Ca 0.04 1.83 -0.24 0.00 0.02 0.00 0.00 61.00 62.65 1vyn s PRO 46 Cb -0.24 -3.24 -0.12 0.00 0.02 0.00 0.00 34.50 30.92 1vyn s PRO 46 CO 0.06 0.01 0.70 -2.30 -0.33 0.00 0.00 177.00 175.14 1vyn n PRO 47 N 2.21 0.79 0.00 5.54 -0.02 -1.26 -4.79 135.00 137.47 1vyn n PRO 47 Ca 0.03 0.29 0.01 0.00 -2.02 0.00 0.00 63.50 61.80 1vyn n PRO 47 Cb 0.45 -1.64 0.03 0.00 -0.02 0.00 0.00 33.50 32.32 1vyn n PRO 47 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1vyn n GLN 48 N 0.51 0.01 0.08 -0.52 10.64 -1.26 0.04 117.38 126.88 1vyn n GLN 48 Ca 0.11 0.41 0.13 0.00 -1.83 0.00 0.00 57.00 55.83 1vyn n GLN 48 Cb 0.38 -1.50 0.44 0.00 -0.86 0.00 0.00 30.24 28.70 1vyn n GLN 48 CO 0.00 0.00 0.00 -1.13 -1.83 0.00 0.00 177.06 174.10 1vyn n SER 49 N -1.43 0.62 0.01 2.61 3.41 -1.26 -3.56 113.62 114.02 1vyn n SER 49 Ca 0.00 0.53 -0.05 0.00 -0.26 0.00 0.00 58.87 59.10 1vyn n SER 49 Cb 0.01 -0.68 -0.11 0.00 -0.26 0.00 0.00 64.21 63.17 1vyn n SER 49 CO 0.00 0.00 0.00 -0.26 -0.16 0.00 0.00 175.04 174.62 1vyn h PHE 50 N 0.00 0.00 0.00 7.33 -1.00 -0.66 -3.48 116.94 119.13 1vyn h PHE 50 Ca 0.00 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.78 1vyn h PHE 50 Cb 0.68 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.24 1vyn h PHE 50 CO 0.00 0.81 0.00 1.04 -1.61 0.00 0.00 178.31 178.55 1vyn n GLN 51 N -3.02 -0.48 -3.10 1.51 1.13 -1.23 -4.99 117.38 107.20 1vyn n GLN 51 Ca -0.12 0.12 -0.39 0.00 -1.94 0.00 0.00 57.00 54.67 1vyn n GLN 51 Cb 0.95 -3.58 -0.05 0.00 0.11 0.00 0.00 30.24 27.67 1vyn n GLN 51 CO 0.00 0.00 0.00 0.45 -1.44 0.00 0.00 177.06 176.07 1vyn s SER 52 N -2.23 7.11 0.31 1.08 0.15 -1.26 -5.06 113.70 113.80 1vyn s SER 52 Ca 0.00 1.32 -0.26 0.00 0.70 0.00 0.00 55.95 57.72 1vyn s SER 52 Cb 0.00 -2.42 -0.10 0.00 -1.71 0.00 0.00 66.02 61.80 1vyn s SER 52 CO 0.00 0.08 0.92 0.00 1.20 0.00 0.00 173.24 175.45 1vyn s ALA 53 N -0.26 3.23 -0.38 5.45 0.00 -1.26 -4.40 121.76 124.14 1vyn s ALA 53 Ca 0.34 0.49 -0.42 0.00 0.00 0.00 0.00 51.96 52.38 1vyn s ALA 53 Cb -0.20 -3.15 -0.16 0.00 0.00 0.00 0.00 23.12 19.61 1vyn s ALA 53 CO 0.20 0.19 1.85 -2.30 0.00 0.00 0.00 175.76 175.70 1vyn n PRO 54 N 0.60 0.70 -4.30 0.00 -0.02 -1.26 -4.76 135.00 125.96 1vyn n PRO 54 Ca 0.01 0.24 -0.35 0.00 -2.02 0.00 0.00 63.50 61.39 1vyn n PRO 54 Cb 0.50 -1.93 -0.10 0.00 -0.02 0.00 0.00 33.50 31.95 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 4.25 3.37 -0.47 -0.52 1.81 0.27 -4.85 118.95 122.81 1vyn s ARG 55 Ca 1.05 -0.42 -0.26 0.00 -1.72 0.00 0.00 55.73 54.39 1vyn s ARG 55 Cb -1.20 -2.91 0.03 0.00 -0.45 0.00 0.00 34.95 30.42 1vyn s ARG 55 CO 0.67 0.50 0.94 0.08 -0.68 0.00 0.00 175.30 176.81 1vyn s VAL 56 N -0.32 4.45 0.03 3.52 1.01 -1.26 -0.22 120.40 127.61 1vyn s VAL 56 Ca 0.07 0.74 0.03 0.00 0.00 0.00 0.00 61.98 62.82 1vyn s VAL 56 Cb -0.12 -4.45 -0.04 0.00 0.00 0.00 0.00 36.38 31.77 1vyn s VAL 56 CO 0.02 -0.87 -0.02 -0.31 0.00 0.00 0.00 175.10 173.93 1vyn s TYR 57 N 3.82 3.00 -0.27 5.22 2.02 -0.41 -4.94 117.35 125.79 1vyn s TYR 57 Ca 0.37 0.01 -0.15 0.00 -0.37 0.00 0.00 57.07 56.93 1vyn s TYR 57 Cb -0.10 -1.60 -0.04 0.00 -0.40 0.00 0.00 41.96 39.82 1vyn s TYR 57 CO 0.26 0.45 0.40 0.50 -1.57 0.00 0.00 175.55 175.59 1vyn s ARG 58 N -1.80 4.02 -0.27 -0.62 3.00 -1.26 -1.02 118.95 121.00 1vyn s ARG 58 Ca 0.21 0.09 -0.26 0.00 -1.00 0.00 0.00 55.73 54.77 1vyn s ARG 58 Cb -0.11 -3.66 0.00 0.00 0.00 0.00 0.00 34.95 31.18 1vyn s ARG 58 CO 0.12 -0.29 0.90 0.08 0.00 0.00 0.00 175.30 176.11 1vyn s VAL 59 N 2.11 4.73 -1.25 7.11 1.01 0.12 -2.17 120.40 132.07 1vyn s VAL 59 Ca 0.16 1.56 0.26 0.00 0.00 0.00 0.00 61.98 63.96 1vyn s VAL 59 Cb -0.16 -4.21 0.14 0.00 0.00 0.00 0.00 36.38 32.15 1vyn s VAL 59 CO 0.10 -0.22 1.55 -3.20 0.00 0.00 0.00 175.10 173.33 1vyn n ASN 60 N 6.28 0.56 0.00 3.32 5.15 -0.92 0.28 115.26 129.94 1vyn n ASN 60 Ca 0.07 -0.35 0.00 0.00 -0.60 0.00 0.00 54.58 53.70 1vyn n ASN 60 Cb 0.47 0.11 0.00 0.00 -0.53 0.00 0.00 39.78 39.83 1vyn n ASN 60 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1vyn n GLY 61 N 1.44 0.31 3.28 8.20 0.00 -0.99 -4.49 105.19 112.94 1vyn n GLY 61 Ca 0.08 -1.17 -0.19 0.00 0.00 0.00 0.00 46.02 44.74 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 2.43 -0.22 0.99 1.43 -1.26 -0.42 118.68 121.63 1vyn s LEU 62 Ca 0.00 -0.85 -0.15 0.00 -1.03 0.00 0.00 54.13 52.10 1vyn s LEU 62 Cb 0.00 -0.66 -0.04 0.00 0.03 0.00 0.00 46.19 45.52 1vyn s LEU 62 CO 0.00 -0.11 0.39 -0.44 0.23 0.00 0.00 176.35 176.42 1vyn s SER 63 N -2.61 6.39 0.00 2.29 0.01 0.23 -4.80 113.70 115.20 1vyn s SER 63 Ca 0.13 0.45 0.07 0.00 1.31 0.00 0.00 55.95 57.91 1vyn s SER 63 Cb -0.05 -2.22 0.31 0.00 0.21 0.00 0.00 66.02 64.27 1vyn s SER 63 CO 0.04 -0.10 1.20 0.54 0.41 0.00 0.00 173.24 175.33 1vyn n ARG 64 N 4.67 0.02 -3.58 12.44 1.74 -1.26 -2.82 116.66 127.87 1vyn n ARG 64 Ca -0.08 0.35 -0.37 0.00 -0.77 0.00 0.00 57.85 56.98 1vyn n ARG 64 Cb 0.51 -1.50 -0.08 0.00 -1.02 0.00 0.00 32.46 30.37 1vyn n ARG 64 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1vyn s ALA 65 N -2.92 3.60 0.56 7.54 0.00 -1.26 -4.99 121.76 124.30 1vyn s ALA 65 Ca 0.04 -0.69 -0.21 0.00 0.00 0.00 0.00 51.96 51.10 1vyn s ALA 65 Cb 0.05 -2.39 -0.04 0.00 0.00 0.00 0.00 23.12 20.73 1vyn s ALA 65 CO 0.12 -0.12 1.33 -2.14 0.00 0.00 0.00 175.76 174.95 1vyn s PRO 66 N 0.92 3.05 0.59 0.00 0.02 -1.26 -3.33 135.00 134.99 1vyn s PRO 66 Ca 0.12 2.16 0.36 0.00 0.02 0.00 0.00 61.00 63.66 1vyn s PRO 66 Cb -0.13 -2.17 1.80 0.00 0.02 0.00 0.00 34.50 34.02 1vyn s PRO 66 CO 0.04 -1.23 2.16 0.00 -0.33 0.00 0.00 177.00 177.64 1vyn h ALA 67 N 1.29 1.10 0.00 -1.55 0.00 -0.72 0.15 119.26 119.53 1vyn h ALA 67 Ca -0.51 -0.03 -0.06 0.00 0.00 0.00 0.00 54.91 54.31 1vyn h ALA 67 Cb 1.30 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.08 1vyn h ALA 67 CO 0.56 0.04 -0.29 1.03 0.00 0.00 0.00 179.25 180.60 1vyn h SER 68 N 0.00 0.00 -0.00 0.00 0.87 -1.40 -2.47 113.55 110.55 1vyn h SER 68 Ca -0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 1vyn h SER 68 Cb 0.26 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.22 1vyn h SER 68 CO 0.00 0.29 -0.30 -1.54 -0.53 0.00 0.00 176.83 174.75 1vyn n SER 69 N -3.42 0.53 -4.73 6.23 3.41 -0.29 -4.73 113.62 110.62 1vyn n SER 69 Ca 0.00 -0.77 -0.41 0.00 -0.26 0.00 0.00 58.87 57.44 1vyn n SER 69 Cb 0.48 0.86 -0.04 0.00 -0.26 0.00 0.00 64.21 65.25 1vyn n SER 69 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 1vyn s GLU 70 N -1.57 4.56 0.04 4.33 0.41 -0.12 -4.98 118.70 121.38 1vyn s GLU 70 Ca 0.04 1.23 0.03 0.00 -0.41 0.00 0.00 54.97 55.86 1vyn s GLU 70 Cb 0.06 -3.40 -0.04 0.00 -1.78 0.00 0.00 34.13 28.97 1vyn s GLU 70 CO 0.28 0.16 0.03 0.95 -0.49 0.00 0.00 175.26 176.19 1vyn s THR 71 N 0.30 4.26 0.08 3.63 -4.23 -1.26 -2.69 115.64 115.73 1vyn s THR 71 Ca 0.44 -0.74 -0.15 0.00 -1.18 0.00 0.00 61.69 60.06 1vyn s THR 71 Cb -0.21 -2.98 0.03 0.00 1.34 0.00 0.00 72.50 70.68 1vyn s THR 71 CO 0.25 0.24 0.35 0.72 -0.54 0.00 0.00 174.62 175.65 1vyn s PHE 72 N -1.23 -0.15 -0.32 3.99 -0.71 -0.55 -4.93 117.98 114.08 1vyn s PHE 72 Ca 0.24 -0.07 -0.22 0.00 -1.04 0.00 0.00 56.93 55.83 1vyn s PHE 72 Cb -0.12 0.17 0.00 0.00 -1.21 0.00 0.00 43.02 41.86 1vyn s PHE 72 CO 0.16 -0.60 0.74 -2.00 -1.34 0.00 0.00 175.22 172.17 1vyn s GLU 73 N -3.19 3.89 -0.11 1.99 2.12 -1.25 -1.49 118.70 120.66 1vyn s GLU 73 Ca -0.01 0.42 -0.01 0.00 0.36 0.00 0.00 54.97 55.74 1vyn s GLU 73 Cb 0.01 -3.75 0.03 0.00 0.26 0.00 0.00 34.13 30.68 1vyn s GLU 73 CO -0.07 -0.69 -0.06 -1.58 -0.54 0.00 0.00 175.26 172.31 1vyn s HIS 74 N 2.88 1.35 -1.40 5.30 2.46 0.22 -4.75 115.29 121.36 1vyn s HIS 74 Ca 0.30 -0.65 0.00 0.00 0.47 0.00 0.00 55.06 55.18 1vyn s HIS 74 Cb -0.14 -1.16 0.00 0.00 -0.13 0.00 0.00 32.58 31.15 1vyn s HIS 74 CO 0.13 -0.48 0.00 -3.47 -2.47 0.00 0.00 174.74 168.45 1vyn n ASP 75 N 4.98 -4.66 0.00 9.88 2.03 -1.26 -1.01 116.55 126.51 1vyn n ASP 75 Ca -0.12 0.10 0.00 0.00 0.52 0.00 0.00 54.79 55.30 1vyn n ASP 75 Cb 0.50 -3.71 0.00 0.00 -0.72 0.00 0.00 41.12 37.19 1vyn n ASP 75 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1vyn n GLY 76 N -1.04 0.85 3.64 0.27 0.00 -1.26 -5.03 105.19 102.61 1vyn n GLY 76 Ca -0.17 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.52 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 -0.13 2.69 -0.41 1.61 -0.14 -0.18 -5.06 119.74 118.11 1vyn s LYS 77 Ca 0.00 -0.65 -0.20 0.00 -1.36 0.00 0.00 55.97 53.76 1vyn s LYS 77 Cb 0.00 -2.59 0.02 0.00 -1.68 0.00 0.00 37.83 33.57 1vyn s LYS 77 CO 0.00 0.62 0.61 0.15 -0.76 0.00 0.00 175.35 175.97 1vyn s LYS 78 N -1.41 3.36 0.38 1.68 1.02 -1.26 0.70 119.74 124.22 1vyn s LYS 78 Ca 0.18 -0.31 0.07 0.00 0.02 0.00 0.00 55.97 55.92 1vyn s LYS 78 Cb -0.11 -3.91 -0.07 0.00 -0.52 0.00 0.00 37.83 33.21 1vyn s LYS 78 CO 0.08 -0.92 -0.01 0.14 -0.92 0.00 0.00 175.35 173.72 1vyn s VAL 79 N 2.70 1.95 0.01 3.17 -7.23 -0.55 -4.84 120.40 115.60 1vyn s VAL 79 Ca 0.22 -2.06 -0.09 0.00 -1.81 0.00 0.00 61.98 58.24 1vyn s VAL 79 Cb -0.15 -2.86 -0.05 0.00 0.56 0.00 0.00 36.38 33.89 1vyn s VAL 79 CO 0.17 -0.07 0.31 0.42 -0.31 0.00 0.00 175.10 175.63 1vyn s THR 80 N -2.77 5.22 0.52 5.32 -4.23 -1.26 -1.48 115.64 116.97 1vyn s THR 80 Ca 0.34 0.35 0.17 0.00 -1.18 0.00 0.00 61.69 61.37 1vyn s THR 80 Cb 0.08 -3.59 0.28 0.00 1.34 0.00 0.00 72.50 70.60 1vyn s THR 80 CO 0.17 0.41 2.14 0.40 -0.54 0.00 0.00 174.62 177.20 1vyn h ILE 81 N 3.20 0.98 0.03 2.99 2.04 -1.25 0.29 117.51 125.79 1vyn h ILE 81 Ca -0.51 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.35 1vyn h ILE 81 Cb 1.20 0.98 0.00 0.00 -0.74 0.00 0.00 36.82 38.26 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 1.98 -0.04 -0.00 1.87 0.00 -1.75 -1.84 119.26 119.48 1vyn h ALA 82 Ca 0.02 -0.12 -0.15 0.00 0.00 0.00 0.00 54.91 54.66 1vyn h ALA 82 Cb 0.07 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 1vyn h ALA 82 CO -0.00 -0.41 -0.71 1.03 0.00 0.00 0.00 179.25 179.16 1vyn h SER 83 N -0.27 0.01 -0.10 0.00 0.87 -1.68 -2.47 113.55 109.90 1vyn h SER 83 Ca -0.00 -0.00 -0.00 0.00 -1.23 0.00 0.00 61.79 60.55 1vyn h SER 83 Cb 0.25 -0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 62.20 1vyn h SER 83 CO 0.01 0.71 0.06 0.22 -0.53 0.00 0.00 176.83 177.30 1vyn h TYR 84 N 0.00 0.14 -0.24 2.24 3.20 -0.38 0.69 116.97 122.63 1vyn h TYR 84 Ca -0.01 -0.00 -0.11 0.00 3.14 0.00 0.00 58.73 61.75 1vyn h TYR 84 Cb 1.25 -0.05 -0.01 0.00 1.54 0.00 0.00 36.73 39.46 1vyn h TYR 84 CO 0.00 0.18 -0.32 0.74 -1.64 0.00 0.00 178.16 177.11 1vyn h PHE 85 N 0.07 0.58 -0.13 -3.82 0.04 -1.34 -2.15 116.94 110.19 1vyn h PHE 85 Ca 0.04 -0.14 -0.05 0.00 2.80 0.00 0.00 57.97 60.61 1vyn h PHE 85 Cb 0.08 -0.13 -0.01 0.00 2.20 0.00 0.00 35.95 38.09 1vyn h PHE 85 CO -0.04 0.77 -0.17 1.25 -0.60 0.00 0.00 178.31 179.52 1vyn h HIS 86 N 0.43 0.22 0.00 -0.55 2.76 -1.03 0.13 115.15 117.11 1vyn h HIS 86 Ca 0.05 -0.03 -0.09 0.00 -2.20 0.00 0.00 60.37 58.10 1vyn h HIS 86 Cb 0.78 -0.06 -0.01 0.00 1.55 0.00 0.00 27.41 29.66 1vyn h HIS 86 CO 0.03 0.37 -0.52 0.77 -1.30 0.00 0.00 177.93 177.28 1vyn h SER 87 N 0.20 0.00 -0.25 3.26 0.02 -0.61 -3.01 113.55 113.16 1vyn h SER 87 Ca 0.04 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.99 1vyn h SER 87 Cb 0.42 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.96 1vyn h SER 87 CO 0.03 0.42 0.00 0.54 -1.14 0.00 0.00 176.83 176.67 1vyn n ARG 88 N -3.16 2.04 -2.71 3.45 5.12 -0.62 -4.88 116.66 115.90 1vyn n ARG 88 Ca 0.01 -1.10 -0.08 0.00 -1.93 0.00 0.00 57.85 54.75 1vyn n ARG 88 Cb 0.71 -1.48 0.02 0.00 -1.16 0.00 0.00 32.46 30.55 1vyn n ARG 88 CO 0.00 0.00 0.00 -1.71 -1.93 0.00 0.00 177.63 173.99 1vyn n ASN 89 N 0.29 -3.30 -3.47 0.55 4.05 -0.97 -4.69 115.26 107.71 1vyn n ASN 89 Ca 0.10 -0.14 -0.26 0.00 0.45 0.00 0.00 54.58 54.72 1vyn n ASN 89 Cb 0.41 -2.01 -0.12 0.00 1.23 0.00 0.00 39.78 39.29 1vyn n ASN 89 CO 0.00 0.00 0.00 -0.47 -3.05 0.00 0.00 177.26 173.74 1vyn s TYR 90 N -2.95 0.31 -0.32 1.20 5.04 0.34 -4.92 117.35 116.06 1vyn s TYR 90 Ca 0.16 -1.08 -0.29 0.00 -2.44 0.00 0.00 57.07 53.41 1vyn s TYR 90 Cb -0.07 -0.80 -0.01 0.00 0.35 0.00 0.00 41.96 41.44 1vyn s TYR 90 CO 0.19 -0.86 1.53 -1.25 -1.34 0.00 0.00 175.55 173.82 1vyn s PRO 91 N 1.65 3.66 0.22 4.97 0.04 -1.26 -2.74 135.00 141.54 1vyn s PRO 91 Ca 0.13 1.31 -0.32 0.00 0.04 0.00 0.00 61.00 62.17 1vyn s PRO 91 Cb -0.18 -4.03 -0.12 0.00 0.04 0.00 0.00 34.50 30.20 1vyn s PRO 91 CO -0.18 -1.46 1.66 1.28 0.04 0.00 0.00 177.00 178.34 1vyn n LEU 92 N 8.77 3.87 0.07 -3.56 4.77 -1.26 -4.88 117.00 124.78 1vyn n LEU 92 Ca 0.18 1.09 -0.05 0.00 -0.03 0.00 0.00 56.01 57.20 1vyn n LEU 92 Cb 0.47 -1.55 0.14 0.00 -2.33 0.00 0.00 43.42 40.15 1vyn n LEU 92 CO 0.67 0.06 0.52 0.11 -1.33 0.00 0.00 177.39 177.43 1vyn h LYS 93 N 6.09 0.29 -2.33 3.23 1.57 -2.01 -3.38 116.57 120.03 1vyn h LYS 93 Ca -0.44 -0.18 -0.59 0.00 -1.87 0.00 0.00 60.65 57.58 1vyn h LYS 93 Cb 1.22 0.02 -0.38 0.00 0.08 0.00 0.00 32.23 33.16 1vyn h LYS 93 CO 0.90 0.75 -0.98 1.19 -0.57 0.00 0.00 179.45 180.75 1vyn n PHE 94 N -3.93 -0.53 0.28 -1.35 3.01 -1.26 -4.66 117.46 109.02 1vyn n PHE 94 Ca -0.02 -3.42 0.17 0.00 1.01 0.00 0.00 57.45 55.19 1vyn n PHE 94 Cb 0.58 0.08 0.75 0.00 -0.01 0.00 0.00 39.48 40.89 1vyn n PHE 94 CO 0.00 0.00 0.00 -1.35 1.01 0.00 0.00 176.76 176.42 1vyn h PRO 95 N 5.27 0.00 -0.92 -1.08 0.11 -1.98 -3.12 132.00 130.27 1vyn h PRO 95 Ca 0.22 0.00 -0.16 0.00 0.11 0.00 0.00 66.00 66.17 1vyn h PRO 95 Cb 0.89 0.00 -0.10 0.00 0.11 0.00 0.00 31.00 31.91 1vyn h PRO 95 CO 0.41 0.03 0.20 1.04 -0.21 0.00 0.00 178.00 179.47 1vyn n GLN 96 N -3.15 2.12 -3.42 1.05 1.13 -1.26 -1.22 117.38 112.64 1vyn n GLN 96 Ca -0.00 -1.52 -0.35 0.00 -1.94 0.00 0.00 57.00 53.19 1vyn n GLN 96 Cb 0.28 -1.70 -0.06 0.00 0.11 0.00 0.00 30.24 28.87 1vyn n GLN 96 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 1vyn s LEU 97 N -1.54 4.32 0.23 1.08 1.43 -1.18 -4.46 118.68 118.56 1vyn s LEU 97 Ca 0.28 0.99 -0.31 0.00 -1.03 0.00 0.00 54.13 54.06 1vyn s LEU 97 Cb 0.23 -3.23 -0.11 0.00 0.03 0.00 0.00 46.19 43.10 1vyn s LEU 97 CO 0.06 0.10 1.60 -1.00 0.23 0.00 0.00 176.35 177.35 1vyn s HIS 98 N -1.48 2.91 0.07 0.29 3.76 -1.26 -0.26 115.29 119.31 1vyn s HIS 98 Ca 0.37 0.65 -0.30 0.00 -0.15 0.00 0.00 55.06 55.63 1vyn s HIS 98 Cb -0.14 -4.02 -0.09 0.00 1.11 0.00 0.00 32.58 29.43 1vyn s HIS 98 CO 0.19 -3.64 1.84 0.00 -0.85 0.00 0.00 174.74 172.28 1vyn s LEU 100 N 3.44 4.35 -0.44 0.00 2.96 0.18 0.76 118.68 129.93 1vyn s LEU 100 Ca 0.82 2.39 -0.05 0.00 -0.22 0.00 0.00 54.13 57.07 1vyn s LEU 100 Cb -0.43 -3.55 0.12 0.00 0.50 0.00 0.00 46.19 42.83 1vyn s LEU 100 CO 0.37 -0.92 0.26 0.21 -1.32 0.00 0.00 176.35 174.95 1vyn s ASN 101 N 3.03 5.38 0.32 3.68 2.47 0.44 -0.56 114.94 129.69 1vyn s ASN 101 Ca 0.75 -2.06 0.09 0.00 0.42 0.00 0.00 52.86 52.06 1vyn s ASN 101 Cb -0.37 -1.88 -0.05 0.00 -1.45 0.00 0.00 41.25 37.50 1vyn s ASN 101 CO 0.32 -0.57 0.06 0.68 -3.72 0.00 0.00 177.10 173.87 1vyn s VAL 102 N 1.11 3.00 0.00 -5.21 -7.23 -0.38 -2.17 120.40 109.51 1vyn s VAL 102 Ca 0.08 -1.85 0.00 0.00 -1.81 0.00 0.00 61.98 58.40 1vyn s VAL 102 Cb -0.23 -2.88 0.00 0.00 0.56 0.00 0.00 36.38 33.83 1vyn s VAL 102 CO -0.03 -0.24 0.00 0.61 -0.31 0.00 0.00 175.10 175.13 1vyn n GLY 103 N -1.01 0.89 3.53 2.32 0.00 -0.92 -0.93 105.19 109.06 1vyn n GLY 103 Ca -0.04 -1.08 -0.13 0.00 0.00 0.00 0.00 46.02 44.77 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 0.70 0.16 1.61 0.01 0.01 -4.83 113.70 107.36 1vyn s SER 104 Ca 0.00 -1.39 -0.06 0.00 1.31 0.00 0.00 55.95 55.82 1vyn s SER 104 Cb 0.00 0.67 0.03 0.00 0.21 0.00 0.00 66.02 66.93 1vyn s SER 104 CO 0.00 -1.31 1.45 0.77 0.41 0.00 0.00 173.24 174.56 1vyn h SER 105 N 2.13 0.70 0.83 2.44 4.64 -2.01 -3.13 113.55 119.14 1vyn h SER 105 Ca -0.29 -0.40 -0.12 0.00 -0.47 0.00 0.00 61.79 60.51 1vyn h SER 105 Cb 1.24 -0.20 -0.02 0.00 -0.31 0.00 0.00 62.40 63.11 1vyn h SER 105 CO 0.39 1.15 -0.58 0.16 -0.87 0.00 0.00 176.83 177.08 1vyn h ILE 106 N 0.46 1.24 -3.18 0.95 3.07 -2.01 -3.40 117.51 114.64 1vyn h ILE 106 Ca -0.01 -2.11 -0.54 0.00 1.55 0.00 0.00 64.86 63.76 1vyn h ILE 106 Cb 1.19 2.20 -0.40 0.00 -0.27 0.00 0.00 36.82 39.53 1vyn h ILE 106 CO 0.12 0.57 -0.76 -0.75 -1.05 0.00 0.00 178.15 176.27 1vyn s LYS 107 N -3.42 0.63 -0.23 0.16 2.36 -1.19 -5.12 119.74 112.93 1vyn s LYS 107 Ca -0.00 -0.63 -0.07 0.00 -2.55 0.00 0.00 55.97 52.72 1vyn s LYS 107 Cb 0.11 -1.97 -0.03 0.00 -1.05 0.00 0.00 37.83 34.89 1vyn s LYS 107 CO 0.74 -0.79 0.05 -1.12 1.55 0.00 0.00 175.35 175.78 1vyn s SER 108 N 1.81 5.06 -0.37 1.43 0.01 -1.19 -0.81 113.70 119.64 1vyn s SER 108 Ca 0.03 -0.19 -0.12 0.00 1.31 0.00 0.00 55.95 56.99 1vyn s SER 108 Cb -0.17 -1.89 0.02 0.00 0.21 0.00 0.00 66.02 64.18 1vyn s SER 108 CO -0.16 0.01 0.22 -0.63 0.41 0.00 0.00 173.24 173.08 1vyn s ILE 109 N 1.36 4.76 -0.30 1.44 1.01 -0.11 -4.97 121.20 124.39 1vyn s ILE 109 Ca 0.05 -0.72 -0.11 0.00 0.00 0.00 0.00 60.65 59.87 1vyn s ILE 109 Cb -0.15 -3.61 -0.03 0.00 0.01 0.00 0.00 42.46 38.68 1vyn s ILE 109 CO 0.03 -0.20 0.18 -0.76 0.00 0.00 0.00 174.94 174.19 1vyn s LEU 110 N 1.60 4.10 0.33 2.97 1.43 -1.24 -1.25 118.68 126.62 1vyn s LEU 110 Ca 0.03 -0.28 0.05 0.00 -1.03 0.00 0.00 54.13 52.90 1vyn s LEU 110 Cb -0.19 -2.07 -0.07 0.00 0.03 0.00 0.00 46.19 43.90 1vyn s LEU 110 CO 0.07 -0.13 0.04 -0.76 0.23 0.00 0.00 176.35 175.80 1vyn s LEU 111 N 1.69 2.34 -0.03 1.79 1.43 0.27 -4.86 118.68 121.31 1vyn s LEU 111 Ca 0.06 -1.36 -0.11 0.00 -1.03 0.00 0.00 54.13 51.70 1vyn s LEU 111 Cb -0.17 -0.50 -0.05 0.00 0.03 0.00 0.00 46.19 45.50 1vyn s LEU 111 CO 0.09 -0.55 0.30 -2.16 0.23 0.00 0.00 176.35 174.26 1vyn s PRO 112 N -3.84 3.70 0.06 1.29 0.04 -1.26 0.47 135.00 135.45 1vyn s PRO 112 Ca 0.35 0.15 0.14 0.00 0.04 0.00 0.00 61.00 61.68 1vyn s PRO 112 Cb 0.08 -3.17 0.61 0.00 0.04 0.00 0.00 34.50 32.06 1vyn s PRO 112 CO 0.16 0.70 1.44 1.51 0.04 0.00 0.00 177.00 180.85 1vyn n ILE 113 N 1.69 1.13 0.31 0.56 0.13 -1.26 -1.21 119.36 120.71 1vyn n ILE 113 Ca -0.15 0.30 0.16 0.00 -1.10 0.00 0.00 62.75 61.96 1vyn n ILE 113 Cb 0.53 -1.13 0.66 0.00 -0.84 0.00 0.00 39.64 38.85 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 0.00 -0.54 9.51 4.57 -1.96 -2.68 114.58 123.48 1vyn h GLU 114 Ca 0.00 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.18 1vyn h GLU 114 Cb 0.22 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.81 1vyn h GLU 114 CO 0.00 0.00 0.00 1.28 -1.18 0.00 0.00 179.01 179.11 1vyn n LEU 115 N -2.85 5.45 -4.03 1.64 4.77 -0.35 -4.90 117.00 116.74 1vyn n LEU 115 Ca 0.01 -2.93 -0.20 0.00 -0.03 0.00 0.00 56.01 52.86 1vyn n LEU 115 Cb 0.27 -0.66 -0.15 0.00 -2.33 0.00 0.00 43.42 40.55 1vyn n LEU 115 CO 0.25 0.65 -0.44 0.00 -1.33 0.00 0.00 177.39 176.51 1vyn s SER 117 N -0.05 4.03 -0.04 0.00 0.01 0.54 -0.90 113.70 117.30 1vyn s SER 117 Ca 0.01 -0.30 -0.08 0.00 1.31 0.00 0.00 55.95 56.88 1vyn s SER 117 Cb -0.06 -0.77 -0.05 0.00 0.21 0.00 0.00 66.02 65.35 1vyn s SER 117 CO 0.00 0.29 0.25 -0.51 0.41 0.00 0.00 173.24 173.68 1vyn s ILE 118 N -0.88 5.31 -0.39 1.44 2.07 0.17 0.27 121.20 129.19 1vyn s ILE 118 Ca 0.14 0.33 -0.29 0.00 -1.41 0.00 0.00 60.65 59.42 1vyn s ILE 118 Cb -0.11 -3.54 0.02 0.00 0.13 0.00 0.00 42.46 38.96 1vyn s ILE 118 CO 0.04 0.50 1.13 -0.70 -1.91 0.00 0.00 174.94 174.00 1vyn s GLU 119 N -1.37 3.89 0.00 3.50 2.12 -1.26 -0.52 118.70 125.07 1vyn s GLU 119 Ca 0.22 0.86 0.11 0.00 0.36 0.00 0.00 54.97 56.52 1vyn s GLU 119 Cb -0.14 -3.83 0.63 0.00 0.26 0.00 0.00 34.13 31.06 1vyn s GLU 119 CO 0.11 -1.15 1.07 -0.85 -0.54 0.00 0.00 175.26 173.91