#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vhq s LYS 6 N 0.00 3.26 -0.30 1.97 -0.14 -1.26 -1.07 119.74 122.20 1vhq s LYS 6 Ca 0.00 -0.78 -0.09 0.00 -1.36 0.00 0.00 55.97 53.74 1vhq s LYS 6 Cb 0.00 -3.65 -0.01 0.00 -1.68 0.00 0.00 37.83 32.49 1vhq s LYS 6 CO 0.00 -0.48 0.14 0.42 -0.76 0.00 0.00 175.35 174.66 1vhq s ILE 7 N 1.62 4.53 0.02 2.17 -1.09 0.15 -0.39 121.20 128.20 1vhq s ILE 7 Ca 0.04 -0.39 -0.30 0.00 -2.23 0.00 0.00 60.65 57.78 1vhq s ILE 7 Cb -0.18 -3.28 -0.04 0.00 -1.58 0.00 0.00 42.46 37.39 1vhq s ILE 7 CO 0.07 0.11 0.96 -0.83 -1.23 0.00 0.00 174.94 174.02 1vhq s GLY 8 N 1.61 2.91 -0.18 6.18 0.00 -0.24 -0.25 107.32 117.35 1vhq s GLY 8 Ca 0.05 0.52 0.00 0.00 0.00 0.00 0.00 44.72 45.29 1vhq s GLY 8 CO 0.06 1.62 -0.16 0.14 0.00 0.00 0.00 173.10 174.75 1vhq s VAL 9 N 0.81 2.39 -0.23 1.40 1.01 -0.18 -0.03 120.40 125.57 1vhq s VAL 9 Ca 0.50 -0.83 -0.09 0.00 0.00 0.00 0.00 61.98 61.56 1vhq s VAL 9 Cb -0.21 -2.02 -0.04 0.00 0.00 0.00 0.00 36.38 34.10 1vhq s VAL 9 CO 0.28 0.51 0.10 -0.63 0.00 0.00 0.00 175.10 175.37 1vhq s ILE 10 N 1.23 4.86 0.25 2.22 -1.09 -0.74 -1.61 121.20 126.32 1vhq s ILE 10 Ca 0.03 0.00 0.09 0.00 -2.23 0.00 0.00 60.65 58.54 1vhq s ILE 10 Cb -0.14 -3.25 -0.04 0.00 -1.58 0.00 0.00 42.46 37.45 1vhq s ILE 10 CO -0.08 0.37 0.02 -0.76 -1.23 0.00 0.00 174.94 173.25 1vhq s LEU 11 N 1.07 3.28 -0.01 2.97 1.43 0.25 -4.10 118.68 123.55 1vhq s LEU 11 Ca 0.05 -0.57 0.02 0.00 -1.03 0.00 0.00 54.13 52.60 1vhq s LEU 11 Cb -0.14 -1.82 0.03 0.00 0.03 0.00 0.00 46.19 44.30 1vhq s LEU 11 CO 0.04 0.01 0.88 -1.54 0.23 0.00 0.00 176.35 175.97 1vhq n SER 12 N -0.83 1.39 0.00 2.29 3.41 -1.26 -4.30 113.62 114.32 1vhq n SER 12 Ca -0.07 -1.85 0.00 0.00 -0.26 0.00 0.00 58.87 56.69 1vhq n SER 12 Cb 0.58 -0.06 0.00 0.00 -0.26 0.00 0.00 64.21 64.47 1vhq n SER 12 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1vhq n GLY 13 N -0.44 0.80 2.45 5.00 0.00 -1.26 -4.31 105.19 107.44 1vhq n GLY 13 Ca 0.02 -1.79 -0.28 0.00 0.00 0.00 0.00 46.02 43.96 1vhq n GLY 13 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1vhq n GLY 15 N 3.57 4.50 0.33 0.00 0.00 0.31 -4.85 105.19 109.06 1vhq n GLY 15 Ca 0.18 -0.72 0.16 0.00 0.00 0.00 0.00 46.02 45.65 1vhq n GLY 15 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 1vhq h VAL 16 N 0.00 0.52 0.00 1.61 3.04 -1.78 0.62 116.25 120.25 1vhq h VAL 16 Ca 0.00 -0.18 0.00 0.00 -1.01 0.00 0.00 66.70 65.51 1vhq h VAL 16 Cb 0.00 -0.05 0.00 0.00 -2.01 0.00 0.00 31.29 29.23 1vhq h VAL 16 CO 0.00 0.09 -0.14 1.88 -1.01 0.00 0.00 177.57 178.40 1vhq h TYR 17 N 0.52 0.00 0.00 3.17 0.05 -1.95 0.26 116.97 119.03 1vhq h TYR 17 Ca 0.61 0.00 -0.06 0.00 0.05 0.00 0.00 58.73 59.33 1vhq h TYR 17 Cb 1.17 0.00 -0.13 0.00 1.01 0.00 0.00 36.73 38.78 1vhq h TYR 17 CO -0.05 0.00 -0.62 -0.40 -1.05 0.00 0.00 178.16 176.04 1vhq n ASP 18 N -2.80 0.27 0.00 3.88 5.68 -1.01 -4.59 116.55 117.98 1vhq n ASP 18 Ca 0.04 -1.93 0.00 0.00 -0.50 0.00 0.00 54.79 52.40 1vhq n ASP 18 Cb 0.50 -0.20 0.00 0.00 -1.14 0.00 0.00 41.12 40.29 1vhq n ASP 18 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1vhq n GLY 19 N 0.16 2.02 3.79 6.12 0.00 0.18 -4.53 105.19 112.93 1vhq n GLY 19 Ca 0.01 -0.30 -0.38 0.00 0.00 0.00 0.00 46.02 45.35 1vhq n GLY 19 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1vhq s SER 20 N 2.00 7.29 -0.09 1.61 0.01 -1.06 -0.87 113.70 122.58 1vhq s SER 20 Ca 0.00 1.59 -0.31 0.00 1.31 0.00 0.00 55.95 58.54 1vhq s SER 20 Cb 0.00 -2.48 -0.09 0.00 0.21 0.00 0.00 66.02 63.66 1vhq s SER 20 CO 0.00 0.14 2.03 1.21 0.41 0.00 0.00 173.24 177.03 1vhq n GLU 21 N 1.26 2.34 -0.04 12.44 0.00 -0.36 -0.53 120.64 135.76 1vhq n GLU 21 Ca -0.04 0.81 -0.11 0.00 0.00 0.00 0.00 57.16 57.81 1vhq n GLU 21 Cb 0.49 -2.94 -0.05 0.00 0.00 0.00 0.00 31.44 28.95 1vhq n GLU 21 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.13 177.95 1vhq h ILE 22 N 6.08 1.13 -0.65 6.31 2.04 -1.91 -0.00 117.51 130.51 1vhq h ILE 22 Ca -0.46 -0.39 0.01 0.00 1.00 0.00 0.00 64.86 65.03 1vhq h ILE 22 Cb 1.25 1.11 -0.04 0.00 -0.74 0.00 0.00 36.82 38.41 1vhq h ILE 22 CO 0.95 0.12 0.42 0.45 0.00 0.00 0.00 178.15 180.10 1vhq h HIS 23 N 0.11 0.79 -0.30 1.37 3.86 -1.99 -1.79 115.15 117.20 1vhq h HIS 23 Ca 0.05 0.02 -0.00 0.00 -1.16 0.00 0.00 60.37 59.28 1vhq h HIS 23 Cb 0.13 -0.26 -0.01 0.00 1.06 0.00 0.00 27.41 28.32 1vhq h HIS 23 CO -0.02 0.48 0.18 0.93 0.86 0.00 0.00 177.93 180.35 1vhq h GLU 24 N 0.84 0.42 -0.53 2.45 5.08 -1.88 0.12 114.58 121.07 1vhq h GLU 24 Ca 0.24 -0.04 -0.00 0.00 -1.00 0.00 0.00 59.36 58.56 1vhq h GLU 24 Cb -0.06 -0.08 -0.03 0.00 0.50 0.00 0.00 28.75 29.08 1vhq h GLU 24 CO -0.07 0.34 0.31 0.00 -1.00 0.00 0.00 179.01 178.59 1vhq h ALA 25 N 1.06 0.68 -0.34 3.43 0.00 -0.94 -1.11 119.26 122.02 1vhq h ALA 25 Ca 0.11 -0.07 -0.11 0.00 0.00 0.00 0.00 54.91 54.84 1vhq h ALA 25 Cb 0.03 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 1vhq h ALA 25 CO -0.02 0.17 -0.21 0.28 0.00 0.00 0.00 179.25 179.48 1vhq h VAL 26 N 0.71 1.29 -0.13 0.00 2.07 -1.15 -1.48 116.25 117.56 1vhq h VAL 26 Ca 0.19 -1.34 -0.04 0.00 0.82 0.00 0.00 66.70 66.33 1vhq h VAL 26 Cb 0.00 1.41 -0.01 0.00 -1.52 0.00 0.00 31.29 31.17 1vhq h VAL 26 CO -0.03 0.44 -0.10 -0.07 0.02 0.00 0.00 177.57 177.83 1vhq h LEU 27 N 0.53 0.19 -0.22 2.57 3.38 -0.69 0.12 115.31 121.19 1vhq h LEU 27 Ca 0.07 -0.03 -0.05 0.00 0.09 0.00 0.00 57.88 57.96 1vhq h LEU 27 Cb 0.76 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.45 1vhq h LEU 27 CO 0.06 0.32 -0.07 0.74 0.09 0.00 0.00 178.44 179.58 1vhq h THR 28 N 0.20 1.29 -0.73 0.22 2.02 -0.78 -0.51 112.91 114.61 1vhq h THR 28 Ca 0.04 -1.08 -0.03 0.00 0.77 0.00 0.00 66.41 66.12 1vhq h THR 28 Cb 0.30 1.55 -0.03 0.00 -1.74 0.00 0.00 68.15 68.23 1vhq h THR 28 CO 0.02 0.33 0.35 -0.07 0.37 0.00 0.00 175.52 176.52 1vhq h LEU 29 N 0.16 0.95 -0.11 2.58 3.38 -0.76 -0.98 115.31 120.53 1vhq h LEU 29 Ca 0.05 -0.13 -0.00 0.00 0.09 0.00 0.00 57.88 57.89 1vhq h LEU 29 Cb 0.53 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 41.03 1vhq h LEU 29 CO 0.02 0.82 0.06 0.25 0.09 0.00 0.00 178.44 179.69 1vhq h LEU 30 N 1.02 0.14 -0.87 1.67 5.85 -0.50 -0.76 115.31 121.87 1vhq h LEU 30 Ca 0.25 -0.07 -0.05 0.00 0.84 0.00 0.00 57.88 58.85 1vhq h LEU 30 Cb 0.12 -0.03 -0.03 0.00 0.37 0.00 0.00 40.66 41.08 1vhq h LEU 30 CO -0.03 0.16 0.21 0.00 -0.34 0.00 0.00 178.44 178.44 1vhq h ALA 31 N 0.98 1.08 0.13 1.25 0.00 -0.83 0.88 119.26 122.76 1vhq h ALA 31 Ca 0.04 -0.21 -0.01 0.00 0.00 0.00 0.00 54.91 54.73 1vhq h ALA 31 Cb 0.05 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 17.58 1vhq h ALA 31 CO -0.01 0.62 -0.06 0.82 0.00 0.00 0.00 179.25 180.62 1vhq h ILE 32 N 1.01 0.95 -0.50 0.00 2.04 -1.05 -1.98 117.51 117.98 1vhq h ILE 32 Ca 0.22 -0.32 -0.01 0.00 1.00 0.00 0.00 64.86 65.75 1vhq h ILE 32 Cb 0.29 1.15 -0.02 0.00 -0.74 0.00 0.00 36.82 37.49 1vhq h ILE 32 CO -0.01 0.08 0.27 -1.28 0.00 0.00 0.00 178.15 177.21 1vhq h SER 33 N -0.33 0.62 -0.04 1.72 0.87 -0.98 -1.88 113.55 113.54 1vhq h SER 33 Ca -0.02 -0.09 -0.04 0.00 -1.23 0.00 0.00 61.79 60.41 1vhq h SER 33 Cb 0.27 -0.16 -0.01 0.00 -0.44 0.00 0.00 62.40 62.06 1vhq h SER 33 CO 0.03 0.53 -0.08 0.03 -0.53 0.00 0.00 176.83 176.82 1vhq h ARG 34 N 0.66 0.27 -0.08 2.24 3.08 -0.81 -2.49 114.38 117.26 1vhq h ARG 34 Ca 0.17 -0.06 0.00 0.00 0.07 0.00 0.00 59.98 60.17 1vhq h ARG 34 Cb 0.05 -0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.06 1vhq h ARG 34 CO -0.03 0.37 0.00 0.43 -1.07 0.00 0.00 179.97 179.67 1vhq n SER 35 N -4.31 0.54 -0.39 7.04 7.64 -0.75 -4.90 113.62 118.49 1vhq n SER 35 Ca -0.00 -1.81 -0.04 0.00 1.01 0.00 0.00 58.87 58.03 1vhq n SER 35 Cb 0.24 -0.06 -0.01 0.00 -1.01 0.00 0.00 64.21 63.38 1vhq n SER 35 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1vhq n GLY 36 N 0.75 0.35 3.67 0.23 0.00 -0.94 -5.06 105.19 104.20 1vhq n GLY 36 Ca 0.08 -0.78 -0.26 0.00 0.00 0.00 0.00 46.02 45.06 1vhq n GLY 36 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1vhq s ALA 37 N -2.18 3.35 -0.22 4.61 0.00 -0.72 -4.57 121.76 122.04 1vhq s ALA 37 Ca 0.00 -2.15 -0.03 0.00 0.00 0.00 0.00 51.96 49.78 1vhq s ALA 37 Cb 0.00 -0.18 -0.00 0.00 0.00 0.00 0.00 23.12 22.93 1vhq s ALA 37 CO 0.00 -0.10 -0.06 -1.14 0.00 0.00 0.00 175.76 174.46 1vhq s GLN 38 N -3.79 3.31 0.12 0.00 2.00 -0.23 -4.11 119.66 116.96 1vhq s GLN 38 Ca 0.38 -0.66 -0.30 0.00 -2.00 0.00 0.00 55.36 52.77 1vhq s GLN 38 Cb 0.05 -2.97 -0.06 0.00 0.80 0.00 0.00 33.01 30.83 1vhq s GLN 38 CO 0.20 -0.21 1.04 0.00 -0.50 0.00 0.00 175.29 175.82 1vhq s ALA 39 N 1.45 3.30 -0.29 1.58 0.00 -1.26 0.29 121.76 126.84 1vhq s ALA 39 Ca 0.05 0.69 0.02 0.00 0.00 0.00 0.00 51.96 52.72 1vhq s ALA 39 Cb -0.14 -3.33 0.08 0.00 0.00 0.00 0.00 23.12 19.73 1vhq s ALA 39 CO -0.04 -0.15 -0.00 0.08 0.00 0.00 0.00 175.76 175.64 1vhq s VAL 40 N 0.11 1.77 -0.01 0.00 1.01 0.65 -4.86 120.40 119.07 1vhq s VAL 40 Ca 0.49 -1.68 -0.06 0.00 0.00 0.00 0.00 61.98 60.73 1vhq s VAL 40 Cb -0.26 -2.14 -0.05 0.00 0.00 0.00 0.00 36.38 33.93 1vhq s VAL 40 CO 0.31 -0.35 0.24 0.00 0.00 0.00 0.00 175.10 175.31 1vhq s PHE 42 N -1.26 0.70 -0.05 0.00 0.08 -0.63 -1.97 117.98 114.85 1vhq s PHE 42 Ca 0.26 -1.02 -0.20 0.00 0.12 0.00 0.00 56.93 56.08 1vhq s PHE 42 Cb -0.13 -0.45 0.04 0.00 -0.57 0.00 0.00 43.02 41.91 1vhq s PHE 42 CO 0.15 -0.30 0.45 0.00 -0.10 0.00 0.00 175.22 175.42 1vhq s ALA 43 N -3.81 -1.16 0.33 5.36 0.00 -0.95 -0.58 121.76 120.95 1vhq s ALA 43 Ca 0.10 0.79 -0.29 0.00 0.00 0.00 0.00 51.96 52.57 1vhq s ALA 43 Cb 0.07 -0.07 -0.10 0.00 0.00 0.00 0.00 23.12 23.01 1vhq s ALA 43 CO -0.07 -0.29 1.32 -1.25 0.00 0.00 0.00 175.76 175.47 1vhq s PRO 44 N -1.05 4.35 -0.93 0.00 0.04 -1.26 -0.99 135.00 135.15 1vhq s PRO 44 Ca -0.11 2.23 -0.18 0.00 0.04 0.00 0.00 61.00 62.98 1vhq s PRO 44 Cb -0.03 -3.07 0.14 0.00 0.04 0.00 0.00 34.50 31.58 1vhq s PRO 44 CO 0.06 -0.21 1.09 0.34 0.04 0.00 0.00 177.00 178.32 1vhq s ASP 45 N -0.44 6.66 0.20 6.66 2.15 -1.26 -3.38 116.67 127.26 1vhq s ASP 45 Ca 0.49 -2.15 -0.20 0.00 0.43 0.00 0.00 52.55 51.12 1vhq s ASP 45 Cb -0.40 -2.38 0.04 0.00 -0.30 0.00 0.00 42.92 39.88 1vhq s ASP 45 CO 0.53 -1.00 0.60 -1.59 -0.17 0.00 0.00 175.17 173.54 1vhq s LYS 46 N 2.35 1.45 0.28 4.34 -2.85 -1.26 -5.01 119.74 119.03 1vhq s LYS 46 Ca 0.31 -0.76 -0.29 0.00 -1.00 0.00 0.00 55.97 54.23 1vhq s LYS 46 Cb -0.05 0.57 -0.09 0.00 -2.06 0.00 0.00 37.83 36.19 1vhq s LYS 46 CO -0.09 -0.64 1.13 -1.14 0.10 0.00 0.00 175.35 174.72 1vhq s GLN 47 N -3.84 4.59 0.66 1.78 0.74 -1.26 -0.78 119.66 121.54 1vhq s GLN 47 Ca 0.07 1.86 -0.17 0.00 0.05 0.00 0.00 55.36 57.17 1vhq s GLN 47 Cb -0.02 -3.18 -0.00 0.00 1.10 0.00 0.00 33.01 30.90 1vhq s GLN 47 CO -0.04 0.13 1.26 -0.65 -0.55 0.00 0.00 175.29 175.44 1vhq s GLN 48 N -1.35 2.51 0.39 1.67 -0.21 0.43 -4.74 119.66 118.36 1vhq s GLN 48 Ca 0.46 1.96 0.18 0.00 0.02 0.00 0.00 55.36 57.98 1vhq s GLN 48 Cb -0.33 -1.85 0.81 0.00 1.00 0.00 0.00 33.01 32.64 1vhq s GLN 48 CO 0.42 -1.60 1.82 -0.39 -2.12 0.00 0.00 175.29 173.42 1vhq h VAL 49 N 0.40 0.99 -3.41 1.09 -1.51 -1.89 -3.44 116.25 108.48 1vhq h VAL 49 Ca -0.50 -1.30 -0.01 0.00 -1.23 0.00 0.00 66.70 63.65 1vhq h VAL 49 Cb 1.32 1.76 -0.07 0.00 -2.13 0.00 0.00 31.29 32.17 1vhq h VAL 49 CO 0.53 0.34 0.02 1.51 -1.23 0.00 0.00 177.57 178.73 1vhq s ASP 50 N -6.58 -0.13 -0.09 4.19 1.47 -1.26 -5.12 116.67 109.15 1vhq s ASP 50 Ca -0.02 -0.83 0.00 0.00 1.18 0.00 0.00 52.55 52.89 1vhq s ASP 50 Cb 0.13 0.65 0.02 0.00 -0.34 0.00 0.00 42.92 43.37 1vhq s ASP 50 CO 0.69 -1.24 -0.08 -0.69 0.68 0.00 0.00 175.17 174.53 1vhq s VAL 51 N -3.91 0.98 -0.09 2.11 1.01 -1.26 -4.84 120.40 114.40 1vhq s VAL 51 Ca 0.18 -0.31 0.03 0.00 0.00 0.00 0.00 61.98 61.88 1vhq s VAL 51 Cb -0.03 -0.98 -0.01 0.00 0.00 0.00 0.00 36.38 35.36 1vhq s VAL 51 CO 0.09 0.35 -0.18 -0.63 0.00 0.00 0.00 175.10 174.73 1vhq s ILE 52 N 1.37 2.68 -0.34 2.22 -1.09 -1.26 -4.53 121.20 120.24 1vhq s ILE 52 Ca -0.02 -0.82 -0.29 0.00 -2.23 0.00 0.00 60.65 57.29 1vhq s ILE 52 Cb -0.14 -2.06 0.00 0.00 -1.58 0.00 0.00 42.46 38.69 1vhq s ILE 52 CO -0.04 0.56 1.33 0.21 -1.23 0.00 0.00 174.94 175.76 1vhq s ASN 53 N -0.03 6.58 0.00 3.58 3.84 0.39 -4.88 114.94 124.42 1vhq s ASN 53 Ca -0.05 1.07 0.22 0.00 0.21 0.00 0.00 52.86 54.31 1vhq s ASN 53 Cb -0.14 -2.54 0.98 0.00 -0.55 0.00 0.00 41.25 39.00 1vhq s ASN 53 CO 0.04 -1.19 1.72 1.41 -2.79 0.00 0.00 177.10 176.30 1vhq n HIS 54 N 7.97 0.00 0.09 0.43 8.25 -1.26 0.95 115.22 131.64 1vhq n HIS 54 Ca 0.15 0.00 -0.23 0.00 -0.26 0.00 0.00 57.72 57.38 1vhq n HIS 54 Cb 0.47 -0.47 -0.15 0.00 1.12 0.00 0.00 29.99 30.96 1vhq n HIS 54 CO 0.00 0.00 0.00 1.25 0.64 0.00 0.00 176.34 178.23 1vhq h LEU 55 N 0.00 0.65 0.00 2.41 5.85 -1.97 -3.39 115.31 118.86 1vhq h LEU 55 Ca 0.00 -0.92 0.00 0.00 0.84 0.00 0.00 57.88 57.80 1vhq h LEU 55 Cb 0.37 -0.21 0.00 0.00 0.37 0.00 0.00 40.66 41.18 1vhq h LEU 55 CO 0.00 1.69 -1.45 0.35 -0.34 0.00 0.00 178.44 178.69 1vhq n THR 56 N -3.76 0.00 -0.84 1.05 -2.24 -1.08 -4.99 114.28 102.42 1vhq n THR 56 Ca -0.21 -0.30 0.00 0.00 -2.27 0.00 0.00 64.05 61.28 1vhq n THR 56 Cb 1.03 0.35 0.00 0.00 -2.10 0.00 0.00 70.33 69.61 1vhq n THR 56 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1vhq n GLY 57 N 1.60 0.91 3.81 3.38 0.00 0.27 -5.02 105.19 110.14 1vhq n GLY 57 Ca -0.01 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.66 1vhq n GLY 57 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1vhq s GLU 58 N -0.16 4.29 0.13 1.61 2.02 -1.22 -4.76 118.70 120.61 1vhq s GLU 58 Ca 0.00 1.05 -0.02 0.00 0.02 0.00 0.00 54.97 56.02 1vhq s GLU 58 Cb 0.00 -2.51 0.03 0.00 0.10 0.00 0.00 34.13 31.75 1vhq s GLU 58 CO 0.00 0.16 0.12 0.00 0.02 0.00 0.00 175.26 175.56 1vhq n ALA 59 N -0.03 -0.37 -3.17 5.21 0.00 -1.26 -0.46 120.51 120.43 1vhq n ALA 59 Ca 0.03 -0.18 -0.22 0.00 0.00 0.00 0.00 53.44 53.07 1vhq n ALA 59 Cb 0.52 -0.01 -0.05 0.00 0.00 0.00 0.00 19.45 19.91 1vhq n ALA 59 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1vhq n THR 61 N -2.74 0.61 -3.92 0.00 -2.24 -1.26 -4.86 114.28 99.87 1vhq n THR 61 Ca 0.02 -4.71 -0.09 0.00 -2.27 0.00 0.00 64.05 56.99 1vhq n THR 61 Cb 0.06 -1.10 -0.06 0.00 -2.10 0.00 0.00 70.33 67.13 1vhq n THR 61 CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 1vhq s GLU 62 N -2.33 1.19 0.06 -0.78 -1.05 -1.26 -5.17 118.70 109.36 1vhq s GLU 62 Ca 0.41 -1.11 0.07 0.00 -0.15 0.00 0.00 54.97 54.19 1vhq s GLU 62 Cb 0.27 0.40 -0.03 0.00 -0.44 0.00 0.00 34.13 34.34 1vhq s GLU 62 CO -0.09 -0.45 -0.20 0.95 0.95 0.00 0.00 175.26 176.42 1vhq s THR 63 N -3.95 1.59 0.04 1.83 -4.23 -1.26 -4.54 115.64 105.12 1vhq s THR 63 Ca 0.15 -1.30 -0.00 0.00 -1.18 0.00 0.00 61.69 59.36 1vhq s THR 63 Cb 0.03 -1.41 -0.03 0.00 1.34 0.00 0.00 72.50 72.42 1vhq s THR 63 CO -0.01 0.07 -0.03 -0.13 -0.54 0.00 0.00 174.62 173.98 1vhq s ARG 64 N -1.45 0.51 -0.18 3.99 0.52 -1.26 -5.06 118.95 116.02 1vhq s ARG 64 Ca 0.06 -0.98 -0.15 0.00 -0.52 0.00 0.00 55.73 54.14 1vhq s ARG 64 Cb -0.09 0.13 -0.04 0.00 0.52 0.00 0.00 34.95 35.47 1vhq s ARG 64 CO 0.03 -0.08 0.36 1.21 0.02 0.00 0.00 175.30 176.84 1vhq s ASN 65 N -2.32 6.45 0.19 0.23 3.84 -1.26 -0.43 114.94 121.64 1vhq s ASN 65 Ca -0.02 0.53 -0.13 0.00 0.21 0.00 0.00 52.86 53.45 1vhq s ASN 65 Cb 0.00 -2.21 0.21 0.00 -0.55 0.00 0.00 41.25 38.70 1vhq s ASN 65 CO -0.06 0.01 1.67 0.58 -2.79 0.00 0.00 177.10 176.51 1vhq h VAL 66 N 4.86 0.56 -0.22 -5.21 2.07 -1.20 -0.51 116.25 116.61 1vhq h VAL 66 Ca -0.39 -0.03 -0.05 0.00 0.82 0.00 0.00 66.70 67.05 1vhq h VAL 66 Cb 1.17 0.46 -0.01 0.00 -1.52 0.00 0.00 31.29 31.39 1vhq h VAL 66 CO 0.73 0.02 -0.07 0.25 0.02 0.00 0.00 177.57 178.52 1vhq h LEU 67 N 0.09 0.44 -1.16 2.57 5.85 -1.76 -0.05 115.31 121.30 1vhq h LEU 67 Ca 0.27 -0.38 -0.00 0.00 0.84 0.00 0.00 57.88 58.60 1vhq h LEU 67 Cb 0.41 -0.12 -0.04 0.00 0.37 0.00 0.00 40.66 41.28 1vhq h LEU 67 CO -0.46 0.72 0.49 0.40 -0.34 0.00 0.00 178.44 179.26 1vhq h ILE 68 N 0.15 1.22 -0.04 4.05 2.04 -1.86 -2.07 117.51 120.99 1vhq h ILE 68 Ca 0.05 -0.45 -0.21 0.00 1.00 0.00 0.00 64.86 65.25 1vhq h ILE 68 Cb 0.54 0.08 0.00 0.00 -0.74 0.00 0.00 36.82 36.71 1vhq h ILE 68 CO 0.03 0.22 -0.86 -0.33 0.00 0.00 0.00 178.15 177.20 1vhq h GLU 69 N 1.09 0.47 0.00 2.37 4.39 -0.94 -3.03 114.58 118.93 1vhq h GLU 69 Ca 0.29 -0.45 0.00 0.00 0.34 0.00 0.00 59.36 59.54 1vhq h GLU 69 Cb -0.07 0.11 0.00 0.00 -0.10 0.00 0.00 28.75 28.69 1vhq h GLU 69 CO -0.06 1.09 0.00 0.00 -1.16 0.00 0.00 179.01 178.89 1vhq h ALA 70 N 0.76 1.00 0.00 3.43 0.00 -0.76 -1.36 119.26 122.33 1vhq h ALA 70 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.85 1vhq h ALA 70 Cb 1.48 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.27 1vhq h ALA 70 CO 0.15 0.00 0.00 0.00 0.00 0.00 0.00 179.25 179.40 1vhq h ALA 71 N 2.09 1.00 -0.43 0.00 0.00 -1.25 -1.88 119.26 118.79 1vhq h ALA 71 Ca 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 54.91 54.80 1vhq h ALA 71 Cb 0.38 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 1vhq h ALA 71 CO 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 179.25 179.08 1vhq h ARG 72 N 0.00 0.87 -0.03 0.00 3.08 -1.37 0.14 114.38 117.07 1vhq h ARG 72 Ca 0.00 -0.36 -0.09 0.00 0.07 0.00 0.00 59.98 59.60 1vhq h ARG 72 Cb 0.43 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.43 1vhq h ARG 72 CO 0.00 1.01 -0.40 0.82 -1.07 0.00 0.00 179.97 180.32 1vhq h ILE 73 N 0.69 1.30 -0.58 2.04 2.04 -1.51 -3.17 117.51 118.31 1vhq h ILE 73 Ca 0.10 -1.42 0.00 0.00 1.00 0.00 0.00 64.86 64.54 1vhq h ILE 73 Cb 0.73 1.73 0.00 0.00 -0.74 0.00 0.00 36.82 38.54 1vhq h ILE 73 CO 0.06 0.41 0.00 0.35 0.00 0.00 0.00 178.15 178.97 1vhq n THR 74 N -4.05 1.50 -3.40 -0.27 -2.24 -1.16 -4.95 114.28 99.71 1vhq n THR 74 Ca -0.02 -1.17 -0.25 0.00 -2.27 0.00 0.00 64.05 60.35 1vhq n THR 74 Cb 0.44 0.26 0.02 0.00 -2.10 0.00 0.00 70.33 68.96 1vhq n THR 74 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1vhq n ARG 75 N 1.01 -4.69 -0.29 -0.78 1.74 -0.78 -1.43 116.66 111.45 1vhq n ARG 75 Ca 0.22 0.67 0.00 0.00 -0.77 0.00 0.00 57.85 57.97 1vhq n ARG 75 Cb 0.74 -5.49 0.00 0.00 -1.02 0.00 0.00 32.46 26.68 1vhq n ARG 75 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1vhq n GLY 76 N -1.47 1.91 3.19 -0.13 0.00 -0.03 -4.96 105.19 103.70 1vhq n GLY 76 Ca -0.03 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.56 1vhq n GLY 76 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1vhq n GLU 77 N -2.00 3.33 -3.51 1.61 1.02 -0.51 -4.89 120.64 115.69 1vhq n GLU 77 Ca 0.00 -3.45 -0.16 0.00 -0.02 0.00 0.00 57.16 53.53 1vhq n GLU 77 Cb 0.00 -3.13 -0.05 0.00 -0.02 0.00 0.00 31.44 28.24 1vhq n GLU 77 CO 0.00 0.00 0.00 -1.50 1.18 0.00 0.00 177.13 176.81 1vhq s ILE 78 N 1.98 0.01 0.23 -3.67 2.07 -1.26 -4.36 121.20 116.19 1vhq s ILE 78 Ca 0.45 -0.05 0.06 0.00 -1.41 0.00 0.00 60.65 59.70 1vhq s ILE 78 Cb 0.05 -0.99 -0.05 0.00 0.13 0.00 0.00 42.46 41.60 1vhq s ILE 78 CO 0.00 -0.03 -0.07 -0.13 -1.91 0.00 0.00 174.94 172.81 1vhq s ARG 79 N -1.98 1.38 0.56 3.50 0.52 -0.83 -4.99 118.95 117.11 1vhq s ARG 79 Ca -0.07 -1.67 -0.21 0.00 -0.52 0.00 0.00 55.73 53.26 1vhq s ARG 79 Cb -0.00 -0.93 -0.04 0.00 0.52 0.00 0.00 34.95 34.49 1vhq s ARG 79 CO 0.03 0.04 1.29 -2.30 0.02 0.00 0.00 175.30 174.38 1vhq n PRO 80 N -0.44 1.50 0.25 3.54 -0.02 -1.26 -2.24 135.00 136.32 1vhq n PRO 80 Ca -0.07 0.56 0.08 0.00 -2.02 0.00 0.00 63.50 62.06 1vhq n PRO 80 Cb 0.62 -2.50 0.62 0.00 -0.02 0.00 0.00 33.50 32.22 1vhq n PRO 80 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 1vhq h LEU 81 N 1.19 0.00 -2.23 2.45 5.85 -1.39 -1.32 115.31 119.86 1vhq h LEU 81 Ca -0.50 0.00 0.03 0.00 0.84 0.00 0.00 57.88 58.25 1vhq h LEU 81 Cb 1.32 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 42.34 1vhq h LEU 81 CO 0.56 0.11 0.11 0.00 -0.34 0.00 0.00 178.44 178.88 1vhq h ALA 82 N 1.89 1.83 -0.00 1.25 0.00 -1.89 -0.77 119.26 121.56 1vhq h ALA 82 Ca -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1vhq h ALA 82 Cb 0.22 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.02 1vhq h ALA 82 CO 0.01 -0.17 -0.09 1.04 0.00 0.00 0.00 179.25 180.04 1vhq n GLN 83 N -4.04 0.79 -2.38 0.00 6.02 -0.50 -4.89 117.38 112.39 1vhq n GLN 83 Ca -0.00 -0.28 -0.42 0.00 -0.01 0.00 0.00 57.00 56.29 1vhq n GLN 83 Cb 0.22 -1.49 -0.03 0.00 1.02 0.00 0.00 30.24 29.96 1vhq n GLN 83 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1vhq s ALA 84 N -2.40 3.45 -0.23 -1.58 0.00 -0.30 -5.01 121.76 115.70 1vhq s ALA 84 Ca 0.31 0.85 0.02 0.00 0.00 0.00 0.00 51.96 53.14 1vhq s ALA 84 Cb 0.20 -3.48 0.05 0.00 0.00 0.00 0.00 23.12 19.89 1vhq s ALA 84 CO 0.46 -0.56 -0.11 0.34 0.00 0.00 0.00 175.76 175.88 1vhq s ASP 85 N 1.23 3.97 0.36 0.00 2.15 -1.26 -5.01 116.67 118.10 1vhq s ASP 85 Ca 0.60 -1.16 0.13 0.00 0.43 0.00 0.00 52.55 52.54 1vhq s ASP 85 Cb -0.30 -1.42 0.96 0.00 -0.30 0.00 0.00 42.92 41.86 1vhq s ASP 85 CO 0.28 -0.16 1.77 0.00 -0.17 0.00 0.00 175.17 176.89 1vhq h ALA 86 N 7.86 1.99 0.00 3.66 0.00 -1.93 -0.75 119.26 130.09 1vhq h ALA 86 Ca -0.24 0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.74 1vhq h ALA 86 Cb 1.07 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.85 1vhq h ALA 86 CO 0.48 -0.39 0.00 0.00 0.00 0.00 0.00 179.25 179.34 1vhq h ALA 87 N 1.65 1.00 -0.57 0.00 0.00 -1.95 -2.15 119.26 117.23 1vhq h ALA 87 Ca 0.59 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.50 1vhq h ALA 87 Cb 1.25 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.04 1vhq h ALA 87 CO -0.34 0.00 0.00 0.39 0.00 0.00 0.00 179.25 179.30 1vhq n GLU 88 N -2.90 2.63 -4.27 0.00 1.02 -0.29 -4.96 120.64 111.86 1vhq n GLU 88 Ca -0.01 -2.49 -0.23 0.00 -0.02 0.00 0.00 57.16 54.41 1vhq n GLU 88 Cb 0.14 -1.54 -0.12 0.00 -0.02 0.00 0.00 31.44 29.89 1vhq n GLU 88 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1vhq s LEU 89 N -1.22 2.31 -0.02 -4.62 1.43 -0.81 -4.84 118.68 110.92 1vhq s LEU 89 Ca 0.44 -0.70 0.19 0.00 -1.03 0.00 0.00 54.13 53.04 1vhq s LEU 89 Cb 0.24 -0.83 -0.27 0.00 0.03 0.00 0.00 46.19 45.36 1vhq s LEU 89 CO 0.32 0.03 0.55 0.47 0.23 0.00 0.00 176.35 177.95 1vhq n ASP 90 N 1.03 0.68 -3.66 2.29 8.00 0.47 -4.96 116.55 120.40 1vhq n ASP 90 Ca -0.19 -0.32 -0.06 0.00 0.71 0.00 0.00 54.79 54.93 1vhq n ASP 90 Cb 0.54 1.59 -0.02 0.00 -0.02 0.00 0.00 41.12 43.21 1vhq n ASP 90 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1vhq s ALA 91 N -3.15 -1.66 -0.02 2.24 0.00 -1.18 -4.20 121.76 113.79 1vhq s ALA 91 Ca -0.02 0.38 0.01 0.00 0.00 0.00 0.00 51.96 52.33 1vhq s ALA 91 Cb 0.13 0.61 0.01 0.00 0.00 0.00 0.00 23.12 23.87 1vhq s ALA 91 CO 0.79 -0.91 -0.02 -1.17 0.00 0.00 0.00 175.76 174.45 1vhq s LEU 92 N -2.79 1.61 -0.03 0.00 2.96 -0.83 -1.08 118.68 118.52 1vhq s LEU 92 Ca 0.09 -0.04 0.03 0.00 -0.22 0.00 0.00 54.13 53.99 1vhq s LEU 92 Cb -0.02 -0.18 0.00 0.00 0.50 0.00 0.00 46.19 46.49 1vhq s LEU 92 CO -0.02 -0.03 -0.11 -0.63 -1.32 0.00 0.00 176.35 174.24 1vhq s ILE 93 N 0.44 0.95 -0.34 6.68 1.01 0.95 -0.73 121.20 130.16 1vhq s ILE 93 Ca -0.04 -0.44 0.02 0.00 0.00 0.00 0.00 60.65 60.19 1vhq s ILE 93 Cb -0.07 -0.84 0.09 0.00 0.01 0.00 0.00 42.46 41.65 1vhq s ILE 93 CO -0.01 0.29 0.06 -0.69 0.00 0.00 0.00 174.94 174.59 1vhq s VAL 94 N 0.25 2.57 0.91 2.92 1.01 0.77 -1.79 120.40 127.04 1vhq s VAL 94 Ca -0.05 -2.08 -0.10 0.00 0.00 0.00 0.00 61.98 59.75 1vhq s VAL 94 Cb -0.10 -2.76 0.14 0.00 0.00 0.00 0.00 36.38 33.66 1vhq s VAL 94 CO 0.01 -0.49 1.15 -2.84 0.00 0.00 0.00 175.10 172.93 1vhq s PRO 95 N 1.02 1.05 0.00 2.72 0.02 -1.26 -4.48 135.00 134.07 1vhq s PRO 95 Ca 0.06 1.56 0.00 0.00 0.02 0.00 0.00 61.00 62.63 1vhq s PRO 95 Cb -0.20 -1.73 0.00 0.00 0.02 0.00 0.00 34.50 32.59 1vhq s PRO 95 CO -0.06 -2.61 0.00 0.41 -0.33 0.00 0.00 177.00 174.41 1vhq n GLY 96 N 0.20 1.31 0.00 0.52 0.00 -1.26 -4.83 105.19 101.13 1vhq n GLY 96 Ca 0.12 -1.56 0.00 0.00 0.00 0.00 0.00 46.02 44.58 1vhq n GLY 96 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1vhq n GLY 97 N 5.00 2.26 0.30 -0.02 0.00 -1.26 -1.23 105.19 110.24 1vhq n GLY 97 Ca 0.00 -1.84 0.18 0.00 0.00 0.00 0.00 46.02 44.36 1vhq n GLY 97 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 1vhq h PHE 98 N 0.00 0.00 -0.71 1.61 -1.00 -0.50 -1.50 116.94 114.83 1vhq h PHE 98 Ca 0.00 0.00 0.11 0.00 2.81 0.00 0.00 57.97 60.89 1vhq h PHE 98 Cb 0.00 0.00 -0.05 0.00 3.61 0.00 0.00 35.95 39.51 1vhq h PHE 98 CO 0.00 0.04 0.47 0.78 -1.61 0.00 0.00 178.31 177.99 1vhq h GLY 99 N 0.62 0.78 1.82 -1.45 0.00 -1.16 -0.06 103.07 103.63 1vhq h GLY 99 Ca -0.00 -0.22 0.00 0.00 0.00 0.00 0.00 47.33 47.11 1vhq h GLY 99 CO 0.00 0.11 0.12 0.00 0.00 0.00 0.00 176.54 176.77 1vhq h ALA 100 N 1.65 1.87 -0.02 3.60 0.00 -1.45 0.21 119.26 125.11 1vhq h ALA 100 Ca 0.34 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.23 1vhq h ALA 100 Cb 0.61 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.32 1vhq h ALA 100 CO -0.11 0.12 -0.22 0.00 0.00 0.00 0.00 179.25 179.04 1vhq n ALA 101 N -2.51 3.01 0.00 0.00 0.00 -0.13 -3.19 120.51 117.68 1vhq n ALA 101 Ca -0.00 -0.53 0.00 0.00 0.00 0.00 0.00 53.44 52.91 1vhq n ALA 101 Cb 0.08 -0.99 0.00 0.00 0.00 0.00 0.00 19.45 18.54 1vhq n ALA 101 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1vhq n LYS 102 N 0.05 0.00 -0.07 0.00 5.02 -0.63 -0.49 118.16 122.04 1vhq n LYS 102 Ca 0.13 0.00 -0.06 0.00 -2.02 0.00 0.00 58.31 56.36 1vhq n LYS 102 Cb 0.43 -0.82 -0.12 0.00 -0.02 0.00 0.00 35.03 34.49 1vhq n LYS 102 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1vhq n ASN 103 N -2.29 1.26 0.04 4.39 3.02 0.67 -4.50 115.26 117.85 1vhq n ASN 103 Ca 0.00 0.00 0.11 0.00 -0.03 0.00 0.00 54.58 54.66 1vhq n ASN 103 Cb 0.37 0.95 -0.00 0.00 -0.61 0.00 0.00 39.78 40.49 1vhq n ASN 103 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1vhq n LEU 104 N -2.52 0.59 -3.82 3.41 4.77 -0.85 -4.80 117.00 113.78 1vhq n LEU 104 Ca -0.23 0.08 -0.09 0.00 -0.03 0.00 0.00 56.01 55.74 1vhq n LEU 104 Cb 0.94 -0.08 0.01 0.00 -2.33 0.00 0.00 43.42 41.97 1vhq n LEU 104 CO 0.32 -0.02 0.51 -0.94 -1.33 0.00 0.00 177.39 175.93 1vhq s SER 105 N -4.36 -0.01 -0.26 -1.43 1.04 -1.19 -0.20 113.70 107.29 1vhq s SER 105 Ca 0.01 -1.07 0.09 0.00 0.48 0.00 0.00 55.95 55.46 1vhq s SER 105 Cb 0.13 0.83 0.45 0.00 0.10 0.00 0.00 66.02 67.53 1vhq s SER 105 CO 0.81 -1.63 1.30 -0.46 0.98 0.00 0.00 173.24 174.24 1vhq n ASN 106 N -1.26 2.55 -0.25 7.02 0.23 -0.86 -2.39 115.26 120.29 1vhq n ASN 106 Ca -0.07 -3.85 0.15 0.00 -0.53 0.00 0.00 54.58 50.27 1vhq n ASN 106 Cb 0.60 -0.54 0.43 0.00 -2.08 0.00 0.00 39.78 38.19 1vhq n ASN 106 CO 0.00 0.00 0.00 0.15 -0.93 0.00 0.00 177.26 176.48 1vhq h PHE 107 N 1.21 0.71 -0.79 -2.53 3.57 -1.68 0.55 116.94 117.97 1vhq h PHE 107 Ca 0.13 0.02 0.06 0.00 3.53 0.00 0.00 57.97 61.72 1vhq h PHE 107 Cb 1.26 -0.22 -0.06 0.00 2.79 0.00 0.00 35.95 39.72 1vhq h PHE 107 CO 0.87 0.23 0.47 0.00 -2.23 0.00 0.00 178.31 177.66 1vhq h ALA 108 N 1.61 1.08 0.00 2.41 0.00 -1.07 0.90 119.26 124.19 1vhq h ALA 108 Ca 0.45 0.00 -0.07 0.00 0.00 0.00 0.00 54.91 55.30 1vhq h ALA 108 Cb 0.88 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.47 1vhq h ALA 108 CO -0.20 0.19 -1.84 -1.13 0.00 0.00 0.00 179.25 176.27 1vhq n SER 109 N -4.68 0.22 -0.00 0.00 3.41 -0.84 -4.66 113.62 107.07 1vhq n SER 109 Ca 0.11 0.09 0.02 0.00 -0.26 0.00 0.00 58.87 58.83 1vhq n SER 109 Cb 0.18 1.43 -0.03 0.00 -0.26 0.00 0.00 64.21 65.53 1vhq n SER 109 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1vhq n LEU 110 N -2.46 0.20 0.00 1.04 4.77 0.12 -5.07 117.00 115.60 1vhq n LEU 110 Ca -0.08 -0.46 0.00 0.00 -0.03 0.00 0.00 56.01 55.44 1vhq n LEU 110 Cb 0.68 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.77 1vhq n LEU 110 CO 0.44 0.05 0.00 0.61 -1.33 0.00 0.00 177.39 177.16 1vhq n GLY 111 N 1.21 3.37 0.11 -0.72 0.00 0.31 -1.50 105.19 107.96 1vhq n GLY 111 Ca 0.01 -0.04 0.08 0.00 0.00 0.00 0.00 46.02 46.07 1vhq n GLY 111 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1vhq n SER 112 N 4.17 0.41 -1.27 1.61 3.41 -1.26 -1.47 113.62 119.21 1vhq n SER 112 Ca 0.00 0.67 0.10 0.00 -0.26 0.00 0.00 58.87 59.39 1vhq n SER 112 Cb 0.00 -0.73 0.30 0.00 -0.26 0.00 0.00 64.21 63.52 1vhq n SER 112 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1vhq n GLU 113 N -2.03 2.96 -1.08 4.33 -0.58 -0.56 -5.01 120.64 118.66 1vhq n GLU 113 Ca -0.00 -2.62 -0.29 0.00 -0.42 0.00 0.00 57.16 53.83 1vhq n GLU 113 Cb 0.06 -1.59 0.17 0.00 -0.57 0.00 0.00 31.44 29.51 1vhq n GLU 113 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1vhq s THR 115 N -2.87 1.34 -0.02 0.00 -4.23 -1.26 -4.98 115.64 103.62 1vhq s THR 115 Ca 0.65 -1.66 -0.01 0.00 -1.18 0.00 0.00 61.69 59.49 1vhq s THR 115 Cb -0.19 -1.48 -0.04 0.00 1.34 0.00 0.00 72.50 72.13 1vhq s THR 115 CO 0.58 -0.37 0.11 -0.69 -0.54 0.00 0.00 174.62 173.72 1vhq s VAL 116 N -1.96 4.95 0.07 2.29 1.01 -1.26 -2.04 120.40 123.46 1vhq s VAL 116 Ca 0.07 -0.30 -0.37 0.00 0.00 0.00 0.00 61.98 61.39 1vhq s VAL 116 Cb -0.06 -3.26 -0.18 0.00 0.00 0.00 0.00 36.38 32.87 1vhq s VAL 116 CO 0.03 0.37 1.07 -0.67 0.00 0.00 0.00 175.10 175.90 1vhq n ASP 117 N 1.20 0.39 -0.33 3.32 -0.08 0.72 -4.76 116.55 117.01 1vhq n ASP 117 Ca -0.13 1.15 -0.03 0.00 -1.51 0.00 0.00 54.79 54.26 1vhq n ASP 117 Cb 0.53 -1.02 0.09 0.00 2.34 0.00 0.00 41.12 43.05 1vhq n ASP 117 CO 0.00 0.00 0.00 0.03 0.12 0.00 0.00 177.20 177.35 1vhq h ARG 118 N 3.14 1.19 -0.25 -0.67 3.08 -1.97 -0.79 114.38 118.11 1vhq h ARG 118 Ca -0.46 -0.09 -0.03 0.00 0.07 0.00 0.00 59.98 59.46 1vhq h ARG 118 Cb 1.40 -0.26 -0.01 0.00 0.08 0.00 0.00 29.97 31.18 1vhq h ARG 118 CO 0.67 0.82 0.02 0.93 -1.07 0.00 0.00 179.97 181.35 1vhq h GLU 119 N 1.21 0.42 -0.25 0.04 5.08 -1.97 -1.07 114.58 118.04 1vhq h GLU 119 Ca 0.32 -0.12 0.00 0.00 -1.00 0.00 0.00 59.36 58.56 1vhq h GLU 119 Cb -0.09 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.10 1vhq h GLU 119 CO -0.06 0.57 0.16 1.25 -1.00 0.00 0.00 179.01 179.92 1vhq h LEU 120 N 0.22 0.27 -0.47 1.33 5.85 -1.83 -0.90 115.31 119.78 1vhq h LEU 120 Ca 0.07 -0.00 0.04 0.00 0.84 0.00 0.00 57.88 58.83 1vhq h LEU 120 Cb 0.36 -0.06 -0.04 0.00 0.37 0.00 0.00 40.66 41.29 1vhq h LEU 120 CO 0.01 0.20 0.23 0.50 -0.34 0.00 0.00 178.44 179.04 1vhq h LYS 121 N 0.33 0.45 -0.69 1.25 3.64 -1.07 0.13 116.57 120.60 1vhq h LYS 121 Ca 0.09 -0.03 -0.02 0.00 -1.27 0.00 0.00 60.65 59.42 1vhq h LYS 121 Cb -0.03 -0.10 -0.03 0.00 -0.41 0.00 0.00 32.23 31.66 1vhq h LYS 121 CO -0.03 0.30 0.34 0.00 -2.27 0.00 0.00 179.45 177.78 1vhq h ALA 122 N 1.26 0.89 -0.51 5.00 0.00 -0.91 -0.66 119.26 124.33 1vhq h ALA 122 Ca 0.21 -0.14 -0.10 0.00 0.00 0.00 0.00 54.91 54.88 1vhq h ALA 122 Cb 0.12 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.62 1vhq h ALA 122 CO -0.15 0.45 -0.07 1.25 0.00 0.00 0.00 179.25 180.73 1vhq h LEU 123 N 0.96 0.94 -0.37 0.00 5.85 -0.82 -1.12 115.31 120.76 1vhq h LEU 123 Ca 0.24 -0.34 -0.02 0.00 0.84 0.00 0.00 57.88 58.60 1vhq h LEU 123 Cb 0.11 -0.26 -0.02 0.00 0.37 0.00 0.00 40.66 40.87 1vhq h LEU 123 CO -0.03 1.06 0.16 0.00 -0.34 0.00 0.00 178.44 179.29 1vhq h ALA 124 N 0.92 0.47 -0.58 1.25 0.00 -0.56 -2.45 119.26 118.31 1vhq h ALA 124 Ca 0.14 -0.12 -0.02 0.00 0.00 0.00 0.00 54.91 54.91 1vhq h ALA 124 Cb 0.62 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.24 1vhq h ALA 124 CO 0.04 0.06 0.29 1.96 0.00 0.00 0.00 179.25 181.59 1vhq h GLN 125 N 0.45 0.82 -1.20 0.00 4.20 -0.97 -1.72 115.11 116.69 1vhq h GLN 125 Ca 0.12 -0.10 0.00 0.00 0.06 0.00 0.00 58.65 58.74 1vhq h GLN 125 Cb 0.16 -0.16 0.00 0.00 0.30 0.00 0.00 27.48 27.78 1vhq h GLN 125 CO -0.01 0.63 0.00 0.00 -0.67 0.00 0.00 178.83 178.78 1vhq n ALA 126 N -2.45 1.86 0.00 3.87 0.00 -0.44 -0.59 120.51 122.76 1vhq n ALA 126 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.49 1vhq n ALA 126 Cb 0.12 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.57 1vhq n ALA 126 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.50 179.08 1vhq n HIS 128 N 0.62 0.00 0.15 0.00 -0.00 -0.65 -2.04 115.22 113.31 1vhq n HIS 128 Ca 0.00 0.00 0.07 0.00 -0.00 0.00 0.00 57.72 57.79 1vhq n HIS 128 Cb 0.19 0.00 0.57 0.00 -0.00 0.00 0.00 29.99 30.74 1vhq n HIS 128 CO 0.00 0.00 0.00 1.96 -0.00 0.00 0.00 176.34 178.30 1vhq h GLN 129 N 0.00 0.19 -0.05 1.57 1.08 -1.11 -0.81 115.11 115.98 1vhq h GLN 129 Ca 0.00 -0.01 0.00 0.00 -1.45 0.00 0.00 58.65 57.19 1vhq h GLN 129 Cb 0.00 -0.04 0.00 0.00 -0.05 0.00 0.00 27.48 27.39 1vhq h GLN 129 CO 0.00 0.13 0.00 0.00 -0.95 0.00 0.00 178.83 178.01 1vhq n ALA 130 N -2.52 2.58 -2.29 3.87 0.00 -0.86 -4.94 120.51 116.35 1vhq n ALA 130 Ca -0.00 -0.39 -0.10 0.00 0.00 0.00 0.00 53.44 52.95 1vhq n ALA 130 Cb 0.11 -1.22 -0.00 0.00 0.00 0.00 0.00 19.45 18.34 1vhq n ALA 130 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1vhq n GLY 131 N 1.09 -0.02 3.85 0.00 0.00 -0.31 -5.03 105.19 104.77 1vhq n GLY 131 Ca 0.19 -0.43 -0.36 0.00 0.00 0.00 0.00 46.02 45.42 1vhq n GLY 131 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1vhq s LYS 132 N -4.63 3.34 0.51 1.61 1.02 -1.26 -5.01 119.74 115.31 1vhq s LYS 132 Ca 0.03 -0.23 -0.19 0.00 0.02 0.00 0.00 55.97 55.60 1vhq s LYS 132 Cb -0.01 -3.09 -0.08 0.00 -0.52 0.00 0.00 37.83 34.13 1vhq s LYS 132 CO 0.04 0.74 1.03 -1.25 -0.92 0.00 0.00 175.35 174.99 1vhq s PRO 133 N -1.20 3.74 0.03 -1.68 0.04 -1.26 -4.21 135.00 130.47 1vhq s PRO 133 Ca 0.17 1.28 0.07 0.00 0.04 0.00 0.00 61.00 62.56 1vhq s PRO 133 Cb -0.12 -2.09 -0.02 0.00 0.04 0.00 0.00 34.50 32.31 1vhq s PRO 133 CO 0.07 -0.47 -0.21 -0.51 0.04 0.00 0.00 177.00 175.92 1vhq s LEU 134 N -3.72 2.14 -0.09 -3.56 1.43 -0.65 -1.97 118.68 112.26 1vhq s LEU 134 Ca 0.65 -0.50 0.00 0.00 -1.03 0.00 0.00 54.13 53.26 1vhq s LEU 134 Cb -0.15 -1.02 0.02 0.00 0.03 0.00 0.00 46.19 45.08 1vhq s LEU 134 CO 0.24 0.19 -0.07 -0.83 0.23 0.00 0.00 176.35 176.11 1vhq s GLY 135 N -1.05 0.71 0.13 -3.19 0.00 0.09 -0.38 107.32 103.63 1vhq s GLY 135 Ca 0.08 -0.39 0.00 0.00 0.00 0.00 0.00 44.72 44.41 1vhq s GLY 135 CO 0.01 0.69 0.02 0.69 0.00 0.00 0.00 173.10 174.51 1vhq n PHE 136 N 4.65 0.22 0.00 1.90 3.01 -0.29 -0.16 117.46 126.79 1vhq n PHE 136 Ca -0.15 -0.72 0.00 0.00 1.01 0.00 0.00 57.45 57.59 1vhq n PHE 136 Cb 0.50 -0.06 0.00 0.00 -0.01 0.00 0.00 39.48 39.92 1vhq n PHE 136 CO 0.00 0.00 0.00 1.51 1.01 0.00 0.00 176.76 179.28 1vhq n ILE 139 N -0.32 0.00 -0.18 4.37 0.13 -1.26 -2.67 119.36 119.43 1vhq n ILE 139 Ca -0.04 0.11 0.04 0.00 -1.10 0.00 0.00 62.75 61.76 1vhq n ILE 139 Cb 0.18 -0.61 0.32 0.00 -0.84 0.00 0.00 39.64 38.69 1vhq n ILE 139 CO 0.00 0.00 0.00 0.00 2.80 0.00 0.00 176.55 179.35 1vhq h ALA 140 N 0.00 1.61 0.00 1.51 0.00 -1.88 -1.41 119.26 119.09 1vhq h ALA 140 Ca 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1vhq h ALA 140 Cb 0.22 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.77 1vhq h ALA 140 CO 0.00 0.31 0.12 -1.35 0.00 0.00 0.00 179.25 178.33 1vhq h PRO 141 N 0.84 0.00 -2.07 0.00 0.11 -1.86 -3.37 132.00 125.66 1vhq h PRO 141 Ca 0.29 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.40 1vhq h PRO 141 Cb 0.09 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.20 1vhq h PRO 141 CO -0.08 0.00 0.03 0.00 -0.21 0.00 0.00 178.00 177.74 1vhq n ALA 142 N -2.00 1.34 0.00 -0.75 0.00 -0.53 -4.44 120.51 114.13 1vhq n ALA 142 Ca -0.03 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.41 1vhq n ALA 142 Cb 0.18 -1.84 0.00 0.00 0.00 0.00 0.00 19.45 17.79 1vhq n ALA 142 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1vhq n LEU 144 N 1.98 0.00 0.31 0.00 4.77 -1.26 -4.62 117.00 118.18 1vhq n LEU 144 Ca 0.00 0.00 0.17 0.00 -0.03 0.00 0.00 56.01 56.15 1vhq n LEU 144 Cb 0.00 0.00 0.99 0.00 -2.33 0.00 0.00 43.42 42.08 1vhq n LEU 144 CO 0.02 0.00 1.14 -0.65 -1.33 0.00 0.00 177.39 176.57 1vhq h PRO 145 N 0.00 0.00 -0.01 3.23 0.11 -1.81 -0.67 132.00 132.84 1vhq h PRO 145 Ca 0.00 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 1vhq h PRO 145 Cb 0.00 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.11 1vhq h PRO 145 CO 0.00 0.00 -0.24 1.63 -0.21 0.00 0.00 178.00 179.18 1vhq n LYS 146 N -3.67 1.27 -0.12 1.05 4.01 -1.26 -4.16 118.16 115.28 1vhq n LYS 146 Ca -0.03 -0.89 -0.25 0.00 -0.51 0.00 0.00 58.31 56.63 1vhq n LYS 146 Cb 0.08 -1.48 -0.11 0.00 -0.51 0.00 0.00 35.03 33.01 1vhq n LYS 146 CO 0.00 0.00 0.00 -0.89 -1.11 0.00 0.00 177.40 175.40 1vhq n ILE 147 N -0.08 1.55 -4.48 -0.18 2.08 -0.41 -4.80 119.36 113.03 1vhq n ILE 147 Ca 0.13 -0.39 -0.34 0.00 0.56 0.00 0.00 62.75 62.71 1vhq n ILE 147 Cb 0.41 -1.79 -0.11 0.00 -0.75 0.00 0.00 39.64 37.40 1vhq n ILE 147 CO 0.00 0.00 0.00 -0.36 0.56 0.00 0.00 176.55 176.75 1vhq s PHE 148 N -2.49 3.02 -0.51 1.39 0.08 -0.40 -4.92 117.98 114.15 1vhq s PHE 148 Ca -0.34 -0.09 -0.02 0.00 0.12 0.00 0.00 56.93 56.59 1vhq s PHE 148 Cb 0.11 -1.84 0.27 0.00 -0.57 0.00 0.00 43.02 40.99 1vhq s PHE 148 CO 0.56 0.19 2.18 -0.40 -0.10 0.00 0.00 175.22 177.65 1vhq n ASP 149 N 2.80 6.97 -3.65 1.36 5.75 -1.26 -4.60 116.55 123.92 1vhq n ASP 149 Ca -0.18 -3.40 -0.15 0.00 -0.01 0.00 0.00 54.79 51.05 1vhq n ASP 149 Cb 0.53 -1.07 -0.08 0.00 -1.03 0.00 0.00 41.12 39.47 1vhq n ASP 149 CO 0.00 0.00 0.00 0.72 -0.11 0.00 0.00 177.20 177.81 1vhq s PHE 150 N -2.66 -0.41 0.43 2.11 -0.12 -1.26 -5.14 117.98 110.92 1vhq s PHE 150 Ca 0.49 0.72 -0.26 0.00 -0.05 0.00 0.00 56.93 57.83 1vhq s PHE 150 Cb 0.37 0.24 -0.09 0.00 -0.63 0.00 0.00 43.02 42.91 1vhq s PHE 150 CO -0.10 -0.47 1.45 -0.35 -0.05 0.00 0.00 175.22 175.70 1vhq n PRO 151 N 1.24 2.37 -4.29 1.99 -0.04 -1.26 -4.95 135.00 130.06 1vhq n PRO 151 Ca -0.20 0.84 -0.20 0.00 -0.04 0.00 0.00 63.50 63.91 1vhq n PRO 151 Cb 0.56 -2.64 -0.13 0.00 -0.04 0.00 0.00 33.50 31.25 1vhq n PRO 151 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1vhq s LEU 152 N -2.50 2.21 -0.23 1.53 1.43 -1.26 -4.98 118.68 114.88 1vhq s LEU 152 Ca 0.59 -0.52 -0.24 0.00 -1.03 0.00 0.00 54.13 52.93 1vhq s LEU 152 Cb -0.46 -0.58 -0.01 0.00 0.03 0.00 0.00 46.19 45.17 1vhq s LEU 152 CO 0.59 -0.00 0.78 -0.13 0.23 0.00 0.00 176.35 177.82 1vhq s ARG 153 N -1.38 4.19 0.32 1.70 0.52 -1.26 -1.23 118.95 121.82 1vhq s ARG 153 Ca 0.00 0.87 -0.08 0.00 -0.52 0.00 0.00 55.73 56.00 1vhq s ARG 153 Cb -0.09 -3.63 0.01 0.00 0.52 0.00 0.00 34.95 31.76 1vhq s ARG 153 CO 0.02 -0.45 0.53 -0.48 0.02 0.00 0.00 175.30 174.94 1vhq s LEU 154 N 2.61 0.60 -0.00 2.53 0.05 -0.85 -4.04 118.68 119.57 1vhq s LEU 154 Ca 0.34 -1.25 -0.08 0.00 0.05 0.00 0.00 54.13 53.19 1vhq s LEU 154 Cb -0.16 1.82 0.00 0.00 -2.05 0.00 0.00 46.19 45.81 1vhq s LEU 154 CO 0.08 -1.32 0.16 0.28 -0.55 0.00 0.00 176.35 175.00 1vhq s THR 155 N -3.22 0.07 -0.01 5.48 -1.32 -1.26 -0.48 115.64 114.90 1vhq s THR 155 Ca 0.25 -0.61 0.01 0.00 -1.21 0.00 0.00 61.69 60.13 1vhq s THR 155 Cb -0.01 -0.44 0.02 0.00 -1.51 0.00 0.00 72.50 70.56 1vhq s THR 155 CO 0.15 -0.34 0.99 2.30 -2.21 0.00 0.00 174.62 175.51 1vhq n ILE 156 N 1.56 1.02 0.00 5.08 -6.64 -1.26 -4.51 119.36 114.61 1vhq n ILE 156 Ca -0.22 -1.05 0.00 0.00 -1.77 0.00 0.00 62.75 59.71 1vhq n ILE 156 Cb 0.56 0.47 0.00 0.00 -1.44 0.00 0.00 39.64 39.22 1vhq n ILE 156 CO 0.00 0.00 0.00 0.61 -1.77 0.00 0.00 176.55 175.39 1vhq n GLY 157 N -0.55 0.47 0.00 3.28 0.00 -1.26 -4.64 105.19 102.49 1vhq n GLY 157 Ca 0.01 -1.20 0.00 0.00 0.00 0.00 0.00 46.02 44.83 1vhq n GLY 157 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1vhq n THR 158 N 0.00 0.00 -1.70 2.61 -2.24 -1.26 -1.80 114.28 109.90 1vhq n THR 158 Ca 0.00 -0.10 -0.53 0.00 -2.27 0.00 0.00 64.05 61.15 1vhq n THR 158 Cb 0.00 1.69 -0.06 0.00 -2.10 0.00 0.00 70.33 69.86 1vhq n THR 158 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 1vhq n ASP 159 N -0.03 2.98 0.25 3.42 -0.08 -1.26 -4.89 116.55 116.94 1vhq n ASP 159 Ca 0.00 1.02 -0.16 0.00 -1.51 0.00 0.00 54.79 54.14 1vhq n ASP 159 Cb 0.17 -1.27 -0.08 0.00 2.34 0.00 0.00 41.12 42.29 1vhq n ASP 159 CO 0.00 0.00 0.00 0.40 0.12 0.00 0.00 177.20 177.72 1vhq h ILE 160 N 5.38 0.58 -0.11 5.18 2.04 -1.99 -0.82 117.51 127.76 1vhq h ILE 160 Ca -0.48 0.00 0.03 0.00 1.00 0.00 0.00 64.86 65.42 1vhq h ILE 160 Cb 1.29 0.58 -0.03 0.00 -0.74 0.00 0.00 36.82 37.91 1vhq h ILE 160 CO 0.96 0.00 -0.09 0.44 0.00 0.00 0.00 178.15 179.45 1vhq h ASP 161 N -0.57 -0.30 -0.67 1.72 3.32 -2.00 -1.41 116.42 116.51 1vhq h ASP 161 Ca -0.06 0.06 -0.08 0.00 0.02 0.00 0.00 57.03 56.98 1vhq h ASP 161 Cb 0.44 0.15 -0.03 0.00 0.22 0.00 0.00 39.33 40.12 1vhq h ASP 161 CO 0.09 -0.13 0.11 0.74 -1.72 0.00 0.00 179.24 178.33 1vhq h THR 162 N -0.11 1.26 -0.85 0.35 2.02 -1.94 -2.49 112.91 111.15 1vhq h THR 162 Ca 0.08 -1.04 0.03 0.00 0.77 0.00 0.00 66.41 66.25 1vhq h THR 162 Cb 0.22 0.62 -0.05 0.00 -1.74 0.00 0.00 68.15 67.20 1vhq h THR 162 CO -0.18 0.39 0.55 0.00 0.37 0.00 0.00 175.52 176.65 1vhq h ALA 163 N 1.07 1.12 -0.61 6.16 0.00 -0.97 -1.67 119.26 124.35 1vhq h ALA 163 Ca 0.21 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 55.04 1vhq h ALA 163 Cb 0.44 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 17.91 1vhq h ALA 163 CO 0.01 0.39 0.20 0.93 0.00 0.00 0.00 179.25 180.78 1vhq h GLU 164 N 1.06 0.91 -0.69 0.00 5.08 -0.92 -0.43 114.58 119.60 1vhq h GLU 164 Ca 0.34 -0.17 -0.05 0.00 -1.00 0.00 0.00 59.36 58.48 1vhq h GLU 164 Cb 0.00 -0.15 -0.03 0.00 0.50 0.00 0.00 28.75 29.08 1vhq h GLU 164 CO -0.11 0.77 0.22 0.28 -1.00 0.00 0.00 179.01 179.17 1vhq h VAL 165 N 0.88 1.25 -0.42 3.13 2.07 -0.95 0.43 116.25 122.64 1vhq h VAL 165 Ca 0.20 -0.86 -0.07 0.00 0.82 0.00 0.00 66.70 66.79 1vhq h VAL 165 Cb 0.24 0.49 -0.02 0.00 -1.52 0.00 0.00 31.29 30.48 1vhq h VAL 165 CO -0.01 0.34 0.00 -0.07 0.02 0.00 0.00 177.57 177.85 1vhq h LEU 166 N 1.02 0.73 -0.94 2.57 -0.00 -0.69 -2.71 115.31 115.30 1vhq h LEU 166 Ca 0.22 -0.30 -0.07 0.00 -0.00 0.00 0.00 57.88 57.73 1vhq h LEU 166 Cb 0.28 -0.20 -0.02 0.00 -0.00 0.00 0.00 40.66 40.73 1vhq h LEU 166 CO -0.01 0.86 -0.03 -0.33 -0.00 0.00 0.00 178.44 178.93 1vhq h GLU 167 N 0.58 0.75 -1.95 1.13 5.08 -0.65 -2.24 114.58 117.28 1vhq h GLU 167 Ca 0.12 -0.21 0.00 0.00 -1.00 0.00 0.00 59.36 58.27 1vhq h GLU 167 Cb 0.48 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.65 1vhq h GLU 167 CO 0.02 0.78 0.00 -1.91 -1.00 0.00 0.00 179.01 176.90 1vhq n GLU 168 N -4.21 0.10 0.00 2.33 2.13 0.10 -4.05 120.64 117.05 1vhq n GLU 168 Ca 0.02 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.84 1vhq n GLU 168 Cb 0.31 -1.45 0.00 0.00 0.27 0.00 0.00 31.44 30.57 1vhq n GLU 168 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1vhq n GLY 170 N 1.44 -0.24 3.86 8.31 0.00 -1.01 -5.09 105.19 112.45 1vhq n GLY 170 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.71 1vhq n GLY 170 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1vhq s ALA 171 N -0.06 3.06 -0.57 4.61 0.00 -0.87 -4.53 121.76 123.40 1vhq s ALA 171 Ca 0.00 -0.00 -0.18 0.00 0.00 0.00 0.00 51.96 51.78 1vhq s ALA 171 Cb 0.00 -3.10 0.11 0.00 0.00 0.00 0.00 23.12 20.13 1vhq s ALA 171 CO 0.00 -0.61 0.64 -2.00 0.00 0.00 0.00 175.76 173.79 1vhq s GLU 172 N -4.87 3.03 -0.16 0.00 2.12 -0.36 -4.21 118.70 114.25 1vhq s GLU 172 Ca 0.56 -1.44 -0.29 0.00 0.36 0.00 0.00 54.97 54.16 1vhq s GLU 172 Cb -0.11 -4.27 -0.00 0.00 0.26 0.00 0.00 34.13 30.00 1vhq s GLU 172 CO 0.48 -1.47 1.04 -1.58 -0.54 0.00 0.00 175.26 173.20 1vhq s HIS 173 N 2.33 3.39 -0.39 5.30 5.65 -1.26 -2.01 115.29 128.30 1vhq s HIS 173 Ca 0.09 1.49 -0.08 0.00 0.25 0.00 0.00 55.06 56.81 1vhq s HIS 173 Cb -0.26 -3.25 0.06 0.00 -1.18 0.00 0.00 32.58 27.95 1vhq s HIS 173 CO 0.05 -0.47 0.20 0.08 -0.65 0.00 0.00 174.74 173.96 1vhq s VAL 174 N 2.59 4.09 0.20 0.89 1.01 0.37 -4.96 120.40 124.59 1vhq s VAL 174 Ca 0.47 -1.28 -0.32 0.00 0.00 0.00 0.00 61.98 60.85 1vhq s VAL 174 Cb -0.17 -3.44 -0.15 0.00 0.00 0.00 0.00 36.38 32.62 1vhq s VAL 174 CO 0.13 -0.38 1.21 -2.65 0.00 0.00 0.00 175.10 173.40 1vhq n PRO 175 N 4.88 1.39 -3.72 2.72 -0.02 -1.26 -4.46 135.00 134.53 1vhq n PRO 175 Ca -0.11 0.49 -0.12 0.00 -2.02 0.00 0.00 63.50 61.75 1vhq n PRO 175 Cb 0.44 -2.02 -0.10 0.00 -0.02 0.00 0.00 33.50 31.80 1vhq n PRO 175 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1vhq s PRO 177 N 0.70 1.38 0.50 0.00 0.04 -1.26 -4.30 135.00 132.07 1vhq s PRO 177 Ca -0.04 0.06 0.20 0.00 0.04 0.00 0.00 61.00 61.27 1vhq s PRO 177 Cb -0.05 -1.89 1.28 0.00 0.04 0.00 0.00 34.50 33.88 1vhq s PRO 177 CO -0.05 -1.99 2.07 -0.24 0.04 0.00 0.00 177.00 176.84 1vhq h VAL 178 N -1.34 0.88 -0.49 -0.36 3.04 -1.92 -2.51 116.25 113.54 1vhq h VAL 178 Ca -0.47 -0.43 0.00 0.00 -1.01 0.00 0.00 66.70 64.80 1vhq h VAL 178 Cb 1.31 1.24 0.00 0.00 -2.01 0.00 0.00 31.29 31.84 1vhq h VAL 178 CO 0.59 0.11 0.00 -0.67 -1.01 0.00 0.00 177.57 176.59 1vhq n ASP 179 N -4.10 3.28 -4.23 3.17 2.03 -1.26 -3.31 116.55 112.12 1vhq n ASP 179 Ca -0.02 -2.20 -0.21 0.00 0.52 0.00 0.00 54.79 52.87 1vhq n ASP 179 Cb 0.20 -0.44 -0.10 0.00 -0.72 0.00 0.00 41.12 40.07 1vhq n ASP 179 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 1vhq s ASP 180 N -0.86 2.09 0.26 1.67 -1.08 -0.95 -4.65 116.67 113.15 1vhq s ASP 180 Ca 0.36 -1.50 0.05 0.00 -0.52 0.00 0.00 52.55 50.94 1vhq s ASP 180 Cb 0.22 0.23 -0.06 0.00 -1.46 0.00 0.00 42.92 41.86 1vhq s ASP 180 CO 0.20 -0.78 -0.02 0.27 0.52 0.00 0.00 175.17 175.36 1vhq s ILE 181 N -3.42 1.27 -0.08 4.11 -4.36 -1.26 -4.54 121.20 112.92 1vhq s ILE 181 Ca 0.33 -2.06 0.04 0.00 -0.26 0.00 0.00 60.65 58.70 1vhq s ILE 181 Cb 0.06 -2.44 0.00 0.00 1.25 0.00 0.00 42.46 41.33 1vhq s ILE 181 CO 0.15 -0.28 -0.21 -0.69 0.24 0.00 0.00 174.94 174.16 1vhq s VAL 182 N -3.26 1.79 -0.07 8.37 1.01 -0.08 -4.99 120.40 123.19 1vhq s VAL 182 Ca 0.30 -0.88 0.04 0.00 0.00 0.00 0.00 61.98 61.44 1vhq s VAL 182 Cb 0.05 -1.55 0.00 0.00 0.00 0.00 0.00 36.38 34.88 1vhq s VAL 182 CO 0.11 0.50 -0.19 -0.69 0.00 0.00 0.00 175.10 174.83 1vhq s VAL 183 N 0.27 1.63 -0.56 2.92 1.01 -1.26 -0.65 120.40 123.76 1vhq s VAL 183 Ca -0.13 -0.80 -0.19 0.00 0.00 0.00 0.00 61.98 60.86 1vhq s VAL 183 Cb -0.16 -1.42 0.09 0.00 0.00 0.00 0.00 36.38 34.90 1vhq s VAL 183 CO 0.06 0.46 0.65 -0.62 0.00 0.00 0.00 175.10 175.66 1vhq s ASP 184 N 0.25 6.19 0.18 3.32 -1.08 0.46 -4.92 116.67 121.06 1vhq s ASP 184 Ca -0.11 -1.33 -0.09 0.00 -0.52 0.00 0.00 52.55 50.50 1vhq s ASP 184 Cb -0.15 -2.28 0.06 0.00 -1.46 0.00 0.00 42.92 39.09 1vhq s ASP 184 CO 0.05 -1.01 1.60 -0.33 0.52 0.00 0.00 175.17 175.99 1vhq h GLU 185 N 9.09 1.00 -0.05 4.34 4.39 -1.94 -0.33 114.58 131.09 1vhq h GLU 185 Ca -0.29 -0.38 -0.05 0.00 0.34 0.00 0.00 59.36 58.98 1vhq h GLU 185 Cb 1.09 -0.06 -0.01 0.00 -0.10 0.00 0.00 28.75 29.67 1vhq h GLU 185 CO 1.05 1.06 -0.19 -0.44 -1.16 0.00 0.00 179.01 179.34 1vhq h ASP 186 N 0.89 0.07 -0.13 1.42 3.32 -1.98 -3.09 116.42 116.92 1vhq h ASP 186 Ca 0.13 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.17 1vhq h ASP 186 Cb 0.70 -0.02 0.00 0.00 0.22 0.00 0.00 39.33 40.23 1vhq h ASP 186 CO 0.05 0.27 0.00 0.59 -1.72 0.00 0.00 179.24 178.43 1vhq n ASN 187 N -4.28 2.49 -3.63 6.45 3.02 -1.11 -5.00 115.26 113.20 1vhq n ASN 187 Ca -0.02 -1.72 -0.20 0.00 -0.03 0.00 0.00 54.58 52.61 1vhq n ASN 187 Cb 0.27 -0.08 0.05 0.00 -0.61 0.00 0.00 39.78 39.41 1vhq n ASN 187 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1vhq n LYS 188 N 0.84 -5.22 -4.47 3.52 5.02 -0.17 -4.81 118.16 112.86 1vhq n LYS 188 Ca 0.10 0.68 -0.33 0.00 -2.02 0.00 0.00 58.31 56.74 1vhq n LYS 188 Cb 0.40 -5.34 -0.15 0.00 -0.02 0.00 0.00 35.03 29.93 1vhq n LYS 188 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1vhq s ILE 189 N -3.59 2.92 -0.14 -0.18 -1.09 -0.96 -1.64 121.20 116.51 1vhq s ILE 189 Ca 0.01 -0.68 0.02 0.00 -2.23 0.00 0.00 60.65 57.77 1vhq s ILE 189 Cb -0.00 -2.25 0.01 0.00 -1.58 0.00 0.00 42.46 38.63 1vhq s ILE 189 CO 0.79 0.50 -0.20 -0.69 -1.23 0.00 0.00 174.94 174.11 1vhq s VAL 190 N 0.80 2.25 0.14 2.92 1.01 0.49 -0.41 120.40 127.60 1vhq s VAL 190 Ca -0.05 -0.92 0.08 0.00 0.00 0.00 0.00 61.98 61.10 1vhq s VAL 190 Cb -0.15 -1.91 -0.04 0.00 0.00 0.00 0.00 36.38 34.27 1vhq s VAL 190 CO 0.01 0.54 -0.17 0.42 0.00 0.00 0.00 175.10 175.89 1vhq s THR 191 N 0.80 1.66 0.03 3.92 -4.23 0.17 -1.13 115.64 116.86 1vhq s THR 191 Ca -0.07 -1.81 -0.15 0.00 -1.18 0.00 0.00 61.69 58.48 1vhq s THR 191 Cb -0.16 -1.71 0.02 0.00 1.34 0.00 0.00 72.50 71.99 1vhq s THR 191 CO -0.01 -0.31 0.32 0.28 -0.54 0.00 0.00 174.62 174.36 1vhq s THR 192 N -1.96 0.07 0.13 3.99 -1.32 -1.09 -0.90 115.64 114.56 1vhq s THR 192 Ca 0.13 -0.61 0.10 0.00 -1.21 0.00 0.00 61.69 60.09 1vhq s THR 192 Cb -0.06 -0.90 -0.10 0.00 -1.51 0.00 0.00 72.50 69.94 1vhq s THR 192 CO 0.05 -0.34 1.43 -0.65 -2.21 0.00 0.00 174.62 172.90 1vhq h PRO 193 N 3.27 0.00 0.00 7.08 0.11 -1.83 -3.47 132.00 137.16 1vhq h PRO 193 Ca -0.31 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.80 1vhq h PRO 193 Cb 1.20 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.31 1vhq h PRO 193 CO 0.45 0.78 0.00 0.00 -0.21 0.00 0.00 178.00 179.02 1vhq n ALA 194 N -2.35 0.00 -1.43 -0.75 0.00 -1.26 -4.15 120.51 110.58 1vhq n ALA 194 Ca -0.00 0.00 -0.38 0.00 0.00 0.00 0.00 53.44 53.06 1vhq n ALA 194 Cb 0.79 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 20.18 1vhq n ALA 194 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1vhq n TYR 195 N 14.00 2.07 0.11 0.00 4.01 -1.26 -0.64 117.16 135.46 1vhq n TYR 195 Ca 0.00 -1.64 0.03 0.00 -0.16 0.00 0.00 57.90 56.13 1vhq n TYR 195 Cb 0.00 -1.97 0.05 0.00 -0.31 0.00 0.00 39.34 37.11 1vhq n TYR 195 CO 0.00 0.00 0.00 1.28 -0.46 0.00 0.00 176.86 177.68 1vhq n LEU 197 N 9.85 0.00 -4.72 7.72 4.77 -1.26 -5.00 117.00 128.36 1vhq n LEU 197 Ca 0.48 0.29 -0.42 0.00 -0.03 0.00 0.00 56.01 56.32 1vhq n LEU 197 Cb 0.43 -0.03 -0.01 0.00 -2.33 0.00 0.00 43.42 41.48 1vhq n LEU 197 CO 0.93 -0.29 1.05 0.00 -1.33 0.00 0.00 177.39 177.75 1vhq n ALA 198 N -1.18 1.79 0.49 -1.18 0.00 0.19 -4.90 120.51 115.73 1vhq n ALA 198 Ca 0.02 0.37 0.11 0.00 0.00 0.00 0.00 53.44 53.94 1vhq n ALA 198 Cb 0.58 -2.34 -0.03 0.00 0.00 0.00 0.00 19.45 17.65 1vhq n ALA 198 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1vhq n GLN 199 N 1.08 0.34 -3.90 0.00 1.13 -1.26 -4.97 117.38 109.79 1vhq n GLN 199 Ca 0.06 -0.03 -0.09 0.00 -1.94 0.00 0.00 57.00 55.00 1vhq n GLN 199 Cb 0.36 -1.58 -0.02 0.00 0.11 0.00 0.00 30.24 29.11 1vhq n GLN 199 CO 0.00 0.00 0.00 0.54 -1.44 0.00 0.00 177.06 176.16 1vhq s ASN 200 N -3.99 -0.06 0.30 1.08 2.20 -1.26 -5.05 114.94 108.16 1vhq s ASN 200 Ca 0.02 -0.88 0.07 0.00 -0.94 0.00 0.00 52.86 51.12 1vhq s ASN 200 Cb 0.14 0.71 0.47 0.00 -2.00 0.00 0.00 41.25 40.57 1vhq s ASN 200 CO 0.83 -1.36 1.71 -0.29 -2.94 0.00 0.00 177.10 175.04 1vhq h ILE 201 N 2.08 1.31 -0.87 0.54 2.10 -2.00 -2.05 117.51 118.62 1vhq h ILE 201 Ca -0.25 -1.52 -0.02 0.00 1.08 0.00 0.00 64.86 64.15 1vhq h ILE 201 Cb 1.25 1.69 -0.04 0.00 -1.09 0.00 0.00 36.82 38.63 1vhq h ILE 201 CO 0.31 0.45 0.44 0.00 -1.08 0.00 0.00 178.15 178.28 1vhq h ALA 202 N 1.39 1.15 -0.41 0.18 0.00 -1.99 -0.22 119.26 119.36 1vhq h ALA 202 Ca 0.02 -0.15 -0.04 0.00 0.00 0.00 0.00 54.91 54.74 1vhq h ALA 202 Cb 0.81 -0.34 -0.02 0.00 0.00 0.00 0.00 17.79 18.24 1vhq h ALA 202 CO 0.06 0.66 0.11 0.93 0.00 0.00 0.00 179.25 181.02 1vhq h GLU 203 N 1.22 0.65 -0.90 0.00 5.08 -1.82 -1.82 114.58 116.99 1vhq h GLU 203 Ca 0.30 -0.15 0.01 0.00 -1.00 0.00 0.00 59.36 58.52 1vhq h GLU 203 Cb 0.08 -0.09 -0.04 0.00 0.50 0.00 0.00 28.75 29.19 1vhq h GLU 203 CO -0.04 0.66 0.59 0.00 -1.00 0.00 0.00 179.01 179.21 1vhq h ALA 204 N 0.96 1.14 -0.56 3.43 0.00 -0.98 -2.18 119.26 121.07 1vhq h ALA 204 Ca 0.13 -0.07 -0.04 0.00 0.00 0.00 0.00 54.91 54.93 1vhq h ALA 204 Cb 0.29 -0.36 -0.03 0.00 0.00 0.00 0.00 17.79 17.69 1vhq h ALA 204 CO -0.00 0.55 0.18 0.00 0.00 0.00 0.00 179.25 179.98 1vhq h ALA 205 N 1.32 1.27 -0.20 0.00 0.00 -0.89 -1.11 119.26 119.65 1vhq h ALA 205 Ca 0.33 -0.18 -0.00 0.00 0.00 0.00 0.00 54.91 55.06 1vhq h ALA 205 Cb -0.13 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.43 1vhq h ALA 205 CO -0.07 0.53 0.12 1.03 0.00 0.00 0.00 179.25 180.86 1vhq h SER 206 N 0.82 0.24 -0.44 0.00 0.87 -0.68 0.16 113.55 114.53 1vhq h SER 206 Ca 0.19 -0.06 -0.12 0.00 -1.23 0.00 0.00 61.79 60.57 1vhq h SER 206 Cb 0.23 -0.06 -0.01 0.00 -0.44 0.00 0.00 62.40 62.11 1vhq h SER 206 CO -0.01 0.23 -0.21 1.23 -0.53 0.00 0.00 176.83 177.54 1vhq h GLY 207 N 0.24 0.99 0.99 5.77 0.00 -1.30 -2.91 103.07 106.85 1vhq h GLY 207 Ca 0.07 -0.89 -0.04 0.00 0.00 0.00 0.00 47.33 46.47 1vhq h GLY 207 CO -0.01 0.81 0.18 -2.22 0.00 0.00 0.00 176.54 175.29 1vhq h ILE 208 N 0.75 1.24 -0.99 2.60 2.04 -0.98 -1.35 117.51 120.82 1vhq h ILE 208 Ca 0.10 -0.80 0.01 0.00 1.00 0.00 0.00 64.86 65.17 1vhq h ILE 208 Cb 0.78 0.69 -0.05 0.00 -0.74 0.00 0.00 36.82 37.49 1vhq h ILE 208 CO 0.06 0.30 0.65 0.44 0.00 0.00 0.00 178.15 179.61 1vhq h ASP 209 N 0.79 1.12 -0.69 1.72 3.32 -0.69 -0.67 116.42 121.32 1vhq h ASP 209 Ca 0.18 -0.03 -0.07 0.00 0.02 0.00 0.00 57.03 57.14 1vhq h ASP 209 Cb 0.28 -0.28 -0.03 0.00 0.22 0.00 0.00 39.33 39.52 1vhq h ASP 209 CO -0.01 0.81 0.16 0.11 -1.72 0.00 0.00 179.24 178.58 1vhq h LYS 210 N 1.32 1.13 -0.32 3.56 1.57 -1.23 -0.89 116.57 121.71 1vhq h LYS 210 Ca 0.37 -0.28 -0.04 0.00 -1.87 0.00 0.00 60.65 58.83 1vhq h LYS 210 Cb -0.13 -0.14 -0.01 0.00 0.08 0.00 0.00 32.23 32.02 1vhq h LYS 210 CO -0.09 1.00 0.03 1.25 -0.57 0.00 0.00 179.45 181.08 1vhq h LEU 211 N 1.06 0.53 -0.45 2.94 6.46 -0.73 -1.22 115.31 123.91 1vhq h LEU 211 Ca 0.22 -0.28 -0.03 0.00 -0.12 0.00 0.00 57.88 57.66 1vhq h LEU 211 Cb 0.39 -0.14 -0.02 0.00 -0.73 0.00 0.00 40.66 40.16 1vhq h LEU 211 CO 0.01 0.68 0.15 0.58 -0.62 0.00 0.00 178.44 179.23 1vhq h VAL 212 N 0.37 1.22 -0.33 1.05 2.07 -1.06 0.06 116.25 119.63 1vhq h VAL 212 Ca 0.10 -0.71 0.01 0.00 0.82 0.00 0.00 66.70 66.91 1vhq h VAL 212 Cb 0.39 0.84 -0.02 0.00 -1.52 0.00 0.00 31.29 30.97 1vhq h VAL 212 CO 0.01 0.26 0.20 0.28 0.02 0.00 0.00 177.57 178.34 1vhq h SER 213 N 0.59 0.33 -0.70 0.57 0.02 -1.08 -0.53 113.55 112.74 1vhq h SER 213 Ca 0.15 -0.00 -0.05 0.00 -0.84 0.00 0.00 61.79 61.04 1vhq h SER 213 Cb 0.25 -0.07 -0.03 0.00 0.14 0.00 0.00 62.40 62.69 1vhq h SER 213 CO -0.01 0.24 0.24 -0.09 -1.14 0.00 0.00 176.83 176.07 1vhq h ARG 214 N 0.41 1.07 -0.82 3.45 9.65 -0.90 -1.14 114.38 126.10 1vhq h ARG 214 Ca 0.13 -0.22 0.01 0.00 -1.10 0.00 0.00 59.98 58.80 1vhq h ARG 214 Cb -0.01 -0.16 -0.04 0.00 -1.39 0.00 0.00 29.97 28.37 1vhq h ARG 214 CO -0.05 0.91 0.54 0.28 2.80 0.00 0.00 179.97 184.45 1vhq h VAL 215 N 1.01 1.21 -0.49 0.20 2.07 -0.60 -0.50 116.25 119.16 1vhq h VAL 215 Ca 0.23 -0.39 -0.09 0.00 0.82 0.00 0.00 66.70 67.27 1vhq h VAL 215 Cb 0.27 0.00 -0.02 0.00 -1.52 0.00 0.00 31.29 30.03 1vhq h VAL 215 CO -0.01 0.20 -0.03 -0.07 0.02 0.00 0.00 177.57 177.68 1vhq h LEU 216 N 1.11 0.88 -0.06 2.57 3.38 -0.79 0.71 115.31 123.12 1vhq h LEU 216 Ca 0.30 -0.32 -0.00 0.00 0.09 0.00 0.00 57.88 57.95 1vhq h LEU 216 Cb -0.13 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 40.38 1vhq h LEU 216 CO -0.06 0.99 0.03 0.58 0.09 0.00 0.00 178.44 180.07 1vhq h VAL 217 N 0.75 1.07 -0.50 1.22 2.07 -0.90 0.11 116.25 120.07 1vhq h VAL 217 Ca 0.14 -0.20 0.06 0.00 0.82 0.00 0.00 66.70 67.52 1vhq h VAL 217 Cb 0.56 1.10 -0.03 0.00 -1.52 0.00 0.00 31.29 31.40 1vhq h VAL 217 CO 0.03 0.06 0.34 -0.07 0.02 0.00 0.00 177.57 177.95 1vhq h LEU 218 N 0.01 0.38 -0.14 2.57 3.38 -0.88 -1.18 115.31 119.45 1vhq h LEU 218 Ca 0.02 0.00 -0.22 0.00 0.09 0.00 0.00 57.88 57.77 1vhq h LEU 218 Cb 0.07 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 40.73 1vhq h LEU 218 CO -0.00 0.25 -0.98 0.00 0.09 0.00 0.00 178.44 177.79 1vhq h ALA 219 N 1.73 0.39 0.00 1.53 0.00 -0.00 -3.45 119.26 119.46 1vhq h ALA 219 Ca 0.22 -0.78 0.00 0.00 0.00 0.00 0.00 54.91 54.34 1vhq h ALA 219 Cb 0.32 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.04 1vhq h ALA 219 CO -0.06 0.97 0.00 -1.91 0.00 0.00 0.00 179.25 178.25