#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vdy n SER 2 N 0.00 -0.30 -0.73 1.61 7.64 -1.26 -4.92 113.62 115.66 1vdy n SER 2 Ca 0.00 -1.28 0.00 0.00 1.01 0.00 0.00 58.87 58.60 1vdy n SER 2 Cb 0.00 -1.58 0.00 0.00 -1.01 0.00 0.00 64.21 61.62 1vdy n SER 2 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 1vdy n SER 3 N -2.68 0.00 -4.93 6.43 2.88 -1.26 -5.18 113.62 108.88 1vdy n SER 3 Ca -0.27 -0.73 -0.25 0.00 -1.33 0.00 0.00 58.87 56.28 1vdy n SER 3 Cb 0.66 0.00 -0.00 0.00 -0.75 0.00 0.00 64.21 64.12 1vdy n SER 3 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 1vdy s GLY 4 N -0.73 1.43 -0.18 0.46 0.00 -1.26 -5.06 107.32 101.97 1vdy s GLY 4 Ca 0.00 -0.81 -0.29 0.00 0.00 0.00 0.00 44.72 43.62 1vdy s GLY 4 CO 0.00 -0.70 1.01 -0.56 0.00 0.00 0.00 173.10 172.86 1vdy s SER 5 N -4.09 7.14 0.13 1.64 0.01 -1.26 -5.00 113.70 112.27 1vdy s SER 5 Ca 0.44 1.42 -0.31 0.00 1.31 0.00 0.00 55.95 58.81 1vdy s SER 5 Cb -0.10 -2.54 -0.09 0.00 0.21 0.00 0.00 66.02 63.50 1vdy s SER 5 CO 0.39 -0.57 1.60 -0.44 0.41 0.00 0.00 173.24 174.64 1vdy s SER 6 N 1.16 6.59 0.00 2.44 0.01 -1.26 -4.61 113.70 118.03 1vdy s SER 6 Ca 0.45 2.58 0.00 0.00 1.31 0.00 0.00 55.95 60.29 1vdy s SER 6 Cb -0.16 -2.58 0.00 0.00 0.21 0.00 0.00 66.02 63.48 1vdy s SER 6 CO 0.11 -0.85 0.00 0.61 0.41 0.00 0.00 173.24 173.52 1vdy n GLY 7 N 3.85 0.00 3.55 3.44 0.00 -1.26 -4.81 105.19 109.97 1vdy n GLY 7 Ca 0.15 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.78 1vdy n GLY 7 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1vdy s GLU 8 N 0.00 2.80 0.11 1.61 2.02 -1.26 -4.88 118.70 119.10 1vdy s GLU 8 Ca 0.00 0.28 -0.30 0.00 0.02 0.00 0.00 54.97 54.97 1vdy s GLU 8 Cb 0.00 -4.39 -0.10 0.00 0.10 0.00 0.00 34.13 29.74 1vdy s GLU 8 CO 0.00 -2.60 1.60 0.66 0.02 0.00 0.00 175.26 174.94 1vdy h SER 9 N 13.27 -1.08 -1.01 -0.19 4.64 -2.02 -2.74 113.55 124.43 1vdy h SER 9 Ca -0.23 0.12 0.24 0.00 -0.47 0.00 0.00 61.79 61.44 1vdy h SER 9 Cb 1.12 0.40 -0.12 0.00 -0.31 0.00 0.00 62.40 63.49 1vdy h SER 9 CO 1.24 -0.47 0.61 0.10 -0.87 0.00 0.00 176.83 177.44 1vdy h TYR 10 N -0.64 0.97 -0.31 4.77 -0.00 -1.99 -1.39 116.97 118.37 1vdy h TYR 10 Ca 0.01 0.03 0.07 0.00 0.00 0.00 0.00 58.73 58.85 1vdy h TYR 10 Cb 0.65 -0.28 -0.08 0.00 0.00 0.00 0.00 36.73 37.02 1vdy h TYR 10 CO -0.31 0.10 -0.32 2.35 -0.00 0.00 0.00 178.16 179.98 1vdy h TRP 11 N 0.59 -0.87 0.44 0.10 -0.00 -1.89 0.94 115.95 115.26 1vdy h TRP 11 Ca 0.63 0.05 -0.02 0.00 -0.00 0.00 0.00 58.89 59.55 1vdy h TRP 11 Cb 1.21 0.43 -0.00 0.00 -0.00 0.00 0.00 29.16 30.79 1vdy h TRP 11 CO -0.01 -0.38 -0.26 0.00 -0.00 0.00 0.00 178.44 177.80 1vdy h ARG 12 N -0.29 -0.63 -0.46 2.65 3.08 -1.34 -3.14 114.38 114.25 1vdy h ARG 12 Ca 0.15 0.04 0.09 0.00 0.07 0.00 0.00 59.98 60.33 1vdy h ARG 12 Cb 0.53 0.14 -0.10 0.00 0.08 0.00 0.00 29.97 30.63 1vdy h ARG 12 CO -0.47 -0.42 -0.31 0.77 -1.07 0.00 0.00 179.97 178.47 1vdy h SER 13 N -0.66 -1.04 -0.73 7.04 0.02 -1.06 -2.45 113.55 114.67 1vdy h SER 13 Ca -0.05 0.20 0.15 0.00 -0.84 0.00 0.00 61.79 61.24 1vdy h SER 13 Cb 0.53 0.50 -0.10 0.00 0.14 0.00 0.00 62.40 63.48 1vdy h SER 13 CO 0.06 -0.30 0.24 0.03 -1.14 0.00 0.00 176.83 175.72 1vdy h ARG 14 N -0.21 0.35 -0.21 3.45 2.47 -0.81 -1.18 114.38 118.24 1vdy h ARG 14 Ca 0.20 -0.02 0.03 0.00 -1.26 0.00 0.00 59.98 58.92 1vdy h ARG 14 Cb 0.53 -0.08 -0.03 0.00 -1.65 0.00 0.00 29.97 28.74 1vdy h ARG 14 CO -0.57 0.23 0.03 0.52 0.56 0.00 0.00 179.97 180.74 1vdy h MET 15 N 0.36 0.10 -0.17 0.04 2.86 -1.40 -0.31 114.93 116.41 1vdy h MET 15 Ca 0.41 -0.01 -0.01 0.00 -2.06 0.00 0.00 59.70 58.03 1vdy h MET 15 Cb 0.65 -0.02 -0.01 0.00 0.06 0.00 0.00 31.60 32.28 1vdy h MET 15 CO -0.44 0.07 0.08 0.82 1.06 0.00 0.00 176.91 178.50 1vdy h ILE 16 N 0.10 1.14 -0.42 -1.22 1.08 -1.35 -2.68 117.51 114.15 1vdy h ILE 16 Ca 0.09 -0.40 0.07 0.00 -0.39 0.00 0.00 64.86 64.24 1vdy h ILE 16 Cb 0.10 1.08 -0.02 0.00 -3.07 0.00 0.00 36.82 34.91 1vdy h ILE 16 CO -0.14 0.13 0.29 -0.78 -0.69 0.00 0.00 178.15 176.96 1vdy h ASP 17 N 0.15 0.24 1.01 1.72 3.58 -0.84 -0.32 116.42 121.97 1vdy h ASP 17 Ca 0.06 0.00 -0.04 0.00 0.42 0.00 0.00 57.03 57.47 1vdy h ASP 17 Cb 0.13 -0.05 -0.01 0.00 1.72 0.00 0.00 39.33 41.12 1vdy h ASP 17 CO -0.01 0.16 -0.19 0.00 -2.88 0.00 0.00 179.24 176.33 1vdy h ALA 18 N 1.78 1.00 -0.01 -0.78 0.00 -0.71 0.79 119.26 121.33 1vdy h ALA 18 Ca 0.19 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1vdy h ALA 18 Cb 0.39 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.15 1vdy h ALA 18 CO -0.04 0.23 -0.23 1.33 0.00 0.00 0.00 179.25 180.55 1vdy n VAL 19 N -3.32 0.00 -1.87 0.00 0.24 -0.70 -4.41 118.33 108.27 1vdy n VAL 19 Ca 0.00 -0.39 0.05 0.00 -2.04 0.00 0.00 64.34 61.97 1vdy n VAL 19 Cb 0.42 1.20 0.10 0.00 -1.47 0.00 0.00 33.84 34.09 1vdy n VAL 19 CO 0.00 0.00 0.00 0.35 -2.14 0.00 0.00 176.83 175.04 1vdy n THR 20 N 0.05 1.06 -1.55 3.34 -2.24 -0.21 -4.72 114.28 110.00 1vdy n THR 20 Ca 0.06 -1.80 -0.39 0.00 -2.27 0.00 0.00 64.05 59.65 1vdy n THR 20 Cb 0.31 0.29 0.03 0.00 -2.10 0.00 0.00 70.33 68.86 1vdy n THR 20 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 1vdy n SER 21 N -0.46 0.21 0.05 3.42 7.64 0.25 -4.71 113.62 120.02 1vdy n SER 21 Ca 0.11 0.87 0.06 0.00 1.01 0.00 0.00 58.87 60.92 1vdy n SER 21 Cb 0.83 -1.28 0.29 0.00 -1.01 0.00 0.00 64.21 63.04 1vdy n SER 21 CO 0.00 0.00 0.00 -0.90 -3.01 0.00 0.00 175.04 171.13 1vdy n ASP 22 N 0.24 0.20 -4.88 6.43 5.75 -1.26 -4.56 116.55 118.48 1vdy n ASP 22 Ca 0.11 0.57 -0.30 0.00 -0.01 0.00 0.00 54.79 55.16 1vdy n ASP 22 Cb 0.44 -0.60 -0.04 0.00 -1.03 0.00 0.00 41.12 39.88 1vdy n ASP 22 CO 0.00 0.00 0.00 -0.70 -0.11 0.00 0.00 177.20 176.39 1vdy s GLU 23 N -3.14 3.79 0.00 0.11 2.56 -1.26 -4.87 118.70 115.89 1vdy s GLU 23 Ca 0.03 0.38 0.00 0.00 0.00 0.00 0.00 54.97 55.37 1vdy s GLU 23 Cb 0.06 -2.49 0.00 0.00 2.00 0.00 0.00 34.13 33.70 1vdy s GLU 23 CO 0.19 0.10 0.48 -3.47 -0.56 0.00 0.00 175.26 172.00 1vdy n ASP 24 N -0.90 0.00 -4.62 -1.70 2.03 -1.26 -4.78 116.55 105.32 1vdy n ASP 24 Ca 0.01 -0.95 -0.43 0.00 0.52 0.00 0.00 54.79 53.94 1vdy n ASP 24 Cb 0.54 -0.00 -0.03 0.00 -0.72 0.00 0.00 41.12 40.91 1vdy n ASP 24 CO 0.00 0.00 0.00 -0.75 -1.92 0.00 0.00 177.20 174.53 1vdy s LYS 25 N -1.99 3.66 0.51 -0.67 2.36 -1.26 -4.97 119.74 117.38 1vdy s LYS 25 Ca 0.00 1.76 -0.22 0.00 -2.55 0.00 0.00 55.97 54.96 1vdy s LYS 25 Cb 0.00 -4.12 -0.06 0.00 -1.05 0.00 0.00 37.83 32.60 1vdy s LYS 25 CO 0.00 -1.47 1.29 0.54 1.55 0.00 0.00 175.35 177.26 1vdy s VAL 26 N 5.84 2.46 0.27 4.02 0.11 -1.26 -4.91 120.40 126.93 1vdy s VAL 26 Ca 0.78 0.35 -0.29 0.00 -2.93 0.00 0.00 61.98 59.89 1vdy s VAL 26 Cb -0.27 -3.18 -0.09 0.00 -1.53 0.00 0.00 36.38 31.30 1vdy s VAL 26 CO 0.32 -0.00 1.14 0.00 -3.33 0.00 0.00 175.10 173.22 1vdy s ALA 27 N -1.39 3.42 1.00 1.54 0.00 -1.26 -5.06 121.76 120.01 1vdy s ALA 27 Ca 0.68 0.94 0.00 0.00 0.00 0.00 0.00 51.96 53.58 1vdy s ALA 27 Cb -0.36 -3.36 0.00 0.00 0.00 0.00 0.00 23.12 19.40 1vdy s ALA 27 CO 0.43 -0.24 0.00 -0.35 0.00 0.00 0.00 175.76 175.60 1vdy n PRO 28 N 1.40 0.63 -0.13 0.00 -0.04 -1.26 -5.04 135.00 130.56 1vdy n PRO 28 Ca -0.00 0.00 -0.22 0.00 -0.04 0.00 0.00 63.50 63.24 1vdy n PRO 28 Cb 0.44 0.00 -0.11 0.00 -0.04 0.00 0.00 33.50 33.79 1vdy n PRO 28 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 1vdy n VAL 29 N -0.73 1.50 -0.23 0.52 0.31 -1.26 -4.51 118.33 113.93 1vdy n VAL 29 Ca 0.00 -0.51 0.02 0.00 -0.01 0.00 0.00 64.34 63.84 1vdy n VAL 29 Cb 0.00 -1.57 0.15 0.00 -0.91 0.00 0.00 33.84 31.50 1vdy n VAL 29 CO 0.00 0.00 0.00 0.10 -1.32 0.00 0.00 176.83 175.61 1vdy h TYR 30 N -0.33 0.50 -0.15 3.52 -0.00 -1.99 -0.27 116.97 118.24 1vdy h TYR 30 Ca -0.62 0.03 -0.03 0.00 -0.00 0.00 0.00 58.73 58.11 1vdy h TYR 30 Cb 1.81 -0.12 -0.01 0.00 -0.00 0.00 0.00 36.73 38.41 1vdy h TYR 30 CO -0.01 0.12 -0.07 0.87 -0.00 0.00 0.00 178.16 179.07 1vdy h LYS 31 N 0.47 0.22 -0.05 0.10 1.79 -1.99 -2.64 116.57 114.47 1vdy h LYS 31 Ca 0.36 -0.04 -0.14 0.00 -2.18 0.00 0.00 60.65 58.65 1vdy h LYS 31 Cb 0.47 -0.04 0.01 0.00 -1.58 0.00 0.00 32.23 31.09 1vdy h LYS 31 CO -0.34 0.31 -0.52 -0.07 -1.08 0.00 0.00 179.45 177.75 1vdy h LEU 32 N 0.22 0.54 -0.80 2.94 3.38 -1.34 -3.27 115.31 116.98 1vdy h LEU 32 Ca 0.05 -0.70 0.15 0.00 0.09 0.00 0.00 57.88 57.47 1vdy h LEU 32 Cb 0.26 -0.16 -0.10 0.00 0.09 0.00 0.00 40.66 40.75 1vdy h LEU 32 CO 0.01 1.16 0.37 -0.33 0.09 0.00 0.00 178.44 179.74 1vdy h GLU 33 N -0.02 0.51 -0.60 1.13 4.39 -0.85 -1.73 114.58 117.40 1vdy h GLU 33 Ca -0.05 -0.03 -0.07 0.00 0.34 0.00 0.00 59.36 59.55 1vdy h GLU 33 Cb 1.19 -0.12 -0.02 0.00 -0.10 0.00 0.00 28.75 29.70 1vdy h GLU 33 CO 0.10 0.34 0.11 0.93 -1.16 0.00 0.00 179.01 179.33 1vdy h GLU 34 N 0.53 0.99 -0.22 2.33 5.08 -1.57 -1.16 114.58 120.55 1vdy h GLU 34 Ca 0.44 -0.26 -0.02 0.00 -1.00 0.00 0.00 59.36 58.53 1vdy h GLU 34 Cb 0.65 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.77 1vdy h GLU 34 CO -0.39 0.92 0.08 0.82 -1.00 0.00 0.00 179.01 179.44 1vdy h ILE 35 N 0.89 1.18 -0.45 3.13 2.04 -1.38 -0.09 117.51 122.83 1vdy h ILE 35 Ca 0.18 -0.55 0.08 0.00 1.00 0.00 0.00 64.86 65.57 1vdy h ILE 35 Cb 0.40 1.14 -0.07 0.00 -0.74 0.00 0.00 36.82 37.56 1vdy h ILE 35 CO 0.01 0.18 0.06 0.00 0.00 0.00 0.00 178.15 178.40 1vdy h ASP 37 N 0.18 0.84 -0.28 0.00 3.58 -1.06 -1.72 116.42 117.96 1vdy h ASP 37 Ca 0.22 -0.41 -0.08 0.00 0.42 0.00 0.00 57.03 57.18 1vdy h ASP 37 Cb 0.30 -0.23 -0.02 0.00 1.72 0.00 0.00 39.33 41.10 1vdy h ASP 37 CO -0.32 1.07 -0.10 -0.07 -2.88 0.00 0.00 179.24 176.94 1vdy h LEU 38 N 0.62 0.68 -0.10 2.28 3.38 -0.65 -0.44 115.31 121.08 1vdy h LEU 38 Ca 0.08 -0.19 -0.00 0.00 0.09 0.00 0.00 57.88 57.86 1vdy h LEU 38 Cb 0.76 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 41.32 1vdy h LEU 38 CO 0.06 0.82 0.04 -0.07 0.09 0.00 0.00 178.44 179.38 1vdy h LEU 39 N 0.63 0.13 -1.05 1.67 3.38 -0.45 -1.72 115.31 117.91 1vdy h LEU 39 Ca 0.11 -0.14 -0.09 0.00 0.09 0.00 0.00 57.88 57.85 1vdy h LEU 39 Cb 0.55 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.25 1vdy h LEU 39 CO 0.03 0.23 -0.36 0.08 0.09 0.00 0.00 178.44 178.52 1vdy h ARG 40 N 0.02 0.22 -0.42 1.13 0.11 -1.07 -3.00 114.38 111.36 1vdy h ARG 40 Ca 0.03 -0.09 0.00 0.00 0.10 0.00 0.00 59.98 60.02 1vdy h ARG 40 Cb 0.14 -0.01 0.00 0.00 1.11 0.00 0.00 29.97 31.21 1vdy h ARG 40 CO -0.00 0.55 0.00 0.45 0.10 0.00 0.00 179.97 181.07 1vdy n SER 41 N -4.07 2.24 -4.59 0.08 2.88 -0.20 -4.94 113.62 105.02 1vdy n SER 41 Ca -0.01 -2.00 -0.27 0.00 -1.33 0.00 0.00 58.87 55.25 1vdy n SER 41 Cb 0.44 -0.28 -0.11 0.00 -0.75 0.00 0.00 64.21 63.51 1vdy n SER 41 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 1vdy s SER 42 N -1.00 3.76 0.70 -3.46 0.01 -0.66 -5.00 113.70 108.06 1vdy s SER 42 Ca 0.28 -1.33 -0.12 0.00 1.31 0.00 0.00 55.95 56.09 1vdy s SER 42 Cb 0.15 -0.37 0.02 0.00 0.21 0.00 0.00 66.02 66.02 1vdy s SER 42 CO 0.19 -0.41 1.07 -2.28 0.41 0.00 0.00 173.24 172.22 1vdy s HIS 43 N -2.72 2.90 0.57 2.43 2.46 -1.26 -4.87 115.29 114.80 1vdy s HIS 43 Ca 0.34 1.48 0.27 0.00 0.47 0.00 0.00 55.06 57.62 1vdy s HIS 43 Cb 0.08 -2.96 1.54 0.00 -0.13 0.00 0.00 32.58 31.11 1vdy s HIS 43 CO 0.17 -1.42 2.05 -0.24 -2.47 0.00 0.00 174.74 172.84 1vdy h VAL 44 N -0.66 0.56 -0.74 0.89 3.04 -1.99 -0.54 116.25 116.82 1vdy h VAL 44 Ca -0.44 0.00 -0.01 0.00 -1.01 0.00 0.00 66.70 65.24 1vdy h VAL 44 Cb 1.22 0.80 -0.04 0.00 -2.01 0.00 0.00 31.29 31.26 1vdy h VAL 44 CO 0.55 0.00 0.43 -1.28 -1.01 0.00 0.00 177.57 176.26 1vdy h SER 45 N 0.00 0.90 -0.40 3.17 0.87 -1.99 0.77 113.55 116.87 1vdy h SER 45 Ca 0.14 -0.07 -0.12 0.00 -1.23 0.00 0.00 61.79 60.50 1vdy h SER 45 Cb 0.66 -0.23 -0.01 0.00 -0.44 0.00 0.00 62.40 62.39 1vdy h SER 45 CO -0.00 0.71 -0.24 0.40 -0.53 0.00 0.00 176.83 177.17 1vdy h ILE 46 N 1.01 1.28 -0.43 2.23 1.08 -1.47 0.20 117.51 121.42 1vdy h ILE 46 Ca 0.26 -1.39 0.03 0.00 -0.39 0.00 0.00 64.86 63.37 1vdy h ILE 46 Cb -0.01 1.31 -0.03 0.00 -3.07 0.00 0.00 36.82 35.01 1vdy h ILE 46 CO -0.05 0.46 0.23 0.58 -0.69 0.00 0.00 178.15 178.68 1vdy h VAL 47 N 0.67 1.00 0.18 1.67 2.07 -1.10 0.09 116.25 120.83 1vdy h VAL 47 Ca 0.08 -0.16 -0.01 0.00 0.82 0.00 0.00 66.70 67.44 1vdy h VAL 47 Cb 0.80 0.50 0.00 0.00 -1.52 0.00 0.00 31.29 31.07 1vdy h VAL 47 CO 0.07 0.08 -0.09 0.11 0.02 0.00 0.00 177.57 177.76 1vdy h LYS 48 N 0.46 -0.23 -0.83 1.57 1.57 -0.69 -3.02 116.57 115.39 1vdy h LYS 48 Ca 0.18 0.02 0.05 0.00 -1.87 0.00 0.00 60.65 59.02 1vdy h LYS 48 Cb 0.06 0.05 -0.06 0.00 0.08 0.00 0.00 32.23 32.37 1vdy h LYS 48 CO -0.11 -0.06 0.52 0.93 -0.57 0.00 0.00 179.45 180.16 1vdy h GLU 49 N -0.37 0.95 -0.49 3.15 4.39 -0.64 -2.06 114.58 119.51 1vdy h GLU 49 Ca -0.02 -0.06 0.06 0.00 0.34 0.00 0.00 59.36 59.68 1vdy h GLU 49 Cb 0.29 -0.21 -0.05 0.00 -0.10 0.00 0.00 28.75 28.67 1vdy h GLU 49 CO 0.04 0.63 0.18 0.74 -1.16 0.00 0.00 179.01 179.44 1vdy h PHE 50 N 0.97 0.32 -0.52 4.33 0.04 -0.92 -1.97 116.94 119.19 1vdy h PHE 50 Ca 0.35 0.02 0.09 0.00 2.80 0.00 0.00 57.97 61.24 1vdy h PHE 50 Cb 0.10 -0.07 -0.07 0.00 2.20 0.00 0.00 35.95 38.11 1vdy h PHE 50 CO -0.03 0.11 0.11 0.77 -0.60 0.00 0.00 178.31 178.66 1vdy h SER 51 N 0.36 0.00 -0.79 2.17 0.02 -1.25 -1.14 113.55 112.92 1vdy h SER 51 Ca 0.23 0.09 0.06 0.00 -0.84 0.00 0.00 61.79 61.34 1vdy h SER 51 Cb 0.24 0.13 -0.06 0.00 0.14 0.00 0.00 62.40 62.85 1vdy h SER 51 CO -0.23 0.03 0.47 -0.33 -1.14 0.00 0.00 176.83 175.63 1vdy h GLU 52 N 0.24 0.84 0.00 3.45 4.39 -1.06 -0.46 114.58 121.98 1vdy h GLU 52 Ca 0.27 -0.05 -0.13 0.00 0.34 0.00 0.00 59.36 59.78 1vdy h GLU 52 Cb 0.36 -0.19 -0.02 0.00 -0.10 0.00 0.00 28.75 28.80 1vdy h GLU 52 CO -0.34 0.56 -0.63 0.74 -1.16 0.00 0.00 179.01 178.17 1vdy h PHE 53 N 0.87 0.00 -0.22 4.33 0.04 -1.06 -2.74 116.94 118.16 1vdy h PHE 53 Ca 0.35 0.00 -0.04 0.00 2.80 0.00 0.00 57.97 61.07 1vdy h PHE 53 Cb 0.17 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.32 1vdy h PHE 53 CO -0.05 0.63 -0.03 0.82 -0.60 0.00 0.00 178.31 179.09 1vdy h ILE 54 N 0.00 1.27 -0.96 -0.55 2.04 0.02 -3.00 117.51 116.33 1vdy h ILE 54 Ca -0.01 -0.97 0.02 0.00 1.00 0.00 0.00 64.86 64.91 1vdy h ILE 54 Cb 1.15 1.47 -0.05 0.00 -0.74 0.00 0.00 36.82 38.64 1vdy h ILE 54 CO 0.08 0.30 0.63 -0.07 0.00 0.00 0.00 178.15 179.09 1vdy h LEU 55 N 0.15 1.07 0.00 1.44 3.38 -1.15 -1.23 115.31 118.97 1vdy h LEU 55 Ca 0.06 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.01 1vdy h LEU 55 Cb 0.45 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 40.95 1vdy h LEU 55 CO 0.02 0.76 0.00 0.29 0.09 0.00 0.00 178.44 179.59 1vdy n LYS 56 N -4.45 0.02 -0.00 1.13 4.76 -1.04 -1.40 118.16 117.19 1vdy n LYS 56 Ca 0.12 0.37 -0.13 0.00 -2.87 0.00 0.00 58.31 55.80 1vdy n LYS 56 Cb 0.05 -1.50 -0.14 0.00 -1.84 0.00 0.00 35.03 31.60 1vdy n LYS 56 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1vdy h ARG 57 N 0.00 0.10 0.00 1.97 2.47 -1.23 -3.35 114.38 114.34 1vdy h ARG 57 Ca 0.00 -0.18 0.00 0.00 -1.26 0.00 0.00 59.98 58.54 1vdy h ARG 57 Cb 0.04 0.07 0.00 0.00 -1.65 0.00 0.00 29.97 28.43 1vdy h ARG 57 CO 0.00 0.79 0.00 -0.07 0.56 0.00 0.00 179.97 181.25 1vdy h LEU 58 N 0.03 0.00 -0.52 3.04 4.07 -1.31 -2.60 115.31 118.03 1vdy h LEU 58 Ca -0.31 0.00 -0.16 0.00 0.08 0.00 0.00 57.88 57.50 1vdy h LEU 58 Cb 2.01 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 43.74 1vdy h LEU 58 CO 0.09 0.00 -0.48 -0.78 -1.08 0.00 0.00 178.44 176.20 1vdy h ASP 59 N 0.00 0.72 -2.03 -0.43 1.82 -1.69 -3.47 116.42 111.34 1vdy h ASP 59 Ca 0.00 -0.36 -0.64 0.00 -0.39 0.00 0.00 57.03 55.64 1vdy h ASP 59 Cb 0.34 -0.20 0.08 0.00 0.68 0.00 0.00 39.33 40.23 1vdy h ASP 59 CO 0.00 1.08 0.35 -3.20 -1.61 0.00 0.00 179.24 175.86 1vdy n ASN 60 N -4.00 1.63 0.21 2.28 2.85 -0.98 -4.91 115.26 112.33 1vdy n ASN 60 Ca -0.03 1.14 0.07 0.00 -0.11 0.00 0.00 54.58 55.65 1vdy n ASN 60 Cb 0.57 -1.25 0.46 0.00 1.24 0.00 0.00 39.78 40.80 1vdy n ASN 60 CO 0.00 0.00 0.00 0.11 -2.11 0.00 0.00 177.26 175.26 1vdy h LYS 61 N 3.68 0.00 -6.72 1.20 1.79 -1.90 -3.44 116.57 111.18 1vdy h LYS 61 Ca -0.44 0.00 -0.51 0.00 -2.18 0.00 0.00 60.65 57.52 1vdy h LYS 61 Cb 1.33 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.98 1vdy h LYS 61 CO 0.72 0.29 0.44 -1.12 -1.08 0.00 0.00 179.45 178.71 1vdy s SER 62 N -6.53 7.36 0.20 0.86 0.01 -1.26 -4.97 113.70 109.37 1vdy s SER 62 Ca -0.02 2.10 -0.04 0.00 1.31 0.00 0.00 55.95 59.30 1vdy s SER 62 Cb 0.13 -2.61 0.16 0.00 0.21 0.00 0.00 66.02 63.90 1vdy s SER 62 CO 0.67 -0.11 1.59 1.55 0.41 0.00 0.00 173.24 177.35 1vdy h PRO 63 N 4.51 0.73 0.14 12.44 0.13 -1.92 -3.31 132.00 144.73 1vdy h PRO 63 Ca -0.45 -0.34 0.01 0.00 -0.87 0.00 0.00 66.00 64.35 1vdy h PRO 63 Cb 1.21 -0.01 -0.04 0.00 0.13 0.00 0.00 31.00 32.28 1vdy h PRO 63 CO 0.70 0.95 -0.52 0.82 -0.23 0.00 0.00 178.00 179.72 1vdy h ILE 64 N 0.62 0.00 -0.84 -3.56 2.04 -1.93 -2.05 117.51 111.78 1vdy h ILE 64 Ca 0.07 0.00 0.21 0.00 1.00 0.00 0.00 64.86 66.14 1vdy h ILE 64 Cb 0.84 0.00 -0.13 0.00 -0.74 0.00 0.00 36.82 36.79 1vdy h ILE 64 CO 0.07 0.00 0.27 0.58 0.00 0.00 0.00 178.15 179.07 1vdy h VAL 65 N -0.75 0.42 0.83 1.67 2.07 -1.80 -0.70 116.25 117.99 1vdy h VAL 65 Ca -0.01 -0.10 -0.04 0.00 0.82 0.00 0.00 66.70 67.37 1vdy h VAL 65 Cb 0.75 0.11 0.01 0.00 -1.52 0.00 0.00 31.29 30.64 1vdy h VAL 65 CO -0.27 0.05 -0.40 0.11 0.02 0.00 0.00 177.57 177.09 1vdy h LYS 66 N 0.29 -1.07 -1.01 1.57 1.57 -1.48 -2.83 116.57 113.60 1vdy h LYS 66 Ca 0.51 0.07 0.18 0.00 -1.87 0.00 0.00 60.65 59.55 1vdy h LYS 66 Cb 0.97 0.24 -0.10 0.00 0.08 0.00 0.00 32.23 33.42 1vdy h LYS 66 CO -0.57 -0.72 0.62 0.37 -0.57 0.00 0.00 179.45 178.58 1vdy h GLN 67 N -1.18 0.77 -0.66 3.15 -0.00 -0.64 -0.15 115.11 116.39 1vdy h GLN 67 Ca -0.11 -0.05 0.07 0.00 -0.00 0.00 0.00 58.65 58.56 1vdy h GLN 67 Cb 0.86 -0.17 -0.06 0.00 0.00 0.00 0.00 27.48 28.10 1vdy h GLN 67 CO 0.19 0.51 0.35 0.87 0.00 0.00 0.00 178.83 180.75 1vdy h LYS 68 N 0.79 0.62 -0.41 1.69 1.57 -1.10 -1.77 116.57 117.96 1vdy h LYS 68 Ca 0.57 -0.04 -0.06 0.00 -1.87 0.00 0.00 60.65 59.25 1vdy h LYS 68 Cb 0.85 -0.14 -0.02 0.00 0.08 0.00 0.00 32.23 33.01 1vdy h LYS 68 CO -0.37 0.41 0.02 0.00 -0.57 0.00 0.00 179.45 178.94 1vdy h ALA 69 N 1.36 0.55 -0.30 3.86 0.00 -0.81 -2.77 119.26 121.16 1vdy h ALA 69 Ca 0.30 -0.25 0.07 0.00 0.00 0.00 0.00 54.91 55.03 1vdy h ALA 69 Cb 0.23 -0.15 -0.07 0.00 0.00 0.00 0.00 17.79 17.80 1vdy h ALA 69 CO -0.20 0.31 -0.16 -0.07 0.00 0.00 0.00 179.25 179.13 1vdy h LEU 70 N 0.55 -0.53 -0.56 0.00 -0.00 -0.48 -0.02 115.31 114.27 1vdy h LEU 70 Ca 0.12 0.12 -0.02 0.00 -0.00 0.00 0.00 57.88 58.10 1vdy h LEU 70 Cb 0.45 0.28 -0.03 0.00 -0.00 0.00 0.00 40.66 41.37 1vdy h LEU 70 CO 0.02 -0.19 0.27 -0.09 -0.00 0.00 0.00 178.44 178.44 1vdy h ARG 71 N -0.12 0.82 -0.52 1.13 2.43 -1.41 -2.94 114.38 113.77 1vdy h ARG 71 Ca 0.16 -0.12 0.01 0.00 -0.81 0.00 0.00 59.98 59.21 1vdy h ARG 71 Cb 0.36 -0.15 -0.03 0.00 -0.42 0.00 0.00 29.97 29.73 1vdy h ARG 71 CO -0.37 0.67 0.33 1.25 -1.51 0.00 0.00 179.97 180.34 1vdy h LEU 72 N 0.77 0.56 0.07 3.80 5.85 -1.01 -0.03 115.31 125.32 1vdy h LEU 72 Ca 0.19 -0.01 0.02 0.00 0.84 0.00 0.00 57.88 58.93 1vdy h LEU 72 Cb 0.13 -0.13 -0.04 0.00 0.37 0.00 0.00 40.66 40.99 1vdy h LEU 72 CO -0.02 0.40 -0.29 0.40 -0.34 0.00 0.00 178.44 178.58 1vdy h ILE 73 N 0.67 0.36 -0.20 4.05 2.04 -0.88 0.18 117.51 123.73 1vdy h ILE 73 Ca 0.20 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 66.05 1vdy h ILE 73 Cb -0.04 0.36 -0.01 0.00 -0.74 0.00 0.00 36.82 36.39 1vdy h ILE 73 CO -0.06 0.00 0.08 0.07 0.00 0.00 0.00 178.15 178.24 1vdy h LYS 74 N -0.48 0.30 -0.27 2.37 2.10 -1.34 0.68 116.57 119.92 1vdy h LYS 74 Ca 0.04 -0.05 0.06 0.00 -2.00 0.00 0.00 60.65 58.70 1vdy h LYS 74 Cb 0.54 -0.05 -0.06 0.00 -0.90 0.00 0.00 32.23 31.76 1vdy h LYS 74 CO -0.21 0.36 -0.11 -0.92 -2.00 0.00 0.00 179.45 176.57 1vdy h TYR 75 N 0.17 -0.25 0.35 0.07 5.03 -0.71 -2.95 116.97 118.68 1vdy h TYR 75 Ca 0.07 0.03 -0.02 0.00 2.58 0.00 0.00 58.73 61.39 1vdy h TYR 75 Cb 0.17 0.15 0.00 0.00 1.55 0.00 0.00 36.73 38.60 1vdy h TYR 75 CO -0.01 -0.17 -0.17 0.00 -1.32 0.00 0.00 178.16 176.49 1vdy h ALA 76 N 1.18 -0.46 -0.51 1.82 0.00 -0.54 -3.27 119.26 117.48 1vdy h ALA 76 Ca 0.14 -0.17 0.15 0.00 0.00 0.00 0.00 54.91 55.02 1vdy h ALA 76 Cb 0.27 0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.22 1vdy h ALA 76 CO -0.32 -0.63 0.45 -0.24 0.00 0.00 0.00 179.25 178.52 1vdy h VAL 77 N -0.73 0.50 -0.00 0.00 3.04 -0.77 0.48 116.25 118.76 1vdy h VAL 77 Ca -0.05 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.64 1vdy h VAL 77 Cb 0.50 0.66 0.00 0.00 -2.01 0.00 0.00 31.29 30.44 1vdy h VAL 77 CO 0.08 0.00 -0.22 0.61 -1.01 0.00 0.00 177.57 177.02 1vdy n GLY 78 N -1.56 -1.36 0.00 3.17 0.00 -1.12 -4.48 105.19 99.84 1vdy n GLY 78 Ca 0.09 -0.22 0.00 0.00 0.00 0.00 0.00 46.02 45.90 1vdy n GLY 78 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1vdy n LYS 79 N -1.47 0.00 -0.01 1.61 2.85 -0.73 -4.93 118.16 115.48 1vdy n LYS 79 Ca 0.07 0.00 -0.11 0.00 -1.05 0.00 0.00 58.31 57.22 1vdy n LYS 79 Cb 0.33 -0.14 0.02 0.00 -0.65 0.00 0.00 35.03 34.60 1vdy n LYS 79 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 1vdy h SER 80 N 0.00 0.70 0.00 -5.58 4.64 -1.16 -3.47 113.55 108.67 1vdy h SER 80 Ca 0.00 -0.39 0.00 0.00 -0.47 0.00 0.00 61.79 60.93 1vdy h SER 80 Cb 0.24 -0.20 0.00 0.00 -0.31 0.00 0.00 62.40 62.13 1vdy h SER 80 CO 0.00 1.13 0.00 0.61 -0.87 0.00 0.00 176.83 177.70 1vdy n GLY 81 N 0.35 4.86 0.31 -0.77 0.00 -1.26 -2.98 105.19 105.70 1vdy n GLY 81 Ca -0.04 -0.89 0.11 0.00 0.00 0.00 0.00 46.02 45.21 1vdy n GLY 81 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1vdy h SER 82 N 0.00 0.00 -0.23 1.61 0.02 -1.94 -2.74 113.55 110.27 1vdy h SER 82 Ca 0.00 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 60.93 1vdy h SER 82 Cb 0.00 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.53 1vdy h SER 82 CO 0.00 0.00 0.06 -0.33 -1.14 0.00 0.00 176.83 175.42 1vdy h GLU 83 N 0.00 0.36 0.00 3.45 3.07 -1.96 -2.38 114.58 117.12 1vdy h GLU 83 Ca 0.00 -0.09 -0.01 0.00 -0.50 0.00 0.00 59.36 58.76 1vdy h GLU 83 Cb 0.90 -0.05 -0.00 0.00 -0.84 0.00 0.00 28.75 28.76 1vdy h GLU 83 CO 0.00 0.47 -0.05 0.35 -1.40 0.00 0.00 179.01 178.38 1vdy h PHE 84 N 0.19 0.00 0.70 4.33 3.57 -1.85 -2.78 116.94 121.09 1vdy h PHE 84 Ca 0.07 0.00 -0.03 0.00 3.53 0.00 0.00 57.97 61.54 1vdy h PHE 84 Cb 0.27 0.00 0.01 0.00 2.79 0.00 0.00 35.95 39.02 1vdy h PHE 84 CO 0.01 0.05 -0.33 -0.09 -2.23 0.00 0.00 178.31 175.72 1vdy h ARG 85 N 0.00 -0.90 -0.38 1.11 2.43 -1.58 0.07 114.38 115.13 1vdy h ARG 85 Ca -0.00 0.06 0.07 0.00 -0.81 0.00 0.00 59.98 59.30 1vdy h ARG 85 Cb 0.11 0.20 -0.06 0.00 -0.42 0.00 0.00 29.97 29.80 1vdy h ARG 85 CO 0.01 -0.60 0.01 0.00 -1.51 0.00 0.00 179.97 177.88 1vdy h ARG 86 N -0.94 0.12 -0.31 0.20 2.47 -1.50 -1.51 114.38 112.91 1vdy h ARG 86 Ca -0.10 -0.01 -0.07 0.00 -1.26 0.00 0.00 59.98 58.55 1vdy h ARG 86 Cb 0.72 -0.03 -0.02 0.00 -1.65 0.00 0.00 29.97 29.00 1vdy h ARG 86 CO 0.16 0.08 -0.10 0.93 0.56 0.00 0.00 179.97 181.60 1vdy h GLU 87 N 0.12 0.52 -0.45 0.04 3.07 -1.48 -2.56 114.58 113.83 1vdy h GLU 87 Ca 0.18 -0.14 -0.11 0.00 -0.50 0.00 0.00 59.36 58.80 1vdy h GLU 87 Cb 0.25 -0.06 -0.02 0.00 -0.84 0.00 0.00 28.75 28.09 1vdy h GLU 87 CO -0.30 0.62 -0.15 1.98 -1.40 0.00 0.00 179.01 179.76 1vdy h MET 88 N 0.48 0.86 -0.71 2.33 4.05 -0.01 -2.71 114.93 119.23 1vdy h MET 88 Ca 0.09 -0.32 0.04 0.00 -0.28 0.00 0.00 59.70 59.23 1vdy h MET 88 Cb 0.46 -0.06 -0.05 0.00 -0.80 0.00 0.00 31.60 31.16 1vdy h MET 88 CO 0.03 0.95 0.43 1.96 0.23 0.00 0.00 176.91 180.51 1vdy h GLN 89 N 0.76 0.81 -0.56 0.39 4.20 -0.93 1.00 115.11 120.78 1vdy h GLN 89 Ca 0.12 -0.05 0.13 0.00 0.06 0.00 0.00 58.65 58.91 1vdy h GLN 89 Cb 0.67 -0.18 -0.03 0.00 0.30 0.00 0.00 27.48 28.24 1vdy h GLN 89 CO 0.05 0.54 0.39 -0.09 -0.67 0.00 0.00 178.83 179.04 1vdy h ARG 90 N 0.84 0.19 -0.05 1.46 9.65 -1.28 -2.68 114.38 122.50 1vdy h ARG 90 Ca 0.29 -0.01 0.00 0.00 -1.10 0.00 0.00 59.98 59.16 1vdy h ARG 90 Cb 0.06 -0.04 0.00 0.00 -1.39 0.00 0.00 29.97 28.60 1vdy h ARG 90 CO -0.13 0.12 0.00 0.09 2.80 0.00 0.00 179.97 182.86 1vdy n ASN 91 N -4.43 2.20 0.01 -3.80 3.02 -0.80 -4.77 115.26 106.69 1vdy n ASN 91 Ca 0.10 -2.14 0.01 0.00 -0.03 0.00 0.00 54.58 52.51 1vdy n ASN 91 Cb 0.50 -0.09 0.03 0.00 -0.61 0.00 0.00 39.78 39.61 1vdy n ASN 91 CO 0.00 0.00 0.00 -0.24 -2.62 0.00 0.00 177.26 174.40 1vdy n SER 92 N -0.47 0.03 0.03 6.41 2.88 0.28 -2.15 113.62 120.63 1vdy n SER 92 Ca 0.04 0.44 0.12 0.00 -1.33 0.00 0.00 58.87 58.14 1vdy n SER 92 Cb 0.33 -0.44 0.58 0.00 -0.75 0.00 0.00 64.21 63.93 1vdy n SER 92 CO 0.00 0.00 0.00 1.62 -1.23 0.00 0.00 175.04 175.43 1vdy h VAL 93 N 0.00 0.90 0.00 2.46 3.04 -1.86 0.15 116.25 120.94 1vdy h VAL 93 Ca 0.00 -0.07 -0.01 0.00 -1.01 0.00 0.00 66.70 65.60 1vdy h VAL 93 Cb 0.16 0.67 -0.00 0.00 -2.01 0.00 0.00 31.29 30.11 1vdy h VAL 93 CO 0.00 0.04 -0.07 0.00 -1.01 0.00 0.00 177.57 176.53 1vdy h ALA 94 N 1.79 1.62 0.07 3.17 0.00 -1.84 -0.40 119.26 123.68 1vdy h ALA 94 Ca 0.19 -0.06 -0.28 0.00 0.00 0.00 0.00 54.91 54.75 1vdy h ALA 94 Cb 0.48 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.24 1vdy h ALA 94 CO -0.03 0.09 -1.49 0.28 0.00 0.00 0.00 179.25 178.09 1vdy h VAL 95 N 0.00 0.88 -0.94 0.00 2.07 -0.99 -3.39 116.25 113.88 1vdy h VAL 95 Ca -0.00 -2.29 0.02 0.00 0.82 0.00 0.00 66.70 65.25 1vdy h VAL 95 Cb 0.15 2.48 -0.05 0.00 -1.52 0.00 0.00 31.29 32.35 1vdy h VAL 95 CO 0.01 0.61 0.62 0.03 0.02 0.00 0.00 177.57 178.86 1vdy h ARG 96 N -0.48 1.19 0.00 1.57 3.08 -0.89 -2.02 114.38 116.83 1vdy h ARG 96 Ca -0.35 -0.07 0.00 0.00 0.07 0.00 0.00 59.98 59.63 1vdy h ARG 96 Cb 1.65 -0.27 0.00 0.00 0.08 0.00 0.00 29.97 31.43 1vdy h ARG 96 CO -0.04 0.79 0.00 0.27 -1.07 0.00 0.00 179.97 179.92 1vdy n ASN 97 N -4.42 0.09 0.09 7.04 0.23 -0.19 -2.66 115.26 115.45 1vdy n ASN 97 Ca 0.12 0.52 0.13 0.00 -0.53 0.00 0.00 54.58 54.82 1vdy n ASN 97 Cb 0.06 -0.54 0.35 0.00 -2.08 0.00 0.00 39.78 37.56 1vdy n ASN 97 CO 0.00 0.00 0.00 0.18 -0.93 0.00 0.00 177.26 176.51 1vdy n LEU 98 N -1.61 0.79 0.12 -4.53 4.77 -0.76 -3.82 117.00 111.97 1vdy n LEU 98 Ca 0.03 0.49 0.08 0.00 -0.03 0.00 0.00 56.01 56.58 1vdy n LEU 98 Cb 0.17 -0.28 0.44 0.00 -2.33 0.00 0.00 43.42 41.41 1vdy n LEU 98 CO 0.14 -0.15 0.74 0.49 -1.33 0.00 0.00 177.39 177.28 1vdy n PHE 99 N -2.23 0.54 -0.33 -1.77 3.72 -1.09 -1.09 117.46 115.22 1vdy n PHE 99 Ca 0.05 0.28 0.00 0.00 -0.05 0.00 0.00 57.45 57.73 1vdy n PHE 99 Cb 0.43 -0.95 0.00 0.00 -0.94 0.00 0.00 39.48 38.02 1vdy n PHE 99 CO 0.00 0.00 0.00 -2.39 -0.05 0.00 0.00 176.76 174.32 1vdy n HIS 100 N -2.06 0.00 -2.21 1.38 1.44 -1.25 -5.02 115.22 107.51 1vdy n HIS 100 Ca -0.01 -0.17 -0.42 0.00 -2.01 0.00 0.00 57.72 55.10 1vdy n HIS 100 Cb 0.03 -0.02 -0.03 0.00 0.12 0.00 0.00 29.99 30.09 1vdy n HIS 100 CO 0.00 0.00 0.00 -0.47 -2.81 0.00 0.00 176.34 173.06 1vdy s TYR 101 N -0.34 2.54 -0.03 -1.40 6.14 -0.25 -4.87 117.35 119.14 1vdy s TYR 101 Ca 0.00 0.65 0.18 0.00 0.64 0.00 0.00 57.07 58.54 1vdy s TYR 101 Cb 0.00 -3.70 -0.28 0.00 0.42 0.00 0.00 41.96 38.39 1vdy s TYR 101 CO 0.00 -2.72 0.39 0.36 0.64 0.00 0.00 175.55 174.22 1vdy n LYS 102 N 6.38 0.58 0.00 4.97 -0.00 -1.26 -4.83 118.16 124.00 1vdy n LYS 102 Ca 0.15 -0.16 0.00 0.00 -0.00 0.00 0.00 58.31 58.30 1vdy n LYS 102 Cb 0.44 -1.43 0.00 0.00 -0.00 0.00 0.00 35.03 34.03 1vdy n LYS 102 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1vdy n GLY 103 N 1.48 1.38 3.11 2.58 0.00 -1.26 -4.84 105.19 107.65 1vdy n GLY 103 Ca -0.04 -0.48 -0.11 0.00 0.00 0.00 0.00 46.02 45.38 1vdy n GLY 103 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 1vdy s HIS 104 N 0.00 0.74 1.05 1.61 -3.43 -1.26 -5.10 115.29 108.89 1vdy s HIS 104 Ca 0.00 -0.71 -0.16 0.00 -0.80 0.00 0.00 55.06 53.39 1vdy s HIS 104 Cb 0.00 -0.44 0.22 0.00 -1.43 0.00 0.00 32.58 30.93 1vdy s HIS 104 CO 0.00 -0.13 1.17 -1.25 -2.00 0.00 0.00 174.74 172.53 1vdy s PRO 105 N -2.68 0.00 0.12 -0.38 0.04 -1.26 -4.56 135.00 126.28 1vdy s PRO 105 Ca 0.00 -0.04 0.10 0.00 0.04 0.00 0.00 61.00 61.11 1vdy s PRO 105 Cb -0.02 -1.74 -0.04 0.00 0.04 0.00 0.00 34.50 32.74 1vdy s PRO 105 CO -0.02 -2.90 -0.26 -0.51 0.04 0.00 0.00 177.00 173.34 1vdy s ASP 106 N -4.18 3.14 0.21 6.66 1.01 -1.26 -4.86 116.67 117.39 1vdy s ASP 106 Ca 0.70 -0.72 0.19 0.00 0.71 0.00 0.00 52.55 53.42 1vdy s ASP 106 Cb -0.10 -0.21 0.88 0.00 1.01 0.00 0.00 42.92 44.50 1vdy s ASP 106 CO 0.55 0.16 1.58 -0.81 0.21 0.00 0.00 175.17 176.86 1vdy n PRO 107 N 1.01 0.13 0.00 8.23 -0.04 -1.26 -2.29 135.00 140.79 1vdy n PRO 107 Ca -0.18 0.47 0.00 0.00 -0.04 0.00 0.00 63.50 63.75 1vdy n PRO 107 Cb 0.53 -1.80 0.00 0.00 -0.04 0.00 0.00 33.50 32.19 1vdy n PRO 107 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1vdy n LEU 108 N -2.05 0.00 0.14 1.53 4.32 -1.26 -4.81 117.00 114.87 1vdy n LEU 108 Ca 0.01 0.00 0.09 0.00 -0.02 0.00 0.00 56.01 56.09 1vdy n LEU 108 Cb 0.14 0.00 0.50 0.00 -1.62 0.00 0.00 43.42 42.44 1vdy n LEU 108 CO 0.14 0.00 0.78 0.29 -1.22 0.00 0.00 177.39 177.38 1vdy n LYS 109 N -1.02 0.12 -3.17 3.23 5.02 -1.26 -4.94 118.16 116.13 1vdy n LYS 109 Ca 0.00 0.61 -0.03 0.00 -2.02 0.00 0.00 58.31 56.88 1vdy n LYS 109 Cb 0.00 -1.89 0.00 0.00 -0.02 0.00 0.00 35.03 33.12 1vdy n LYS 109 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1vdy n GLY 110 N -1.30 -0.33 3.19 0.72 0.00 -0.97 -3.84 105.19 102.66 1vdy n GLY 110 Ca -0.01 0.12 -0.15 0.00 0.00 0.00 0.00 46.02 45.98 1vdy n GLY 110 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1vdy n ASP 111 N 1.14 -2.43 0.04 1.61 9.92 -1.26 -4.88 116.55 120.68 1vdy n ASP 111 Ca -0.01 -0.57 0.00 0.00 -0.53 0.00 0.00 54.79 53.69 1vdy n ASP 111 Cb 0.47 -4.70 0.00 0.00 -0.64 0.00 0.00 41.12 36.26 1vdy n ASP 111 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1vdy n ALA 112 N -3.76 3.00 -0.17 2.24 0.00 -1.25 -4.66 120.51 115.91 1vdy n ALA 112 Ca -0.24 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.18 1vdy n ALA 112 Cb 0.65 0.31 0.07 0.00 0.00 0.00 0.00 19.45 20.49 1vdy n ALA 112 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 1vdy h LEU 113 N 0.00 -0.06 -0.25 0.00 -0.00 -1.91 0.68 115.31 113.77 1vdy h LEU 113 Ca 0.00 0.10 0.04 0.00 -0.00 0.00 0.00 57.88 58.02 1vdy h LEU 113 Cb 0.32 0.16 -0.04 0.00 -0.00 0.00 0.00 40.66 41.10 1vdy h LEU 113 CO 0.00 -0.01 0.01 -0.55 -0.00 0.00 0.00 178.44 177.90 1vdy h ASN 114 N 0.20 -0.06 0.25 -0.43 -1.07 -1.89 -2.66 115.58 109.92 1vdy h ASN 114 Ca 0.27 0.05 -0.01 0.00 0.07 0.00 0.00 56.30 56.68 1vdy h ASN 114 Cb 0.38 0.08 -0.00 0.00 -2.07 0.00 0.00 38.32 36.71 1vdy h ASN 114 CO -0.37 -0.00 -0.14 0.11 0.07 0.00 0.00 177.43 177.10 1vdy h LYS 115 N 0.10 -0.35 -0.98 4.14 6.56 -1.63 -2.85 116.57 121.54 1vdy h LYS 115 Ca 0.12 0.02 0.37 0.00 -1.06 0.00 0.00 60.65 60.10 1vdy h LYS 115 Cb 0.14 0.08 -0.18 0.00 -0.57 0.00 0.00 32.23 31.70 1vdy h LYS 115 CO -0.18 -0.24 0.38 0.00 -2.06 0.00 0.00 179.45 177.35 1vdy n ALA 116 N -2.28 0.87 0.47 3.86 0.00 0.16 -0.29 120.51 123.29 1vdy n ALA 116 Ca -0.09 1.02 -0.18 0.00 0.00 0.00 0.00 53.44 54.18 1vdy n ALA 116 Cb 0.18 -0.94 -0.09 0.00 0.00 0.00 0.00 19.45 18.60 1vdy n ALA 116 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1vdy h VAL 117 N 0.00 0.00 -0.41 0.00 2.07 -1.25 -2.07 116.25 114.60 1vdy h VAL 117 Ca 0.77 -0.07 -0.07 0.00 0.82 0.00 0.00 66.70 68.15 1vdy h VAL 117 Cb 1.93 0.00 -0.02 0.00 -1.52 0.00 0.00 31.29 31.68 1vdy h VAL 117 CO -0.81 0.00 -0.03 0.08 0.02 0.00 0.00 177.57 176.83 1vdy h ARG 118 N -1.27 0.67 0.53 1.57 -0.00 -1.06 -0.58 114.38 114.24 1vdy h ARG 118 Ca -0.12 -0.18 -0.02 0.00 -0.00 0.00 0.00 59.98 59.66 1vdy h ARG 118 Cb 0.92 -0.08 -0.01 0.00 -0.00 0.00 0.00 29.97 30.80 1vdy h ARG 118 CO 0.20 0.71 -0.39 0.93 -0.00 0.00 0.00 179.97 181.42 1vdy h GLU 119 N 0.63 -0.86 -0.04 0.08 4.39 -0.68 -2.20 114.58 115.89 1vdy h GLU 119 Ca 0.12 0.06 -0.09 0.00 0.34 0.00 0.00 59.36 59.79 1vdy h GLU 119 Cb 0.44 0.19 -0.01 0.00 -0.10 0.00 0.00 28.75 29.27 1vdy h GLU 119 CO 0.02 -0.57 -0.38 1.15 -1.16 0.00 0.00 179.01 178.07 1vdy h THR 120 N -0.89 1.29 -0.68 1.13 2.02 -1.30 -2.78 112.91 111.70 1vdy h THR 120 Ca -0.06 -1.37 0.12 0.00 0.77 0.00 0.00 66.41 65.87 1vdy h THR 120 Cb 0.75 1.68 -0.04 0.00 -1.74 0.00 0.00 68.15 68.80 1vdy h THR 120 CO 0.02 0.40 0.45 0.00 0.37 0.00 0.00 175.52 176.76 1vdy h ALA 121 N 1.54 2.07 -0.48 6.16 0.00 -0.51 0.61 119.26 128.65 1vdy h ALA 121 Ca 0.01 -0.01 -0.07 0.00 0.00 0.00 0.00 54.91 54.84 1vdy h ALA 121 Cb 0.71 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.42 1vdy h ALA 121 CO 0.05 -0.24 0.03 0.45 0.00 0.00 0.00 179.25 179.54 1vdy h HIS 122 N 0.41 0.90 -0.33 0.00 -0.00 -1.14 -1.10 115.15 113.89 1vdy h HIS 122 Ca 0.32 -0.15 -0.12 0.00 -0.00 0.00 0.00 60.37 60.43 1vdy h HIS 122 Cb 0.70 -0.24 -0.01 0.00 -0.00 0.00 0.00 27.41 27.86 1vdy h HIS 122 CO -0.00 0.85 -0.24 0.93 -0.00 0.00 0.00 177.93 179.46 1vdy h GLU 123 N 0.69 0.76 -0.38 2.45 5.08 -1.26 -2.32 114.58 119.60 1vdy h GLU 123 Ca 0.14 -0.37 0.02 0.00 -1.00 0.00 0.00 59.36 58.15 1vdy h GLU 123 Cb 0.47 -0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.69 1vdy h GLU 123 CO 0.02 0.99 0.20 1.15 -1.00 0.00 0.00 179.01 180.37 1vdy h THR 124 N 0.53 1.01 -0.45 1.13 2.02 -0.79 -0.21 112.91 116.15 1vdy h THR 124 Ca 0.06 -0.14 -0.02 0.00 0.77 0.00 0.00 66.41 67.09 1vdy h THR 124 Cb 0.81 0.56 -0.02 0.00 -1.74 0.00 0.00 68.15 67.75 1vdy h THR 124 CO 0.07 0.08 0.22 0.40 0.37 0.00 0.00 175.52 176.65 1vdy h ILE 125 N 0.42 1.18 -0.67 3.11 1.08 -1.17 -0.87 117.51 120.59 1vdy h ILE 125 Ca 0.15 -0.51 0.12 0.00 -0.39 0.00 0.00 64.86 64.24 1vdy h ILE 125 Cb 0.04 0.68 -0.09 0.00 -3.07 0.00 0.00 36.82 34.38 1vdy h ILE 125 CO -0.09 0.20 0.23 -1.28 -0.69 0.00 0.00 178.15 176.52 1vdy h SER 126 N 0.59 0.18 0.17 1.72 0.87 -0.88 -2.30 113.55 113.90 1vdy h SER 126 Ca 0.16 0.10 -0.01 0.00 -1.23 0.00 0.00 61.79 60.81 1vdy h SER 126 Cb 0.11 0.10 0.00 0.00 -0.44 0.00 0.00 62.40 62.17 1vdy h SER 126 CO -0.02 0.09 -0.08 0.00 -0.53 0.00 0.00 176.83 176.28 1vdy h ALA 127 N 1.49 -0.23 -0.39 6.23 0.00 -0.63 -2.93 119.26 122.81 1vdy h ALA 127 Ca 0.36 -0.19 0.06 0.00 0.00 0.00 0.00 54.91 55.14 1vdy h ALA 127 Cb 0.51 0.09 -0.09 0.00 0.00 0.00 0.00 17.79 18.30 1vdy h ALA 127 CO -0.38 -0.44 -0.46 0.82 0.00 0.00 0.00 179.25 178.79 1vdy h ILE 128 N -0.61 0.08 -0.60 0.00 2.04 -0.91 -1.76 117.51 115.75 1vdy h ILE 128 Ca -0.02 0.00 -0.34 0.00 1.00 0.00 0.00 64.86 65.49 1vdy h ILE 128 Cb 0.45 0.08 -0.18 0.00 -0.74 0.00 0.00 36.82 36.44 1vdy h ILE 128 CO 0.04 0.00 0.44 0.49 0.00 0.00 0.00 178.15 179.12 1vdy n PHE 129 N -5.41 1.87 -0.08 1.37 3.72 -0.89 -4.56 117.46 113.49 1vdy n PHE 129 Ca -0.02 -1.64 -0.15 0.00 -0.05 0.00 0.00 57.45 55.59 1vdy n PHE 129 Cb 0.35 -0.82 -0.12 0.00 -0.94 0.00 0.00 39.48 37.96 1vdy n PHE 129 CO 0.00 0.00 0.00 1.03 -0.05 0.00 0.00 176.76 177.74 1vdy h SER 130 N 0.97 0.00 -3.18 4.37 0.87 -1.12 -3.45 113.55 112.01 1vdy h SER 130 Ca 0.37 -0.78 -0.53 0.00 -1.23 0.00 0.00 61.79 59.62 1vdy h SER 130 Cb 1.66 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.63 1vdy h SER 130 CO 0.77 1.11 0.57 -1.61 -0.53 0.00 0.00 176.83 177.14 1vdy s GLU 131 N -2.23 4.42 -0.97 2.24 8.01 -1.26 -4.95 118.70 123.97 1vdy s GLU 131 Ca -0.21 1.79 -0.24 0.00 0.01 0.00 0.00 54.97 56.33 1vdy s GLU 131 Cb -0.00 -3.34 0.03 0.00 -4.31 0.00 0.00 34.13 26.51 1vdy s GLU 131 CO 0.61 -0.27 1.52 -1.21 0.01 0.00 0.00 175.26 175.93 1vdy s GLU 132 N 1.08 3.36 -0.09 1.61 2.02 -1.26 -4.92 118.70 120.49 1vdy s GLU 132 Ca 0.59 -0.87 -0.03 0.00 0.02 0.00 0.00 54.97 54.68 1vdy s GLU 132 Cb -0.30 -5.18 0.05 0.00 0.10 0.00 0.00 34.13 28.80 1vdy s GLU 132 CO 0.29 -2.41 0.16 1.21 0.02 0.00 0.00 175.26 174.54 1vdy s ASN 133 N 5.43 0.86 0.00 -0.19 2.47 -1.26 -5.10 114.94 117.15 1vdy s ASN 133 Ca 0.49 0.25 0.00 0.00 0.42 0.00 0.00 52.86 54.03 1vdy s ASN 133 Cb -0.02 0.26 0.00 0.00 -1.45 0.00 0.00 41.25 40.03 1vdy s ASN 133 CO -0.05 -0.25 0.00 0.61 -3.72 0.00 0.00 177.10 173.68 1vdy n GLY 134 N 5.32 2.60 2.65 1.21 0.00 -1.26 -5.05 105.19 110.66 1vdy n GLY 134 Ca -0.05 -1.82 -0.22 0.00 0.00 0.00 0.00 46.02 43.93 1vdy n GLY 134 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1vdy s SER 135 N 0.00 2.19 1.00 1.61 0.15 -1.26 -5.15 113.70 112.24 1vdy s SER 135 Ca 0.00 -1.36 -0.06 0.00 0.70 0.00 0.00 55.95 55.22 1vdy s SER 135 Cb 0.00 0.16 0.09 0.00 -1.71 0.00 0.00 66.02 64.56 1vdy s SER 135 CO 0.00 -0.35 0.49 0.61 1.20 0.00 0.00 173.24 175.19 1vdy n GLY 136 N 4.77 -1.33 3.58 9.45 0.00 -1.26 -4.94 105.19 115.46 1vdy n GLY 136 Ca 0.03 -1.67 -0.30 0.00 0.00 0.00 0.00 46.02 44.08 1vdy n GLY 136 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1vdy s PRO 137 N -4.08 2.74 0.00 1.61 0.04 -1.26 -4.69 135.00 129.35 1vdy s PRO 137 Ca 0.28 -1.16 0.19 0.00 0.04 0.00 0.00 61.00 60.35 1vdy s PRO 137 Cb -0.01 -5.26 0.31 0.00 0.04 0.00 0.00 34.50 29.57 1vdy s PRO 137 CO 0.20 -3.62 1.24 0.43 0.04 0.00 0.00 177.00 175.29 1vdy n SER 138 N 13.37 3.00 -4.01 6.66 7.64 -1.26 -4.73 113.62 134.29 1vdy n SER 138 Ca 0.44 -1.88 -0.43 0.00 1.01 0.00 0.00 58.87 58.02 1vdy n SER 138 Cb 0.47 -0.16 0.00 0.00 -1.01 0.00 0.00 64.21 63.51 1vdy n SER 138 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 1vdy n SER 139 N 1.14 5.06 0.00 6.43 2.88 -1.26 -5.31 113.62 122.56 1vdy n SER 139 Ca 0.15 -3.06 0.00 0.00 -1.33 0.00 0.00 58.87 54.62 1vdy n SER 139 Cb 0.51 -1.51 0.00 0.00 -0.75 0.00 0.00 64.21 62.45 1vdy n SER 139 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42