#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1byr s PRO 3 N 0.00 4.06 0.18 5.31 0.04 -1.24 -4.69 135.00 138.65 1byr s PRO 3 Ca 0.00 2.03 -0.16 0.00 0.04 0.00 0.00 61.00 62.91 1byr s PRO 3 Cb 0.00 -2.78 0.02 0.00 0.04 0.00 0.00 34.50 31.79 1byr s PRO 3 CO 0.00 -0.37 0.46 -1.54 0.04 0.00 0.00 177.00 175.59 1byr s SER 4 N -0.87 -0.21 -0.02 6.66 1.04 -1.01 -5.01 113.70 114.30 1byr s SER 4 Ca 0.56 -0.51 0.02 0.00 0.48 0.00 0.00 55.95 56.50 1byr s SER 4 Cb -0.35 0.54 0.00 0.00 0.10 0.00 0.00 66.02 66.30 1byr s SER 4 CO 0.45 -0.99 -0.07 -0.69 0.98 0.00 0.00 173.24 172.92 1byr s VAL 5 N -3.87 0.59 0.14 5.02 1.01 -1.26 -0.70 120.40 121.33 1byr s VAL 5 Ca 0.09 -0.28 0.10 0.00 0.00 0.00 0.00 61.98 61.89 1byr s VAL 5 Cb 0.00 -0.53 -0.04 0.00 0.00 0.00 0.00 36.38 35.82 1byr s VAL 5 CO -0.04 0.19 -0.24 -1.10 0.00 0.00 0.00 175.10 173.90 1byr s GLN 6 N 0.08 1.35 0.05 2.72 -0.21 -0.67 -4.97 119.66 118.01 1byr s GLN 6 Ca -0.01 -1.35 0.02 0.00 0.02 0.00 0.00 55.36 54.04 1byr s GLN 6 Cb -0.06 -1.70 -0.03 0.00 1.00 0.00 0.00 33.01 32.22 1byr s GLN 6 CO -0.00 0.39 -0.08 0.08 -2.12 0.00 0.00 175.29 173.55 1byr s VAL 7 N -1.34 0.63 0.05 1.09 1.01 -1.26 -1.10 120.40 119.48 1byr s VAL 7 Ca 0.14 -1.22 -0.06 0.00 0.00 0.00 0.00 61.98 60.85 1byr s VAL 7 Cb -0.09 -0.80 -0.01 0.00 0.00 0.00 0.00 36.38 35.48 1byr s VAL 7 CO 0.07 -0.43 0.10 -0.83 0.00 0.00 0.00 175.10 174.01 1byr s GLY 8 N -1.79 0.19 0.14 4.51 0.00 -0.33 -4.89 107.32 105.15 1byr s GLY 8 Ca -0.06 -0.64 0.04 0.00 0.00 0.00 0.00 44.72 44.06 1byr s GLY 8 CO 0.00 -0.79 -0.10 -0.19 0.00 0.00 0.00 173.10 172.02 1byr s TYR 9 N -3.01 1.23 0.15 1.90 2.02 -1.26 -1.10 117.35 117.28 1byr s TYR 9 Ca -0.02 -0.76 0.11 0.00 -0.37 0.00 0.00 57.07 56.03 1byr s TYR 9 Cb 0.01 -0.63 -0.04 0.00 -0.40 0.00 0.00 41.96 40.90 1byr s TYR 9 CO -0.06 0.06 -0.25 -1.12 -1.57 0.00 0.00 175.55 172.61 1byr s SER 10 N -3.11 3.27 -0.00 2.29 0.01 -0.72 -2.01 113.70 113.44 1byr s SER 10 Ca 0.16 -0.79 0.01 0.00 1.31 0.00 0.00 55.95 56.63 1byr s SER 10 Cb 0.02 -0.22 0.02 0.00 0.21 0.00 0.00 66.02 66.05 1byr s SER 10 CO 0.00 0.14 0.97 -0.81 0.41 0.00 0.00 173.24 173.95 1byr n PRO 11 N 0.65 1.05 -0.31 12.44 -0.04 -0.66 -1.65 135.00 146.47 1byr n PRO 11 Ca -0.16 -0.07 0.10 0.00 -0.04 0.00 0.00 63.50 63.33 1byr n PRO 11 Cb 0.54 -1.06 0.27 0.00 -0.04 0.00 0.00 33.50 33.22 1byr n PRO 11 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 1byr h GLU 12 N 0.11 0.59 0.00 0.54 3.07 -1.85 -3.46 114.58 113.58 1byr h GLU 12 Ca 0.00 -0.04 0.00 0.00 -0.50 0.00 0.00 59.36 58.82 1byr h GLU 12 Cb 0.07 -0.13 0.00 0.00 -0.84 0.00 0.00 28.75 27.85 1byr h GLU 12 CO 0.00 0.39 0.00 0.41 -1.40 0.00 0.00 179.01 178.41 1byr n GLY 13 N -1.33 2.01 0.20 -3.84 0.00 -0.85 -4.98 105.19 96.40 1byr n GLY 13 Ca 0.20 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.27 1byr n GLY 13 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1byr h SER 14 N 0.41 0.00 0.06 1.61 4.64 -1.84 -2.92 113.55 115.51 1byr h SER 14 Ca 0.00 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1byr h SER 14 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1byr h SER 14 CO 0.00 0.32 -0.03 0.00 -0.87 0.00 0.00 176.83 176.26 1byr h ALA 15 N 1.68 -0.08 -0.18 5.18 0.00 -1.58 -1.63 119.26 122.65 1byr h ALA 15 Ca -0.00 -0.16 0.04 0.00 0.00 0.00 0.00 54.91 54.79 1byr h ALA 15 Cb 0.64 0.03 -0.05 0.00 0.00 0.00 0.00 17.79 18.41 1byr h ALA 15 CO 0.04 -0.38 -0.11 -0.09 0.00 0.00 0.00 179.25 178.71 1byr h ARG 16 N -0.40 -0.10 -0.95 0.00 2.43 -1.81 -0.20 114.38 113.37 1byr h ARG 16 Ca -0.01 0.01 0.02 0.00 -0.81 0.00 0.00 59.98 59.19 1byr h ARG 16 Cb 0.35 0.02 -0.05 0.00 -0.42 0.00 0.00 29.97 29.87 1byr h ARG 16 CO 0.01 -0.06 0.62 0.28 -1.51 0.00 0.00 179.97 179.31 1byr h VAL 17 N -0.10 1.20 -0.47 0.20 2.07 -1.51 -0.98 116.25 116.66 1byr h VAL 17 Ca 0.10 -0.43 -0.05 0.00 0.82 0.00 0.00 66.70 67.15 1byr h VAL 17 Cb 0.25 -0.15 -0.02 0.00 -1.52 0.00 0.00 31.29 29.85 1byr h VAL 17 CO -0.24 0.23 0.11 0.25 0.02 0.00 0.00 177.57 177.94 1byr h LEU 18 N 1.24 0.71 -0.56 2.57 5.85 -0.68 0.51 115.31 124.96 1byr h LEU 18 Ca 0.36 -0.23 -0.02 0.00 0.84 0.00 0.00 57.88 58.83 1byr h LEU 18 Cb -0.07 -0.19 -0.03 0.00 0.37 0.00 0.00 40.66 40.74 1byr h LEU 18 CO -0.10 0.76 0.28 0.58 -0.34 0.00 0.00 178.44 179.62 1byr h VAL 19 N 0.63 1.20 -0.69 1.05 2.07 -0.66 -1.15 116.25 118.70 1byr h VAL 19 Ca 0.15 -0.55 -0.03 0.00 0.82 0.00 0.00 66.70 67.09 1byr h VAL 19 Cb 0.33 0.54 -0.03 0.00 -1.52 0.00 0.00 31.29 30.60 1byr h VAL 19 CO 0.00 0.22 0.32 -0.07 0.02 0.00 0.00 177.57 178.07 1byr h LEU 20 N 0.75 0.88 -1.04 2.57 3.38 -0.91 -2.30 115.31 118.65 1byr h LEU 20 Ca 0.19 -0.10 -0.02 0.00 0.09 0.00 0.00 57.88 58.04 1byr h LEU 20 Cb 0.10 -0.23 -0.04 0.00 0.09 0.00 0.00 40.66 40.59 1byr h LEU 20 CO -0.03 0.75 0.38 -1.28 0.09 0.00 0.00 178.44 178.36 1byr h SER 21 N 0.97 0.95 -0.33 -0.43 0.87 -0.19 0.10 113.55 115.49 1byr h SER 21 Ca 0.24 -0.09 -0.07 0.00 -1.23 0.00 0.00 61.79 60.63 1byr h SER 21 Cb 0.11 -0.24 -0.01 0.00 -0.44 0.00 0.00 62.40 61.82 1byr h SER 21 CO -0.03 0.79 -0.08 0.00 -0.53 0.00 0.00 176.83 176.97 1byr h ALA 22 N 1.36 0.46 -0.36 6.23 0.00 -0.70 -1.73 119.26 124.52 1byr h ALA 22 Ca 0.26 -0.30 -0.08 0.00 0.00 0.00 0.00 54.91 54.80 1byr h ALA 22 Cb 0.07 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 1byr h ALA 22 CO -0.04 0.30 -0.08 0.82 0.00 0.00 0.00 179.25 180.26 1byr h ILE 23 N 0.43 1.28 0.00 0.00 2.04 -1.11 -2.71 117.51 117.44 1byr h ILE 23 Ca 0.08 -1.14 -0.00 0.00 1.00 0.00 0.00 64.86 64.81 1byr h ILE 23 Cb 0.58 1.27 -0.00 0.00 -0.74 0.00 0.00 36.82 37.94 1byr h ILE 23 CO 0.03 0.37 -0.01 0.44 0.00 0.00 0.00 178.15 178.98 1byr h ASP 24 N 0.49 0.00 1.35 1.72 3.32 -0.75 -2.57 116.42 119.97 1byr h ASP 24 Ca 0.09 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.14 1byr h ASP 24 Cb 0.58 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.13 1byr h ASP 24 CO 0.03 0.01 -0.43 0.77 -1.72 0.00 0.00 179.24 177.91 1byr h SER 25 N 0.00 0.00 -2.50 6.45 4.64 -0.98 -3.47 113.55 117.70 1byr h SER 25 Ca -0.00 -0.05 -0.53 0.00 -0.47 0.00 0.00 61.79 60.74 1byr h SER 25 Cb 0.18 0.00 0.04 0.00 -0.31 0.00 0.00 62.40 62.30 1byr h SER 25 CO 0.00 0.03 1.14 0.00 -0.87 0.00 0.00 176.83 177.13 1byr s ALA 26 N -3.22 3.74 -0.05 5.18 0.00 -0.97 -4.87 121.76 121.57 1byr s ALA 26 Ca 0.05 1.45 0.13 0.00 0.00 0.00 0.00 51.96 53.59 1byr s ALA 26 Cb 0.10 -3.78 -0.20 0.00 0.00 0.00 0.00 23.12 19.24 1byr s ALA 26 CO 0.70 -1.29 0.23 1.63 0.00 0.00 0.00 175.76 177.04 1byr n LYS 27 N 5.97 0.82 0.00 0.00 4.76 -1.26 -4.88 118.16 123.57 1byr n LYS 27 Ca 0.18 -0.09 0.00 0.00 -2.87 0.00 0.00 58.31 55.53 1byr n LYS 27 Cb 0.38 -1.32 0.00 0.00 -1.84 0.00 0.00 35.03 32.25 1byr n LYS 27 CO 0.00 0.00 0.00 0.25 -1.37 0.00 0.00 177.40 176.28 1byr n THR 28 N -2.10 0.00 -3.81 -0.18 -2.24 -1.26 -4.65 114.28 100.04 1byr n THR 28 Ca -0.07 0.00 -0.10 0.00 -2.27 0.00 0.00 64.05 61.61 1byr n THR 28 Cb 0.50 -0.57 -0.07 0.00 -2.10 0.00 0.00 70.33 68.09 1byr n THR 28 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1byr s SER 29 N -4.16 0.01 -0.10 3.42 1.04 -1.26 -0.60 113.70 112.05 1byr s SER 29 Ca 0.00 -0.47 -0.04 0.00 0.48 0.00 0.00 55.95 55.92 1byr s SER 29 Cb 0.00 0.35 0.05 0.00 0.10 0.00 0.00 66.02 66.52 1byr s SER 29 CO 0.00 -0.69 0.20 -0.63 0.98 0.00 0.00 173.24 173.10 1byr s ILE 30 N -3.36 -0.20 -0.25 -1.02 1.01 -0.39 -0.26 121.20 116.72 1byr s ILE 30 Ca 0.01 0.25 0.02 0.00 0.00 0.00 0.00 60.65 60.93 1byr s ILE 30 Cb 0.02 -0.34 0.07 0.00 0.01 0.00 0.00 42.46 42.22 1byr s ILE 30 CO -0.08 0.10 -0.05 -0.13 0.00 0.00 0.00 174.94 174.78 1byr s ARG 31 N 1.84 1.73 0.01 2.79 1.81 -0.14 -1.61 118.95 125.38 1byr s ARG 31 Ca -0.03 -1.18 0.04 0.00 -1.72 0.00 0.00 55.73 52.84 1byr s ARG 31 Cb -0.12 -2.70 -0.03 0.00 -0.45 0.00 0.00 34.95 31.65 1byr s ARG 31 CO -0.07 -0.64 -0.09 1.41 -0.68 0.00 0.00 175.30 175.23 1byr s MET 32 N 1.28 2.47 -0.05 3.54 -2.45 -0.58 -1.00 119.30 122.51 1byr s MET 32 Ca -0.04 -0.76 0.04 0.00 -1.25 0.00 0.00 55.69 53.68 1byr s MET 32 Cb -0.19 -2.45 -0.00 0.00 1.25 0.00 0.00 34.83 33.44 1byr s MET 32 CO -0.07 0.59 -0.17 -1.64 1.05 0.00 0.00 175.02 174.78 1byr s MET 33 N -1.38 1.95 0.03 4.11 -1.94 0.32 -1.34 119.30 121.05 1byr s MET 33 Ca 0.16 -0.62 -0.09 0.00 -1.71 0.00 0.00 55.69 53.44 1byr s MET 33 Cb -0.11 -1.64 0.00 0.00 2.01 0.00 0.00 34.83 35.09 1byr s MET 33 CO 0.07 0.20 0.17 0.00 -0.01 0.00 0.00 175.02 175.45 1byr s ALA 34 N 0.18 -0.32 0.00 3.03 0.00 -0.99 -1.27 121.76 122.39 1byr s ALA 34 Ca -0.08 -0.27 0.00 0.00 0.00 0.00 0.00 51.96 51.62 1byr s ALA 34 Cb -0.13 0.23 0.00 0.00 0.00 0.00 0.00 23.12 23.22 1byr s ALA 34 CO 0.03 -0.32 0.00 0.98 0.00 0.00 0.00 175.76 176.46 1byr n TYR 35 N 0.89 0.00 -1.68 0.00 9.36 -1.17 -1.22 117.16 123.35 1byr n TYR 35 Ca -0.20 0.00 -0.46 0.00 3.32 0.00 0.00 57.90 60.56 1byr n TYR 35 Cb 0.58 0.00 -0.04 0.00 -0.63 0.00 0.00 39.34 39.25 1byr n TYR 35 CO 0.00 0.00 0.00 0.43 0.22 0.00 0.00 176.86 177.51 1byr n SER 36 N 0.00 3.66 -3.96 2.98 7.64 -1.26 -4.24 113.62 118.44 1byr n SER 36 Ca 0.00 0.96 -0.31 0.00 1.01 0.00 0.00 58.87 60.54 1byr n SER 36 Cb 0.00 -1.43 -0.14 0.00 -1.01 0.00 0.00 64.21 61.64 1byr n SER 36 CO 0.00 0.00 0.00 0.12 -3.01 0.00 0.00 175.04 172.15 1byr s PHE 37 N 3.81 3.21 0.00 1.43 5.36 -1.26 -3.39 117.98 127.13 1byr s PHE 37 Ca 0.90 -3.14 0.00 0.00 -0.96 0.00 0.00 56.93 53.73 1byr s PHE 37 Cb -0.61 -2.85 0.00 0.00 -0.34 0.00 0.00 43.02 39.22 1byr s PHE 37 CO 0.47 -0.75 0.00 0.25 -1.46 0.00 0.00 175.22 173.73 1byr n THR 38 N 3.12 0.00 -1.57 0.12 -2.24 -0.41 -4.39 114.28 108.91 1byr n THR 38 Ca 0.05 0.00 -0.45 0.00 -2.27 0.00 0.00 64.05 61.38 1byr n THR 38 Cb 0.33 0.00 -0.04 0.00 -2.10 0.00 0.00 70.33 68.52 1byr n THR 38 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1byr n ALA 39 N -0.09 1.56 -0.32 6.98 0.00 -0.34 -4.84 120.51 123.47 1byr n ALA 39 Ca 0.00 -0.16 0.08 0.00 0.00 0.00 0.00 53.44 53.36 1byr n ALA 39 Cb 0.00 -2.80 0.24 0.00 0.00 0.00 0.00 19.45 16.89 1byr n ALA 39 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 1byr h PRO 40 N 13.94 0.69 -0.88 0.00 0.11 -1.97 -1.27 132.00 142.62 1byr h PRO 40 Ca -0.38 -0.04 0.04 0.00 0.11 0.00 0.00 66.00 65.73 1byr h PRO 40 Cb 1.26 -0.16 -0.05 0.00 0.11 0.00 0.00 31.00 32.16 1byr h PRO 40 CO 0.97 0.46 0.57 0.38 -0.21 0.00 0.00 178.00 180.16 1byr h ASP 41 N 0.71 0.93 -0.38 -2.05 2.03 -2.00 -0.42 116.42 115.24 1byr h ASP 41 Ca 0.49 -0.00 -0.06 0.00 -0.73 0.00 0.00 57.03 56.72 1byr h ASP 41 Cb 0.67 -0.20 -0.01 0.00 -0.83 0.00 0.00 39.33 38.95 1byr h ASP 41 CO -0.35 0.63 -0.01 0.40 -1.03 0.00 0.00 179.24 178.88 1byr h ILE 42 N 1.08 1.26 -0.46 4.15 1.08 -1.65 -2.30 117.51 120.68 1byr h ILE 42 Ca 0.36 -1.02 -0.02 0.00 -0.39 0.00 0.00 64.86 63.79 1byr h ILE 42 Cb 0.05 1.17 -0.02 0.00 -3.07 0.00 0.00 36.82 34.95 1byr h ILE 42 CO -0.13 0.34 0.21 0.24 -0.69 0.00 0.00 178.15 178.12 1byr h MET 43 N 0.49 0.67 -0.99 2.37 2.86 -0.87 -0.86 114.93 118.59 1byr h MET 43 Ca 0.11 -0.11 0.01 0.00 -2.06 0.00 0.00 59.70 57.65 1byr h MET 43 Cb 0.48 -0.12 -0.05 0.00 0.06 0.00 0.00 31.60 31.98 1byr h MET 43 CO 0.02 0.58 0.65 0.87 1.06 0.00 0.00 176.91 180.10 1byr h LYS 44 N 0.60 1.31 -0.54 1.72 1.57 -1.04 -1.33 116.57 118.85 1byr h LYS 44 Ca 0.16 -0.08 -0.12 0.00 -1.87 0.00 0.00 60.65 58.74 1byr h LYS 44 Cb 0.14 -0.29 -0.02 0.00 0.08 0.00 0.00 32.23 32.14 1byr h LYS 44 CO -0.02 0.87 -0.12 0.00 -0.57 0.00 0.00 179.45 179.60 1byr h ALA 45 N 1.36 0.74 -0.37 3.86 0.00 -1.09 -1.32 119.26 122.45 1byr h ALA 45 Ca 0.36 -0.36 -0.04 0.00 0.00 0.00 0.00 54.91 54.88 1byr h ALA 45 Cb -0.15 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.43 1byr h ALA 45 CO -0.08 0.67 0.09 -0.07 0.00 0.00 0.00 179.25 179.86 1byr h LEU 46 N 0.91 0.56 -1.17 0.00 3.38 -0.65 -1.49 115.31 116.85 1byr h LEU 46 Ca 0.14 -0.23 -0.09 0.00 0.09 0.00 0.00 57.88 57.79 1byr h LEU 46 Cb 0.70 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.29 1byr h LEU 46 CO 0.05 0.64 -0.41 -0.37 0.09 0.00 0.00 178.44 178.44 1byr h VAL 47 N 0.44 1.29 -0.11 1.22 -1.51 -1.23 -1.43 116.25 114.94 1byr h VAL 47 Ca 0.11 -1.42 -0.10 0.00 -1.23 0.00 0.00 66.70 64.06 1byr h VAL 47 Cb 0.31 1.77 -0.01 0.00 -2.13 0.00 0.00 31.29 31.22 1byr h VAL 47 CO 0.00 0.41 -0.37 0.00 -1.23 0.00 0.00 177.57 176.38 1byr h ALA 48 N 1.59 1.18 -0.13 5.19 0.00 -0.91 -1.35 119.26 124.82 1byr h ALA 48 Ca -0.00 -0.38 -0.02 0.00 0.00 0.00 0.00 54.91 54.51 1byr h ALA 48 Cb 0.74 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.43 1byr h ALA 48 CO 0.05 0.55 0.00 0.00 0.00 0.00 0.00 179.25 179.86 1byr h ALA 49 N 1.43 0.18 -0.40 0.00 0.00 -0.32 -2.03 119.26 118.11 1byr h ALA 49 Ca 0.02 -0.19 0.06 0.00 0.00 0.00 0.00 54.91 54.81 1byr h ALA 49 Cb 0.75 -0.05 -0.05 0.00 0.00 0.00 0.00 17.79 18.43 1byr h ALA 49 CO 0.06 -0.13 0.08 -0.22 0.00 0.00 0.00 179.25 179.03 1byr h LYS 50 N -0.03 0.20 -0.19 0.00 1.63 -1.01 -0.32 116.57 116.85 1byr h LYS 50 Ca 0.04 -0.01 0.06 0.00 -0.85 0.00 0.00 60.65 59.88 1byr h LYS 50 Cb 0.36 -0.05 -0.01 0.00 -0.60 0.00 0.00 32.23 31.93 1byr h LYS 50 CO 0.01 0.13 0.14 0.87 -3.45 0.00 0.00 179.45 177.15 1byr h LYS 51 N 0.21 0.00 0.00 1.90 1.57 -1.13 0.56 116.57 119.68 1byr h LYS 51 Ca 0.19 -0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.97 1byr h LYS 51 Cb 0.23 -0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.54 1byr h LYS 51 CO -0.25 0.00 0.00 0.54 -0.57 0.00 0.00 179.45 179.17 1byr n ARG 52 N -4.48 0.05 0.00 3.15 1.74 -0.21 -4.86 116.66 112.05 1byr n ARG 52 Ca 0.02 0.14 0.00 0.00 -0.77 0.00 0.00 57.85 57.24 1byr n ARG 52 Cb 0.28 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 30.22 1byr n ARG 52 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1byr n GLY 53 N 0.59 0.48 3.75 -0.13 0.00 0.20 -5.07 105.19 105.01 1byr n GLY 53 Ca 0.06 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.67 1byr n GLY 53 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1byr s VAL 54 N -2.00 2.78 -0.82 1.61 1.01 -0.73 -4.93 120.40 117.32 1byr s VAL 54 Ca 0.00 0.70 -0.25 0.00 0.00 0.00 0.00 61.98 62.43 1byr s VAL 54 Cb 0.00 -3.45 0.04 0.00 0.00 0.00 0.00 36.38 32.97 1byr s VAL 54 CO 0.00 0.13 1.30 -0.62 0.00 0.00 0.00 175.10 175.92 1byr s ASP 55 N 0.01 6.28 -0.21 3.32 2.15 0.23 -4.28 116.67 124.18 1byr s ASP 55 Ca 0.55 -0.83 -0.08 0.00 0.43 0.00 0.00 52.55 52.61 1byr s ASP 55 Cb -0.40 -2.55 -0.04 0.00 -0.30 0.00 0.00 42.92 39.63 1byr s ASP 55 CO 0.46 -1.69 0.07 -0.69 -0.17 0.00 0.00 175.17 173.16 1byr s VAL 56 N 5.30 4.72 -0.02 1.11 1.01 -1.26 -1.26 120.40 130.01 1byr s VAL 56 Ca 0.37 -0.05 0.02 0.00 0.00 0.00 0.00 61.98 62.32 1byr s VAL 56 Cb -0.06 -3.16 0.00 0.00 0.00 0.00 0.00 36.38 33.16 1byr s VAL 56 CO 0.07 0.41 -0.05 -0.54 0.00 0.00 0.00 175.10 174.99 1byr s LYS 57 N 0.77 0.57 -0.02 2.72 1.02 -0.64 -3.60 119.74 120.56 1byr s LYS 57 Ca 0.04 -0.17 0.02 0.00 0.02 0.00 0.00 55.97 55.88 1byr s LYS 57 Cb -0.13 -0.57 0.00 0.00 -0.52 0.00 0.00 37.83 36.61 1byr s LYS 57 CO 0.02 0.06 -0.09 0.42 -0.92 0.00 0.00 175.35 174.85 1byr s ILE 58 N 0.20 0.74 -0.12 2.17 1.01 -0.44 -1.53 121.20 123.24 1byr s ILE 58 Ca -0.02 -0.34 0.01 0.00 0.00 0.00 0.00 60.65 60.30 1byr s ILE 58 Cb -0.06 -0.66 0.02 0.00 0.01 0.00 0.00 42.46 41.77 1byr s ILE 58 CO -0.00 0.23 -0.15 0.68 0.00 0.00 0.00 174.94 175.70 1byr s VAL 59 N 0.15 1.49 0.27 2.92 -7.23 -0.45 -0.69 120.40 116.86 1byr s VAL 59 Ca -0.02 -0.62 0.09 0.00 -1.81 0.00 0.00 61.98 59.61 1byr s VAL 59 Cb -0.08 -1.37 -0.05 0.00 0.56 0.00 0.00 36.38 35.44 1byr s VAL 59 CO 0.00 0.44 -0.13 0.27 -0.31 0.00 0.00 175.10 175.38 1byr s ILE 60 N 1.14 1.97 0.27 -0.62 -4.36 0.51 -2.34 121.20 117.76 1byr s ILE 60 Ca -0.03 -2.24 -0.30 0.00 -0.26 0.00 0.00 60.65 57.82 1byr s ILE 60 Cb -0.14 -2.31 -0.10 0.00 1.25 0.00 0.00 42.46 41.15 1byr s ILE 60 CO -0.04 -0.40 1.44 -0.62 0.24 0.00 0.00 174.94 175.55 1byr s ASP 61 N -3.44 6.63 -0.10 4.36 2.15 -0.35 -0.05 116.67 125.86 1byr s ASP 61 Ca 0.28 2.71 -0.12 0.00 0.43 0.00 0.00 52.55 55.85 1byr s ASP 61 Cb -0.00 -2.63 -0.10 0.00 -0.30 0.00 0.00 42.92 39.89 1byr s ASP 61 CO 0.12 -0.71 0.39 -0.08 -0.17 0.00 0.00 175.17 174.72 1byr h GLU 62 N 4.70 -0.07 -0.44 4.34 4.81 -1.45 -3.32 114.58 123.14 1byr h GLU 62 Ca -0.47 0.00 0.04 0.00 -0.13 0.00 0.00 59.36 58.81 1byr h GLU 62 Cb 1.22 0.02 -0.02 0.00 0.63 0.00 0.00 28.75 30.59 1byr h GLU 62 CO 0.76 0.28 0.30 0.00 -0.73 0.00 0.00 179.01 179.61 1byr h ARG 63 N -0.99 0.44 -0.32 1.92 3.08 -1.92 -2.17 114.38 114.43 1byr h ARG 63 Ca -0.01 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.02 1byr h ARG 63 Cb 0.38 -0.10 0.00 0.00 0.08 0.00 0.00 29.97 30.33 1byr h ARG 63 CO 0.01 0.29 0.00 0.41 -1.07 0.00 0.00 179.97 179.61 1byr n GLY 64 N -1.50 0.50 2.55 0.04 0.00 -1.26 -4.27 105.19 101.26 1byr n GLY 64 Ca 0.05 -0.35 -0.20 0.00 0.00 0.00 0.00 46.02 45.52 1byr n GLY 64 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1byr n ASN 65 N 0.44 3.44 -0.28 1.61 3.02 -0.81 -4.62 115.26 118.06 1byr n ASN 65 Ca 0.11 -3.33 0.03 0.00 -0.03 0.00 0.00 54.58 51.36 1byr n ASN 65 Cb 0.28 -0.49 0.04 0.00 -0.61 0.00 0.00 39.78 39.00 1byr n ASN 65 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 1byr n THR 66 N -0.31 0.25 -1.62 3.41 -2.24 -1.26 -4.57 114.28 107.94 1byr n THR 66 Ca 0.27 -0.63 -0.31 0.00 -2.27 0.00 0.00 64.05 61.12 1byr n THR 66 Cb 0.72 0.97 0.06 0.00 -2.10 0.00 0.00 70.33 69.98 1byr n THR 66 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1byr s GLY 67 N -0.65 1.65 0.19 3.38 0.00 -1.26 -4.83 107.32 105.79 1byr s GLY 67 Ca 0.09 -0.08 -0.13 0.00 0.00 0.00 0.00 44.72 44.60 1byr s GLY 67 CO 0.08 0.27 1.72 -0.09 0.00 0.00 0.00 173.10 175.09 1byr h ARG 68 N -0.81 0.25 -0.68 2.90 9.65 -2.00 -1.03 114.38 122.66 1byr h ARG 68 Ca -0.45 -0.01 -0.03 0.00 -1.10 0.00 0.00 59.98 58.38 1byr h ARG 68 Cb 1.23 -0.06 -0.03 0.00 -1.39 0.00 0.00 29.97 29.73 1byr h ARG 68 CO 0.59 0.16 0.30 0.00 2.80 0.00 0.00 179.97 183.82 1byr h ALA 69 N 1.37 1.24 -0.18 2.80 0.00 -1.96 -1.21 119.26 121.32 1byr h ALA 69 Ca 0.25 -0.16 -0.00 0.00 0.00 0.00 0.00 54.91 55.00 1byr h ALA 69 Cb 0.32 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 1byr h ALA 69 CO -0.31 0.57 0.10 0.77 0.00 0.00 0.00 179.25 180.38 1byr h SER 70 N 0.98 0.22 -0.74 0.00 0.02 -1.50 -1.93 113.55 110.60 1byr h SER 70 Ca 0.23 -0.07 -0.00 0.00 -0.84 0.00 0.00 61.79 61.11 1byr h SER 70 Cb 0.15 -0.06 -0.04 0.00 0.14 0.00 0.00 62.40 62.59 1byr h SER 70 CO -0.03 0.23 0.46 0.40 -1.14 0.00 0.00 176.83 176.75 1byr h ILE 71 N 0.19 1.20 -0.57 3.27 2.04 -0.80 -0.41 117.51 122.44 1byr h ILE 71 Ca 0.06 -0.43 0.03 0.00 1.00 0.00 0.00 64.86 65.53 1byr h ILE 71 Cb 0.06 0.16 -0.04 0.00 -0.74 0.00 0.00 36.82 36.26 1byr h ILE 71 CO -0.01 0.21 0.34 0.00 0.00 0.00 0.00 178.15 178.68 1byr h ALA 72 N 1.24 0.74 -0.28 1.87 0.00 -1.01 0.14 119.26 121.97 1byr h ALA 72 Ca 0.27 -0.01 -0.09 0.00 0.00 0.00 0.00 54.91 55.08 1byr h ALA 72 Cb -0.06 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 1byr h ALA 72 CO -0.05 0.05 -0.17 0.00 0.00 0.00 0.00 179.25 179.07 1byr h ALA 73 N 1.26 0.39 -0.71 0.00 0.00 -0.98 -0.27 119.26 118.95 1byr h ALA 73 Ca 0.23 -0.34 -0.00 0.00 0.00 0.00 0.00 54.91 54.80 1byr h ALA 73 Cb 0.05 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.71 1byr h ALA 73 CO -0.11 0.31 0.43 0.52 0.00 0.00 0.00 179.25 180.40 1byr h MET 74 N 0.34 0.97 -0.24 0.00 2.07 -0.84 0.15 114.93 117.39 1byr h MET 74 Ca 0.06 -0.09 -0.04 0.00 -2.07 0.00 0.00 59.70 57.56 1byr h MET 74 Cb 0.71 -0.20 -0.01 0.00 -1.87 0.00 0.00 31.60 30.23 1byr h MET 74 CO 0.05 0.69 -0.01 -0.91 1.07 0.00 0.00 176.91 177.80 1byr h ASN 75 N 0.97 0.42 -0.49 1.22 -0.26 -0.63 -0.73 115.58 116.08 1byr h ASN 75 Ca 0.26 -0.32 0.05 0.00 -0.56 0.00 0.00 56.30 55.73 1byr h ASN 75 Cb -0.03 -0.11 -0.05 0.00 -1.06 0.00 0.00 38.32 37.07 1byr h ASN 75 CO -0.05 0.64 0.21 0.22 -1.06 0.00 0.00 177.43 177.40 1byr h TYR 76 N 0.19 0.39 -0.12 1.19 3.20 -0.74 -0.95 116.97 120.12 1byr h TYR 76 Ca 0.07 0.02 -0.02 0.00 3.14 0.00 0.00 58.73 61.94 1byr h TYR 76 Cb 0.43 -0.10 -0.00 0.00 1.54 0.00 0.00 36.73 38.59 1byr h TYR 76 CO 0.04 0.16 0.01 0.82 -1.64 0.00 0.00 178.16 177.55 1byr h ILE 77 N 0.42 1.23 -0.79 1.81 1.08 -0.54 -3.11 117.51 117.61 1byr h ILE 77 Ca 0.23 -0.73 -0.03 0.00 -0.39 0.00 0.00 64.86 63.93 1byr h ILE 77 Cb 0.19 1.49 -0.04 0.00 -3.07 0.00 0.00 36.82 35.39 1byr h ILE 77 CO -0.20 0.21 0.37 0.00 -0.69 0.00 0.00 178.15 177.84 1byr h ALA 78 N 0.78 1.03 -0.06 1.87 0.00 -0.98 -2.30 119.26 119.58 1byr h ALA 78 Ca 0.04 -0.17 0.02 0.00 0.00 0.00 0.00 54.91 54.80 1byr h ALA 78 Cb 0.32 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 17.79 1byr h ALA 78 CO 0.00 0.60 0.13 -0.91 0.00 0.00 0.00 179.25 179.08 1byr h ASN 79 N 1.13 0.00 -0.02 0.00 2.35 -1.14 -0.28 115.58 117.62 1byr h ASN 79 Ca 0.27 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.02 1byr h ASN 79 Cb 0.14 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.51 1byr h ASN 79 CO -0.03 0.00 0.00 -1.20 -1.65 0.00 0.00 177.43 174.55 1byr n SER 80 N -3.42 1.21 0.00 5.81 7.64 -0.87 -4.92 113.62 119.06 1byr n SER 80 Ca -0.01 -1.41 0.00 0.00 1.01 0.00 0.00 58.87 58.46 1byr n SER 80 Cb 0.21 -0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.41 1byr n SER 80 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1byr n GLY 81 N 1.14 0.59 3.62 0.23 0.00 -0.12 -4.99 105.19 105.67 1byr n GLY 81 Ca 0.20 -0.13 -0.42 0.00 0.00 0.00 0.00 46.02 45.67 1byr n GLY 81 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1byr s ILE 82 N -2.00 4.82 0.04 -0.61 1.01 -1.19 -5.00 121.20 118.27 1byr s ILE 82 Ca 0.00 1.29 -0.31 0.00 0.00 0.00 0.00 60.65 61.63 1byr s ILE 82 Cb 0.00 -4.12 -0.10 0.00 0.01 0.00 0.00 42.46 38.25 1byr s ILE 82 CO 0.00 -0.18 1.93 -2.65 0.00 0.00 0.00 174.94 174.03 1byr n PRO 83 N 6.12 2.73 -4.41 2.79 -0.02 -1.24 -4.41 135.00 136.56 1byr n PRO 83 Ca 0.04 1.00 -0.19 0.00 -2.02 0.00 0.00 63.50 62.33 1byr n PRO 83 Cb 0.48 -2.92 -0.15 0.00 -0.02 0.00 0.00 33.50 30.89 1byr n PRO 83 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 1byr s LEU 84 N 3.97 2.02 0.04 2.45 2.96 -1.26 -1.33 118.68 127.53 1byr s LEU 84 Ca 0.88 -0.18 0.03 0.00 -0.22 0.00 0.00 54.13 54.64 1byr s LEU 84 Cb -0.49 -0.51 -0.02 0.00 0.50 0.00 0.00 46.19 45.67 1byr s LEU 84 CO 0.43 0.12 -0.09 -0.13 -1.32 0.00 0.00 176.35 175.35 1byr s ARG 85 N -0.24 0.60 -0.02 1.98 0.52 0.14 -0.46 118.95 121.47 1byr s ARG 85 Ca 0.04 -0.70 -0.02 0.00 -0.52 0.00 0.00 55.73 54.53 1byr s ARG 85 Cb -0.04 -0.47 -0.04 0.00 0.52 0.00 0.00 34.95 34.93 1byr s ARG 85 CO -0.00 0.10 0.11 0.95 0.02 0.00 0.00 175.30 176.48 1byr s THR 86 N -1.10 4.97 -0.10 0.02 -4.23 -0.33 -0.37 115.64 114.51 1byr s THR 86 Ca -0.06 -0.29 0.01 0.00 -1.18 0.00 0.00 61.69 60.18 1byr s THR 86 Cb -0.08 -3.27 0.02 0.00 1.34 0.00 0.00 72.50 70.50 1byr s THR 86 CO 0.01 0.37 -0.11 -0.62 -0.54 0.00 0.00 174.62 173.73 1byr s ASP 87 N -1.71 2.11 -0.02 3.99 2.15 0.92 0.08 116.67 124.19 1byr s ASP 87 Ca 0.23 -0.33 0.03 0.00 0.43 0.00 0.00 52.55 52.91 1byr s ASP 87 Cb -0.12 -0.89 0.04 0.00 -0.30 0.00 0.00 42.92 41.65 1byr s ASP 87 CO 0.14 -0.04 1.02 -1.54 -0.17 0.00 0.00 175.17 174.58 1byr n SER 88 N 4.45 2.04 0.00 -0.34 3.41 -1.26 -1.12 113.62 120.79 1byr n SER 88 Ca -0.17 -2.16 0.11 0.00 -0.26 0.00 0.00 58.87 56.39 1byr n SER 88 Cb 0.51 -0.06 0.61 0.00 -0.26 0.00 0.00 64.21 65.01 1byr n SER 88 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1byr n ASN 89 N -0.64 0.00 -4.17 4.04 3.02 -1.26 -4.71 115.26 111.54 1byr n ASN 89 Ca 0.02 -0.38 -0.23 0.00 -0.03 0.00 0.00 54.58 53.96 1byr n ASN 89 Cb 0.31 -0.14 -0.15 0.00 -0.61 0.00 0.00 39.78 39.20 1byr n ASN 89 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 1byr s PHE 90 N -2.28 1.49 0.32 3.10 0.40 -1.26 -5.01 117.98 114.74 1byr s PHE 90 Ca 0.28 -0.31 0.11 0.00 -0.60 0.00 0.00 56.93 56.40 1byr s PHE 90 Cb 0.15 -0.93 0.95 0.00 0.51 0.00 0.00 43.02 43.70 1byr s PHE 90 CO 0.30 0.01 1.70 -1.35 0.70 0.00 0.00 175.22 176.57 1byr h PRO 91 N 5.40 0.43 -2.86 0.24 0.11 -1.98 -3.38 132.00 129.96 1byr h PRO 91 Ca -0.38 -0.03 -0.20 0.00 0.11 0.00 0.00 66.00 65.51 1byr h PRO 91 Cb 1.16 -0.10 -0.31 0.00 0.11 0.00 0.00 31.00 31.86 1byr h PRO 91 CO 0.47 0.29 -0.50 0.42 -0.21 0.00 0.00 178.00 178.46 1byr s ILE 92 N -5.75 -0.34 -1.00 4.15 1.01 -1.26 -4.94 121.20 113.07 1byr s ILE 92 Ca -0.11 0.24 -0.18 0.00 0.00 0.00 0.00 60.65 60.60 1byr s ILE 92 Cb 0.28 -0.45 0.12 0.00 0.01 0.00 0.00 42.46 42.43 1byr s ILE 92 CO 0.79 0.10 1.25 -1.58 0.00 0.00 0.00 174.94 175.50 1byr s GLN 93 N 2.16 3.70 0.00 2.79 0.74 -1.26 -4.85 119.66 122.94 1byr s GLN 93 Ca -0.01 -1.81 0.29 0.00 0.05 0.00 0.00 55.36 53.87 1byr s GLN 93 Cb -0.12 -5.03 1.29 0.00 1.10 0.00 0.00 33.01 30.25 1byr s GLN 93 CO -0.09 -1.86 1.93 1.58 -0.55 0.00 0.00 175.29 176.31 1byr n HIS 94 N 6.82 0.00 -1.83 1.67 -0.00 -1.26 -4.00 115.22 116.62 1byr n HIS 94 Ca 0.28 0.00 -0.40 0.00 0.46 0.00 0.00 57.72 58.06 1byr n HIS 94 Cb 0.48 -0.36 0.01 0.00 -0.12 0.00 0.00 29.99 30.00 1byr n HIS 94 CO 0.00 0.00 0.00 -0.51 0.46 0.00 0.00 176.34 176.29 1byr s ASP 95 N -2.77 6.04 -0.54 0.26 1.11 -1.26 -4.65 116.67 114.87 1byr s ASP 95 Ca 0.21 2.92 0.04 0.00 0.18 0.00 0.00 52.55 55.90 1byr s ASP 95 Cb 0.20 -2.66 0.16 0.00 1.07 0.00 0.00 42.92 41.68 1byr s ASP 95 CO 0.51 -1.06 0.36 -0.54 1.18 0.00 0.00 175.17 175.61 1byr s LYS 96 N -2.33 1.68 -0.00 8.23 3.01 -1.26 -3.05 119.74 126.02 1byr s LYS 96 Ca 0.58 -2.57 0.03 0.00 -1.01 0.00 0.00 55.97 53.01 1byr s LYS 96 Cb -0.44 -2.59 -0.01 0.00 -1.01 0.00 0.00 37.83 33.79 1byr s LYS 96 CO 0.57 -1.26 -0.11 0.08 0.51 0.00 0.00 175.35 175.15 1byr s VAL 97 N -0.43 0.84 -0.16 3.17 1.01 -0.40 -4.02 120.40 120.42 1byr s VAL 97 Ca 0.24 -0.51 -0.01 0.00 0.00 0.00 0.00 61.98 61.70 1byr s VAL 97 Cb -0.10 -0.71 0.04 0.00 0.00 0.00 0.00 36.38 35.60 1byr s VAL 97 CO -0.11 0.20 -0.03 -0.63 0.00 0.00 0.00 175.10 174.53 1byr s ILE 98 N -0.33 0.95 -0.31 2.22 1.01 -0.78 -0.52 121.20 123.45 1byr s ILE 98 Ca 0.03 -0.56 -0.11 0.00 0.00 0.00 0.00 60.65 60.01 1byr s ILE 98 Cb -0.05 -1.18 -0.03 0.00 0.01 0.00 0.00 42.46 41.21 1byr s ILE 98 CO -0.00 0.07 0.20 -0.63 0.00 0.00 0.00 174.94 174.57 1byr s ILE 99 N 1.70 5.11 -0.17 2.92 1.01 -0.17 -0.02 121.20 131.58 1byr s ILE 99 Ca 0.01 -0.10 -0.04 0.00 0.00 0.00 0.00 60.65 60.52 1byr s ILE 99 Cb -0.15 -3.54 -0.02 0.00 0.01 0.00 0.00 42.46 38.76 1byr s ILE 99 CO -0.07 0.13 -0.04 -0.69 0.00 0.00 0.00 174.94 174.26 1byr s VAL 100 N 1.71 3.78 -1.30 2.92 1.01 0.76 -0.96 120.40 128.32 1byr s VAL 100 Ca 0.06 -0.39 -0.06 0.00 0.00 0.00 0.00 61.98 61.59 1byr s VAL 100 Cb -0.17 -2.67 0.04 0.00 0.00 0.00 0.00 36.38 33.59 1byr s VAL 100 CO 0.10 0.48 0.39 0.47 0.00 0.00 0.00 175.10 176.54 1byr n ASP 101 N 3.77 -4.35 -0.44 3.32 8.00 0.64 -1.33 116.55 126.17 1byr n ASP 101 Ca -0.17 -0.22 -0.05 0.00 0.71 0.00 0.00 54.79 55.05 1byr n ASP 101 Cb 0.52 -3.59 -0.02 0.00 -0.02 0.00 0.00 41.12 38.01 1byr n ASP 101 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 1byr n ASN 102 N -2.23 -4.83 0.00 -2.24 5.15 -1.26 -4.61 115.26 105.23 1byr n ASN 102 Ca -0.07 0.13 0.00 0.00 -0.60 0.00 0.00 54.58 54.03 1byr n ASN 102 Cb 0.58 -3.31 0.00 0.00 -0.53 0.00 0.00 39.78 36.52 1byr n ASN 102 CO 0.00 0.00 0.00 1.33 1.40 0.00 0.00 177.26 179.99 1byr n VAL 103 N -1.79 0.00 -4.99 3.44 0.24 -0.94 -4.49 118.33 109.80 1byr n VAL 103 Ca -0.05 0.00 -0.29 0.00 -2.04 0.00 0.00 64.34 61.96 1byr n VAL 103 Cb 0.46 1.05 -0.15 0.00 -1.47 0.00 0.00 33.84 33.73 1byr n VAL 103 CO 0.00 0.00 0.00 -0.89 -2.14 0.00 0.00 176.83 173.80 1byr s THR 104 N 0.00 1.92 -0.08 3.34 2.01 -0.44 -0.80 115.64 121.59 1byr s THR 104 Ca 0.00 -1.18 0.00 0.00 0.31 0.00 0.00 61.69 60.82 1byr s THR 104 Cb 0.00 -1.63 0.02 0.00 0.01 0.00 0.00 72.50 70.91 1byr s THR 104 CO 0.00 0.41 -0.05 -0.69 -0.69 0.00 0.00 174.62 173.60 1byr s VAL 105 N -0.69 0.74 -0.12 3.82 1.01 -0.51 -0.17 120.40 124.49 1byr s VAL 105 Ca 0.10 -0.17 -0.06 0.00 0.00 0.00 0.00 61.98 61.85 1byr s VAL 105 Cb -0.09 -0.78 -0.04 0.00 0.00 0.00 0.00 36.38 35.47 1byr s VAL 105 CO 0.01 0.30 0.09 -0.70 0.00 0.00 0.00 175.10 174.80 1byr s GLU 106 N 1.41 3.42 0.32 2.72 -6.30 0.97 -0.36 118.70 120.87 1byr s GLU 106 Ca -0.02 -0.24 -0.18 0.00 -2.50 0.00 0.00 54.97 52.03 1byr s GLU 106 Cb -0.13 -3.10 0.06 0.00 0.00 0.00 0.00 34.13 30.96 1byr s GLU 106 CO -0.03 0.68 0.86 -0.08 0.02 0.00 0.00 175.26 176.70 1byr s THR 107 N -0.76 0.00 -5.00 -1.70 -1.32 -0.27 -1.86 115.64 104.74 1byr s THR 107 Ca 0.13 -0.88 0.00 0.00 -1.21 0.00 0.00 61.69 59.73 1byr s THR 107 Cb -0.12 -2.82 0.00 0.00 -1.51 0.00 0.00 72.50 68.05 1byr s THR 107 CO 0.03 0.00 0.00 0.61 -2.21 0.00 0.00 174.62 173.05 1byr n GLY 108 N -0.57 0.81 0.10 6.08 0.00 -1.26 -0.60 105.19 109.75 1byr n GLY 108 Ca -0.07 -1.72 0.02 0.00 0.00 0.00 0.00 46.02 44.25 1byr n GLY 108 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1byr h SER 109 N 0.00 0.00 -1.06 1.61 4.64 -1.70 -3.43 113.55 113.61 1byr h SER 109 Ca 0.00 0.00 -0.68 0.00 -0.47 0.00 0.00 61.79 60.64 1byr h SER 109 Cb 0.00 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.07 1byr h SER 109 CO 0.00 0.49 1.39 0.33 -0.87 0.00 0.00 176.83 178.17 1byr n PHE 110 N -2.89 1.60 -2.85 4.77 -0.00 -1.16 -4.93 117.46 112.01 1byr n PHE 110 Ca -0.07 0.31 -0.29 0.00 -0.00 0.00 0.00 57.45 57.39 1byr n PHE 110 Cb 0.79 -2.52 -0.02 0.00 -0.00 0.00 0.00 39.48 37.73 1byr n PHE 110 CO 0.00 0.00 0.00 -0.80 -0.00 0.00 0.00 176.76 175.96 1byr s ASN 111 N 7.06 6.46 -1.37 -2.13 -0.87 -1.26 -4.80 114.94 118.02 1byr s ASN 111 Ca 1.10 1.05 -0.10 0.00 -1.57 0.00 0.00 52.86 53.34 1byr s ASN 111 Cb -0.90 -2.29 0.10 0.00 -0.02 0.00 0.00 41.25 38.14 1byr s ASN 111 CO 0.51 -0.42 2.16 0.49 -2.57 0.00 0.00 177.10 177.27 1byr n PHE 112 N -1.48 2.95 -4.20 2.20 3.72 -1.22 -4.62 117.46 114.82 1byr n PHE 112 Ca 0.02 -2.87 -0.12 0.00 -0.05 0.00 0.00 57.45 54.43 1byr n PHE 112 Cb 0.54 -2.12 -0.10 0.00 -0.94 0.00 0.00 39.48 36.86 1byr n PHE 112 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 176.76 177.66 1byr s THR 113 N 0.93 0.29 0.08 4.37 -4.23 -1.26 -1.20 115.64 114.62 1byr s THR 113 Ca 0.47 -1.95 -0.20 0.00 -1.18 0.00 0.00 61.69 58.83 1byr s THR 113 Cb 0.13 -2.21 -0.09 0.00 1.34 0.00 0.00 72.50 71.67 1byr s THR 113 CO -0.04 -0.34 1.55 0.11 -0.54 0.00 0.00 174.62 175.36 1byr h LYS 114 N 2.72 0.34 -0.88 3.99 6.56 -1.89 -2.53 116.57 124.89 1byr h LYS 114 Ca -0.36 -0.09 0.05 0.00 -1.06 0.00 0.00 60.65 59.19 1byr h LYS 114 Cb 1.21 -0.04 -0.05 0.00 -0.57 0.00 0.00 32.23 32.78 1byr h LYS 114 CO 0.59 0.49 0.57 0.00 -2.06 0.00 0.00 179.45 179.04 1byr h ALA 115 N 0.84 1.50 -0.09 3.86 0.00 -1.96 -0.29 119.26 123.11 1byr h ALA 115 Ca 0.06 -0.03 -0.08 0.00 0.00 0.00 0.00 54.91 54.87 1byr h ALA 115 Cb 0.31 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 1byr h ALA 115 CO 0.00 0.39 -0.28 0.00 0.00 0.00 0.00 179.25 179.36 1byr h ALA 116 N 1.51 1.35 0.12 0.00 0.00 -1.76 -0.72 119.26 119.76 1byr h ALA 116 Ca 0.36 -0.31 -0.29 0.00 0.00 0.00 0.00 54.91 54.68 1byr h ALA 116 Cb 0.12 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 17.83 1byr h ALA 116 CO -0.12 0.45 -1.40 0.93 0.00 0.00 0.00 179.25 179.11 1byr h GLU 117 N 0.15 0.26 0.00 0.00 5.08 -0.80 -3.42 114.58 115.85 1byr h GLU 117 Ca 0.02 -0.44 0.00 0.00 -1.00 0.00 0.00 59.36 57.94 1byr h GLU 117 Cb 0.59 0.16 0.00 0.00 0.50 0.00 0.00 28.75 30.00 1byr h GLU 117 CO 0.04 1.16 -0.27 2.41 -1.00 0.00 0.00 179.01 181.35 1byr n THR 118 N -3.49 0.00 0.00 1.13 -1.04 -0.24 -4.56 114.28 106.09 1byr n THR 118 Ca -0.13 -0.33 0.00 0.00 -2.04 0.00 0.00 64.05 61.55 1byr n THR 118 Cb 1.04 0.85 0.00 0.00 -1.82 0.00 0.00 70.33 70.39 1byr n THR 118 CO 0.00 0.00 0.00 0.29 -0.64 0.00 0.00 175.07 174.72 1byr n LYS 119 N -1.07 0.00 -1.68 -2.82 4.76 -0.39 -4.78 118.16 112.18 1byr n LYS 119 Ca 0.00 0.00 -0.31 0.00 -2.87 0.00 0.00 58.31 55.13 1byr n LYS 119 Cb 0.00 -0.56 0.05 0.00 -1.84 0.00 0.00 35.03 32.67 1byr n LYS 119 CO 0.00 0.00 0.00 -0.80 -1.37 0.00 0.00 177.40 175.23 1byr s ASN 120 N -4.78 5.46 -0.12 4.39 0.01 -0.55 -4.61 114.94 114.73 1byr s ASN 120 Ca 0.00 1.45 -0.21 0.00 -0.71 0.00 0.00 52.86 53.40 1byr s ASN 120 Cb 0.00 -2.34 -0.04 0.00 0.41 0.00 0.00 41.25 39.28 1byr s ASN 120 CO 0.00 -1.37 0.60 -0.55 -1.51 0.00 0.00 177.10 174.26 1byr s SER 121 N -3.98 6.79 0.22 -1.22 0.15 -1.25 -1.66 113.70 112.74 1byr s SER 121 Ca 0.58 0.95 -0.09 0.00 0.70 0.00 0.00 55.95 58.08 1byr s SER 121 Cb -0.13 -2.35 -0.01 0.00 -1.71 0.00 0.00 66.02 61.82 1byr s SER 121 CO 0.54 -0.12 0.36 -1.61 1.20 0.00 0.00 173.24 173.62 1byr s GLU 122 N 1.05 1.40 0.00 5.44 0.41 -0.66 -4.92 118.70 121.43 1byr s GLU 122 Ca 0.31 -1.34 -0.00 0.00 -0.41 0.00 0.00 54.97 53.53 1byr s GLU 122 Cb -0.16 0.41 -0.00 0.00 -1.78 0.00 0.00 34.13 32.59 1byr s GLU 122 CO 0.13 -0.55 0.01 0.54 -0.49 0.00 0.00 175.26 174.90 1byr s ASN 123 N -3.05 0.05 -0.02 -0.19 4.22 -1.26 -1.75 114.94 112.93 1byr s ASN 123 Ca 0.26 -0.10 0.02 0.00 -2.14 0.00 0.00 52.86 50.90 1byr s ASN 123 Cb 0.02 0.05 0.00 0.00 1.28 0.00 0.00 41.25 42.60 1byr s ASN 123 CO 0.08 -0.08 -0.08 0.00 -2.04 0.00 0.00 177.10 174.99 1byr s ALA 124 N -0.36 0.77 0.07 3.54 0.00 -0.26 -1.76 121.76 123.76 1byr s ALA 124 Ca -0.04 -0.28 0.08 0.00 0.00 0.00 0.00 51.96 51.72 1byr s ALA 124 Cb -0.02 -0.30 -0.03 0.00 0.00 0.00 0.00 23.12 22.77 1byr s ALA 124 CO -0.00 0.12 -0.23 0.14 0.00 0.00 0.00 175.76 175.79 1byr s VAL 125 N 0.23 1.84 -0.22 0.00 -7.23 0.23 -1.19 120.40 114.07 1byr s VAL 125 Ca -0.03 -1.38 0.01 0.00 -1.81 0.00 0.00 61.98 58.78 1byr s VAL 125 Cb -0.08 -1.61 0.05 0.00 0.56 0.00 0.00 36.38 35.29 1byr s VAL 125 CO 0.00 0.17 -0.11 -0.69 -0.31 0.00 0.00 175.10 174.16 1byr s VAL 126 N -0.91 1.83 -0.53 1.32 1.01 -0.25 -1.11 120.40 121.76 1byr s VAL 126 Ca 0.09 -1.18 -0.17 0.00 0.00 0.00 0.00 61.98 60.71 1byr s VAL 126 Cb -0.09 -1.89 0.09 0.00 0.00 0.00 0.00 36.38 34.49 1byr s VAL 126 CO 0.03 0.15 0.54 -0.63 0.00 0.00 0.00 175.10 175.19 1byr s ILE 127 N 1.30 5.06 0.18 2.22 1.01 0.51 -1.67 121.20 129.82 1byr s ILE 127 Ca -0.03 -1.05 -0.21 0.00 0.00 0.00 0.00 60.65 59.36 1byr s ILE 127 Cb -0.17 -4.31 -0.08 0.00 0.01 0.00 0.00 42.46 37.92 1byr s ILE 127 CO -0.08 -0.83 0.71 0.26 0.00 0.00 0.00 174.94 175.00 1byr s TRP 128 N 2.08 3.75 -1.05 3.97 0.52 0.13 -1.42 118.94 126.91 1byr s TRP 128 Ca 0.08 1.43 -0.16 0.00 0.02 0.00 0.00 56.10 57.47 1byr s TRP 128 Cb -0.25 -2.64 -0.01 0.00 -1.15 0.00 0.00 33.47 29.43 1byr s TRP 128 CO 0.07 0.43 0.76 0.09 0.02 0.00 0.00 176.95 178.31 1byr n ASN 129 N 1.12 -5.54 -3.41 2.95 4.13 -1.07 -2.40 115.26 111.04 1byr n ASN 129 Ca -0.05 -0.91 -0.27 0.00 1.68 0.00 0.00 54.58 55.04 1byr n ASN 129 Cb 0.50 -3.33 -0.10 0.00 -1.54 0.00 0.00 39.78 35.31 1byr n ASN 129 CO 0.00 0.00 0.00 0.23 0.28 0.00 0.00 177.26 177.77 1byr n MET 130 N -3.73 0.46 -0.26 3.52 2.81 0.02 -3.72 117.12 116.22 1byr n MET 130 Ca -0.11 -3.33 0.07 0.00 -1.81 0.00 0.00 57.70 52.52 1byr n MET 130 Cb 0.59 -1.68 0.21 0.00 -0.71 0.00 0.00 33.22 31.64 1byr n MET 130 CO 0.00 0.00 0.00 -1.35 1.51 0.00 0.00 175.97 176.13 1byr h PRO 131 N 5.35 0.31 -0.64 0.03 0.11 -1.84 -1.76 132.00 133.56 1byr h PRO 131 Ca 0.23 -0.02 -0.05 0.00 0.11 0.00 0.00 66.00 66.27 1byr h PRO 131 Cb 0.89 -0.07 -0.03 0.00 0.11 0.00 0.00 31.00 31.90 1byr h PRO 131 CO 0.43 0.21 0.20 0.87 -0.21 0.00 0.00 178.00 179.49 1byr h LYS 132 N 0.32 0.98 -0.43 1.05 6.56 -1.93 -0.58 116.57 122.54 1byr h LYS 132 Ca 0.45 -0.19 -0.10 0.00 -1.06 0.00 0.00 60.65 59.75 1byr h LYS 132 Cb 0.78 -0.15 -0.01 0.00 -0.57 0.00 0.00 32.23 32.27 1byr h LYS 132 CO -0.50 0.84 -0.12 1.25 -2.06 0.00 0.00 179.45 178.85 1byr h LEU 133 N 0.95 0.85 -0.51 2.94 5.85 -1.73 -2.64 115.31 121.01 1byr h LEU 133 Ca 0.21 -0.37 -0.13 0.00 0.84 0.00 0.00 57.88 58.43 1byr h LEU 133 Cb 0.27 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 41.06 1byr h LEU 133 CO -0.01 1.02 -0.20 0.00 -0.34 0.00 0.00 178.44 178.92 1byr h ALA 134 N 0.85 0.71 -0.12 1.25 0.00 -1.00 -1.55 119.26 119.40 1byr h ALA 134 Ca 0.11 -0.39 -0.08 0.00 0.00 0.00 0.00 54.91 54.55 1byr h ALA 134 Cb 0.66 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 1byr h ALA 134 CO 0.05 0.68 -0.28 1.49 0.00 0.00 0.00 179.25 181.18 1byr h GLU 135 N 0.87 0.23 -0.27 0.00 4.57 -1.11 0.24 114.58 119.10 1byr h GLU 135 Ca 0.12 -0.08 -0.05 0.00 -1.18 0.00 0.00 59.36 58.16 1byr h GLU 135 Cb 0.78 -0.02 -0.01 0.00 -0.16 0.00 0.00 28.75 29.34 1byr h GLU 135 CO 0.06 0.50 -0.04 1.03 -1.18 0.00 0.00 179.01 179.39 1byr h SER 136 N 0.20 0.51 -0.25 1.04 0.87 -1.24 -2.20 113.55 112.48 1byr h SER 136 Ca 0.03 -0.34 -0.04 0.00 -1.23 0.00 0.00 61.79 60.21 1byr h SER 136 Cb 0.61 -0.14 -0.02 0.00 -0.44 0.00 0.00 62.40 62.42 1byr h SER 136 CO 0.04 0.73 0.04 -0.26 -0.53 0.00 0.00 176.83 176.85 1byr h PHE 137 N 0.28 0.53 -0.83 2.24 0.04 -0.73 -2.31 116.94 116.14 1byr h PHE 137 Ca 0.07 -0.04 -0.01 0.00 2.80 0.00 0.00 57.97 60.79 1byr h PHE 137 Cb 0.49 -0.16 -0.04 0.00 2.20 0.00 0.00 35.95 38.44 1byr h PHE 137 CO 0.04 0.50 0.47 1.25 -0.60 0.00 0.00 178.31 179.97 1byr h LEU 138 N 0.50 1.03 -1.21 1.54 5.85 -0.26 0.11 115.31 122.88 1byr h LEU 138 Ca 0.11 -0.09 -0.02 0.00 0.84 0.00 0.00 57.88 58.72 1byr h LEU 138 Cb 0.27 -0.26 -0.03 0.00 0.37 0.00 0.00 40.66 41.01 1byr h LEU 138 CO 0.00 0.82 0.27 -0.33 -0.34 0.00 0.00 178.44 178.87 1byr h GLU 139 N 1.15 0.82 -0.38 1.25 5.08 -0.85 0.43 114.58 122.08 1byr h GLU 139 Ca 0.29 -0.11 -0.08 0.00 -1.00 0.00 0.00 59.36 58.47 1byr h GLU 139 Cb 0.01 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 29.09 1byr h GLU 139 CO -0.05 0.65 -0.06 1.25 -1.00 0.00 0.00 179.01 179.80 1byr h HIS 140 N 0.82 0.79 -0.26 4.33 2.76 -1.01 -1.72 115.15 120.86 1byr h HIS 140 Ca 0.20 -0.16 -0.04 0.00 -2.20 0.00 0.00 60.37 58.17 1byr h HIS 140 Cb 0.10 -0.20 -0.01 0.00 1.55 0.00 0.00 27.41 28.85 1byr h HIS 140 CO 0.01 0.84 -0.00 2.35 -1.30 0.00 0.00 177.93 179.82 1byr h TRP 141 N 0.52 0.51 -0.85 5.26 7.01 -0.10 -3.02 115.95 125.27 1byr h TRP 141 Ca 0.10 -0.09 0.00 0.00 2.11 0.00 0.00 58.89 61.01 1byr h TRP 141 Cb 0.56 -0.13 -0.04 0.00 -2.10 0.00 0.00 29.16 27.45 1byr h TRP 141 CO 0.05 0.62 0.54 0.37 -2.79 0.00 0.00 178.44 177.24 1byr h GLN 142 N 0.25 1.14 -0.70 2.65 5.75 -0.10 0.25 115.11 124.35 1byr h GLN 142 Ca 0.07 -0.08 -0.05 0.00 -0.15 0.00 0.00 58.65 58.44 1byr h GLN 142 Cb 0.42 -0.25 -0.03 0.00 1.07 0.00 0.00 27.48 28.69 1byr h GLN 142 CO 0.01 0.78 0.24 0.22 -2.65 0.00 0.00 178.83 177.43 1byr h ASP 143 N 1.17 1.00 -0.18 -0.69 3.58 -1.32 -0.28 116.42 119.69 1byr h ASP 143 Ca 0.31 -0.19 -0.20 0.00 0.42 0.00 0.00 57.03 57.37 1byr h ASP 143 Cb -0.10 -0.26 0.01 0.00 1.72 0.00 0.00 39.33 40.70 1byr h ASP 143 CO -0.06 0.92 -0.67 0.03 -2.88 0.00 0.00 179.24 176.58 1byr h ARG 144 N 1.02 0.78 -0.24 0.28 -0.00 -1.35 -3.26 114.38 111.60 1byr h ARG 144 Ca 0.23 -0.59 -0.00 0.00 -0.50 0.00 0.00 59.98 59.11 1byr h ARG 144 Cb 0.26 0.11 -0.01 0.00 0.00 0.00 0.00 29.97 30.33 1byr h ARG 144 CO -0.01 1.21 0.14 2.35 0.00 0.00 0.00 179.97 183.66 1byr h TRP 145 N 0.51 0.33 -0.12 3.04 2.91 -0.82 -2.90 115.95 118.90 1byr h TRP 145 Ca -0.03 -0.00 0.03 0.00 1.13 0.00 0.00 58.89 60.02 1byr h TRP 145 Cb 1.30 -0.11 -0.00 0.00 -0.51 0.00 0.00 29.16 29.84 1byr h TRP 145 CO 0.09 0.26 0.28 -0.91 -1.03 0.00 0.00 178.44 177.13 1byr h ASN 146 N 0.30 0.00 -0.28 2.65 2.35 -1.08 0.31 115.58 119.82 1byr h ASN 146 Ca 0.09 0.00 -0.07 0.00 -0.55 0.00 0.00 56.30 55.77 1byr h ASN 146 Cb 0.04 0.00 -0.04 0.00 0.05 0.00 0.00 38.32 38.36 1byr h ASN 146 CO -0.02 0.00 -0.02 0.00 -1.65 0.00 0.00 177.43 175.74 1byr n GLN 147 N -3.28 2.38 -2.84 0.81 10.64 -1.10 -5.01 117.38 118.99 1byr n GLN 147 Ca 0.00 -2.95 -0.19 0.00 -1.83 0.00 0.00 57.00 52.04 1byr n GLN 147 Cb 0.37 -1.81 0.03 0.00 -0.86 0.00 0.00 30.24 27.96 1byr n GLN 147 CO 0.00 0.00 0.00 0.20 -1.83 0.00 0.00 177.06 175.43 1byr s GLY 148 N -2.23 1.88 -0.15 2.61 0.00 0.09 -4.67 107.32 104.86 1byr s GLY 148 Ca 0.42 -1.55 -0.01 0.00 0.00 0.00 0.00 44.72 43.58 1byr s GLY 148 CO 0.05 -1.30 -0.10 -1.60 0.00 0.00 0.00 173.10 170.15 1byr s ARG 149 N -4.57 3.42 0.36 2.90 3.52 0.11 -4.88 118.95 119.81 1byr s ARG 149 Ca 0.57 -0.65 -0.27 0.00 -0.13 0.00 0.00 55.73 55.24 1byr s ARG 149 Cb -0.10 -2.74 -0.12 0.00 -1.56 0.00 0.00 34.95 30.43 1byr s ARG 149 CO 0.36 0.14 1.27 -0.25 -0.81 0.00 0.00 175.30 176.00 1byr n ASP 150 N 3.77 2.62 -3.96 -2.12 8.00 -1.26 -1.18 116.55 122.42 1byr n ASP 150 Ca -0.18 1.18 -0.31 0.00 0.71 0.00 0.00 54.79 56.19 1byr n ASP 150 Cb 0.52 -1.48 -0.15 0.00 -0.02 0.00 0.00 41.12 39.99 1byr n ASP 150 CO 0.00 0.00 0.00 -0.47 -0.39 0.00 0.00 177.20 176.34 1byr s TYR 151 N -1.12 2.83 0.49 1.24 5.04 0.40 -4.83 117.35 121.40 1byr s TYR 151 Ca 0.57 -2.17 0.03 0.00 -2.44 0.00 0.00 57.07 53.06 1byr s TYR 151 Cb -0.56 -1.98 -0.02 0.00 0.35 0.00 0.00 41.96 39.75 1byr s TYR 151 CO 0.61 -0.85 0.03 1.03 -1.34 0.00 0.00 175.55 175.04 1byr s ARG 152 N 1.24 2.16 0.00 4.97 0.52 -1.26 -4.41 118.95 122.17 1byr s ARG 152 Ca -0.01 -2.32 0.00 0.00 -0.52 0.00 0.00 55.73 52.88 1byr s ARG 152 Cb -0.19 -1.60 0.00 0.00 0.52 0.00 0.00 34.95 33.68 1byr s ARG 152 CO -0.08 -0.32 0.07 0.43 0.02 0.00 0.00 175.30 175.41