#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bhn s ARG 20 N 0.00 3.47 0.15 0.54 0.52 -1.26 -0.98 118.95 121.39 2bhn s ARG 20 Ca 0.00 -0.55 0.07 0.00 -0.52 0.00 0.00 55.73 54.73 2bhn s ARG 20 Cb 0.00 -2.81 -0.04 0.00 0.52 0.00 0.00 34.95 32.62 2bhn s ARG 20 CO 0.00 0.31 -0.05 0.14 0.02 0.00 0.00 175.30 175.72 2bhn s VAL 21 N 0.16 3.55 -0.21 3.52 -7.23 0.38 -4.81 120.40 115.75 2bhn s VAL 21 Ca -0.03 -1.39 -0.08 0.00 -1.81 0.00 0.00 61.98 58.67 2bhn s VAL 21 Cb -0.14 -2.74 -0.04 0.00 0.56 0.00 0.00 36.38 34.02 2bhn s VAL 21 CO 0.03 -0.03 0.09 -0.31 -0.31 0.00 0.00 175.10 174.57 2bhn s TYR 22 N -1.55 3.24 -0.12 2.82 1.51 0.02 -0.81 117.35 122.47 2bhn s TYR 22 Ca 0.25 0.03 0.00 0.00 -1.01 0.00 0.00 57.07 56.34 2bhn s TYR 22 Cb -0.10 -2.16 0.02 0.00 -0.11 0.00 0.00 41.96 39.61 2bhn s TYR 22 CO 0.17 0.04 -0.11 0.08 -1.11 0.00 0.00 175.55 174.61 2bhn s VAL 23 N 0.79 1.24 0.29 0.71 1.01 0.22 -0.74 120.40 123.92 2bhn s VAL 23 Ca 0.05 -0.44 -0.30 0.00 0.00 0.00 0.00 61.98 61.29 2bhn s VAL 23 Cb -0.13 -1.20 -0.13 0.00 0.00 0.00 0.00 36.38 34.92 2bhn s VAL 23 CO 0.02 0.40 1.38 -0.67 0.00 0.00 0.00 175.10 176.23 2bhn n ASP 24 N 4.71 2.88 0.04 3.32 -0.08 -0.72 -1.96 116.55 124.73 2bhn n ASP 24 Ca -0.15 1.17 0.19 0.00 -1.51 0.00 0.00 54.79 54.49 2bhn n ASP 24 Cb 0.50 -1.47 0.70 0.00 2.34 0.00 0.00 41.12 43.20 2bhn n ASP 24 CO 0.00 0.00 0.00 0.58 0.12 0.00 0.00 177.20 177.90 2bhn h VAL 25 N 2.88 0.70 0.23 5.18 2.07 -1.74 0.36 116.25 125.93 2bhn h VAL 25 Ca -0.46 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.05 2bhn h VAL 25 Cb 1.27 0.75 0.00 0.00 -1.52 0.00 0.00 31.29 31.80 2bhn h VAL 25 CO 0.71 0.00 -0.11 0.08 0.02 0.00 0.00 177.57 178.27 2bhn h ARG 26 N 0.00 -0.30 -0.67 1.57 0.11 -1.89 -3.14 114.38 110.06 2bhn h ARG 26 Ca 0.22 0.02 0.20 0.00 0.10 0.00 0.00 59.98 60.51 2bhn h ARG 26 Cb 0.92 0.07 -0.03 0.00 1.11 0.00 0.00 29.97 32.04 2bhn h ARG 26 CO -0.00 -0.20 0.67 1.49 0.10 0.00 0.00 179.97 182.03 2bhn h GLU 27 N -0.41 0.00 -1.66 0.08 4.57 -1.73 0.67 114.58 116.09 2bhn h GLU 27 Ca -0.03 0.00 0.48 0.00 -1.18 0.00 0.00 59.36 58.63 2bhn h GLU 27 Cb 0.24 0.00 -0.07 0.00 -0.16 0.00 0.00 28.75 28.76 2bhn h GLU 27 CO 0.05 0.00 1.28 0.93 -1.18 0.00 0.00 179.01 180.09 2bhn h GLU 28 N 0.00 0.00 -0.27 1.92 3.07 -0.26 0.23 114.58 119.27 2bhn h GLU 28 Ca 0.32 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.18 2bhn h GLU 28 Cb 1.66 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.57 2bhn h GLU 28 CO -0.00 0.00 0.00 2.89 -1.40 0.00 0.00 179.01 180.50 2bhn n ARG 29 N -3.86 1.49 -2.31 2.33 -4.01 0.23 -4.83 116.66 105.70 2bhn n ARG 29 Ca 0.37 -0.68 -0.28 0.00 -1.04 0.00 0.00 57.85 56.22 2bhn n ARG 29 Cb 1.79 -1.21 0.02 0.00 -3.04 0.00 0.00 32.46 30.02 2bhn n ARG 29 CO 0.00 0.00 0.00 -1.12 -3.04 0.00 0.00 177.63 173.47 2bhn s SER 30 N -0.91 5.83 0.45 2.89 0.01 0.80 -4.95 113.70 117.82 2bhn s SER 30 Ca 0.13 0.93 0.31 0.00 1.31 0.00 0.00 55.95 58.62 2bhn s SER 30 Cb 0.07 -1.98 1.43 0.00 0.21 0.00 0.00 66.02 65.75 2bhn s SER 30 CO 0.08 -0.95 1.93 -0.65 0.41 0.00 0.00 173.24 174.05 2bhn h PRO 31 N -0.16 0.00 -0.08 12.44 0.11 -1.91 -3.35 132.00 139.04 2bhn h PRO 31 Ca -0.46 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 65.62 2bhn h PRO 31 Cb 1.23 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.34 2bhn h PRO 31 CO 0.62 0.00 -0.07 0.28 -0.21 0.00 0.00 178.00 178.62 2bhn h VAL 32 N 0.00 1.35 -0.61 3.15 2.07 -1.90 -3.17 116.25 117.14 2bhn h VAL 32 Ca 0.00 -1.18 0.02 0.00 0.82 0.00 0.00 66.70 66.35 2bhn h VAL 32 Cb 0.28 1.96 -0.03 0.00 -1.52 0.00 0.00 31.29 31.98 2bhn h VAL 32 CO 0.00 0.33 0.40 -0.65 0.02 0.00 0.00 177.57 177.68 2bhn h PRO 33 N -0.21 0.76 0.26 1.57 0.11 -1.87 -0.85 132.00 131.77 2bhn h PRO 33 Ca 0.02 -0.05 -0.01 0.00 0.11 0.00 0.00 66.00 66.07 2bhn h PRO 33 Cb 0.56 -0.17 0.00 0.00 0.11 0.00 0.00 31.00 31.50 2bhn h PRO 33 CO 0.02 0.50 -0.12 1.03 -0.21 0.00 0.00 178.00 179.22 2bhn h SER 34 N 0.78 -0.29 -0.79 -2.05 0.87 -1.81 -1.76 113.55 108.50 2bhn h SER 34 Ca 0.23 -0.12 0.17 0.00 -1.23 0.00 0.00 61.79 60.84 2bhn h SER 34 Cb -0.02 0.08 -0.05 0.00 -0.44 0.00 0.00 62.40 61.96 2bhn h SER 34 CO -0.06 -0.05 0.53 0.40 -0.53 0.00 0.00 176.83 177.12 2bhn h ILE 35 N -0.54 0.75 -0.17 2.23 2.04 -1.44 0.14 117.51 120.53 2bhn h ILE 35 Ca -0.04 -0.13 -0.20 0.00 1.00 0.00 0.00 64.86 65.49 2bhn h ILE 35 Cb 0.40 0.34 0.00 0.00 -0.74 0.00 0.00 36.82 36.83 2bhn h ILE 35 CO 0.06 0.07 -0.70 -0.07 0.00 0.00 0.00 178.15 177.51 2bhn h LEU 36 N 0.37 0.82 -0.96 1.44 3.38 -0.78 0.21 115.31 119.79 2bhn h LEU 36 Ca 0.39 -0.51 -0.11 0.00 0.09 0.00 0.00 57.88 57.74 2bhn h LEU 36 Cb 0.97 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 41.47 2bhn h LEU 36 CO -0.12 1.29 -0.50 -0.33 0.09 0.00 0.00 178.44 178.86 2bhn h GLU 37 N 0.50 0.04 0.48 1.13 5.08 -0.94 0.34 114.58 121.21 2bhn h GLU 37 Ca -0.03 -0.02 -0.02 0.00 -1.00 0.00 0.00 59.36 58.29 2bhn h GLU 37 Cb 1.31 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.54 2bhn h GLU 37 CO 0.14 0.54 -0.39 1.03 -1.00 0.00 0.00 179.01 179.33 2bhn h SER 38 N 0.04 -1.03 0.00 1.42 0.87 -0.22 -0.14 113.55 114.48 2bhn h SER 38 Ca -0.00 0.07 0.00 0.00 -1.23 0.00 0.00 61.79 60.63 2bhn h SER 38 Cb 0.90 0.33 0.00 0.00 -0.44 0.00 0.00 62.40 63.19 2bhn h SER 38 CO 0.07 -0.54 0.03 0.18 -0.53 0.00 0.00 176.83 176.03 2bhn n LEU 39 N -4.79 0.03 -0.09 2.23 4.77 0.69 -4.77 117.00 115.07 2bhn n LEU 39 Ca -0.10 0.48 0.00 0.00 -0.03 0.00 0.00 56.01 56.36 2bhn n LEU 39 Cb 0.37 -0.49 0.00 0.00 -2.33 0.00 0.00 43.42 40.97 2bhn n LEU 39 CO 0.23 -0.49 0.00 0.61 -1.33 0.00 0.00 177.39 176.41 2bhn n GLY 40 N -1.46 1.12 3.47 -0.72 0.00 -0.07 -5.07 105.19 102.46 2bhn n GLY 40 Ca -0.00 -0.17 -0.33 0.00 0.00 0.00 0.00 46.02 45.51 2bhn n GLY 40 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2bhn s VAL 41 N -2.19 3.52 0.11 1.61 1.01 0.11 -4.72 120.40 119.85 2bhn s VAL 41 Ca 0.00 -0.51 -0.31 0.00 0.00 0.00 0.00 61.98 61.16 2bhn s VAL 41 Cb 0.00 -2.49 -0.08 0.00 0.00 0.00 0.00 36.38 33.81 2bhn s VAL 41 CO 0.00 0.53 1.48 -1.58 0.00 0.00 0.00 175.10 175.54 2bhn s GLN 42 N 0.03 4.27 -0.35 2.72 0.74 -0.15 -3.12 119.66 123.79 2bhn s GLN 42 Ca -0.02 2.18 0.04 0.00 0.05 0.00 0.00 55.36 57.61 2bhn s GLN 42 Cb -0.14 -3.31 0.10 0.00 1.10 0.00 0.00 33.01 30.76 2bhn s GLN 42 CO 0.03 -0.55 0.07 0.08 -0.55 0.00 0.00 175.29 174.37 2bhn s VAL 43 N 1.51 2.29 -0.08 1.34 1.01 -1.26 -0.47 120.40 124.74 2bhn s VAL 43 Ca 0.67 -2.42 -0.16 0.00 0.00 0.00 0.00 61.98 60.08 2bhn s VAL 43 Cb -0.39 -2.69 -0.05 0.00 0.00 0.00 0.00 36.38 33.25 2bhn s VAL 43 CO 0.30 -0.62 0.41 -0.63 0.00 0.00 0.00 175.10 174.57 2bhn s ILE 44 N 0.81 5.15 -0.02 2.22 1.01 0.01 -4.95 121.20 125.43 2bhn s ILE 44 Ca 0.11 0.83 -0.15 0.00 0.00 0.00 0.00 60.65 61.44 2bhn s ILE 44 Cb -0.20 -3.74 -0.05 0.00 0.01 0.00 0.00 42.46 38.48 2bhn s ILE 44 CO -0.07 0.43 0.41 -2.16 0.00 0.00 0.00 174.94 173.55 2bhn s PRO 45 N -0.04 4.00 0.38 2.79 0.04 -1.26 0.72 135.00 141.63 2bhn s PRO 45 Ca 0.23 0.41 0.05 0.00 0.04 0.00 0.00 61.00 61.72 2bhn s PRO 45 Cb -0.15 -3.26 -0.06 0.00 0.04 0.00 0.00 34.50 31.06 2bhn s PRO 45 CO 0.10 0.59 0.04 0.15 0.04 0.00 0.00 177.00 177.92 2bhn s LYS 46 N -0.75 1.82 -1.24 4.56 1.02 -0.83 -4.86 119.74 119.46 2bhn s LYS 46 Ca 0.24 -2.04 -0.12 0.00 0.02 0.00 0.00 55.97 54.07 2bhn s LYS 46 Cb -0.16 -1.16 0.17 0.00 -0.52 0.00 0.00 37.83 36.16 2bhn s LYS 46 CO 0.13 -0.18 1.63 1.04 -0.92 0.00 0.00 175.35 177.05 2bhn n GLN 47 N -0.85 3.50 -1.65 1.68 3.00 -1.26 -1.83 117.38 119.96 2bhn n GLN 47 Ca -0.05 -3.72 -0.47 0.00 -0.01 0.00 0.00 57.00 52.76 2bhn n GLN 47 Cb 0.67 -2.98 -0.04 0.00 0.00 0.00 0.00 30.24 27.88 2bhn n GLN 47 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.06 178.34 2bhn n LEU 48 N 4.79 2.73 0.08 1.08 4.77 -1.26 -4.94 117.00 124.25 2bhn n LEU 48 Ca 0.38 1.11 -0.16 0.00 -0.03 0.00 0.00 56.01 57.31 2bhn n LEU 48 Cb 0.40 -1.37 -0.10 0.00 -2.33 0.00 0.00 43.42 40.02 2bhn n LEU 48 CO 0.71 -0.54 0.51 1.55 -1.33 0.00 0.00 177.39 178.29 2bhn h PRO 49 N 5.06 -0.66 -5.10 3.23 0.13 -2.03 -3.46 132.00 129.17 2bhn h PRO 49 Ca -0.45 0.05 -0.41 0.00 -0.87 0.00 0.00 66.00 64.31 2bhn h PRO 49 Cb 1.28 0.15 -0.14 0.00 0.13 0.00 0.00 31.00 32.42 2bhn h PRO 49 CO 0.82 -0.44 -0.62 -1.64 -0.23 0.00 0.00 178.00 175.88 2bhn s MET 50 N -5.65 1.49 1.99 0.86 -1.94 -1.26 -5.12 119.30 109.67 2bhn s MET 50 Ca -0.16 -1.80 0.00 0.00 -1.71 0.00 0.00 55.69 52.02 2bhn s MET 50 Cb 0.06 -0.63 0.00 0.00 2.01 0.00 0.00 34.83 36.27 2bhn s MET 50 CO 0.59 -0.19 0.00 0.41 -0.01 0.00 0.00 175.02 175.82 2bhn n GLY 51 N -0.55 0.67 0.02 -0.03 0.00 -1.26 -4.75 105.19 99.29 2bhn n GLY 51 Ca -0.02 -0.83 -0.02 0.00 0.00 0.00 0.00 46.02 45.15 2bhn n GLY 51 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2bhn n ASP 52 N -3.32 4.11 -3.72 1.61 8.00 0.84 -4.78 116.55 119.30 2bhn n ASP 52 Ca 0.00 -0.00 -0.23 0.00 0.71 0.00 0.00 54.79 55.27 2bhn n ASP 52 Cb 0.00 0.51 -0.18 0.00 -0.02 0.00 0.00 41.12 41.44 2bhn n ASP 52 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 2bhn s TYR 53 N -2.08 0.45 -0.18 1.24 1.51 0.15 -1.75 117.35 116.68 2bhn s TYR 53 Ca -0.02 -0.11 -0.15 0.00 -1.01 0.00 0.00 57.07 55.78 2bhn s TYR 53 Cb 0.01 -0.71 -0.04 0.00 -0.11 0.00 0.00 41.96 41.11 2bhn s TYR 53 CO 0.14 -0.33 0.34 -1.17 -1.11 0.00 0.00 175.55 173.41 2bhn s LEU 54 N 2.05 4.20 -0.18 -1.29 2.96 0.08 -0.42 118.68 126.08 2bhn s LEU 54 Ca 0.04 0.50 -0.07 0.00 -0.22 0.00 0.00 54.13 54.37 2bhn s LEU 54 Cb -0.13 -2.43 -0.08 0.00 0.50 0.00 0.00 46.19 44.04 2bhn s LEU 54 CO -0.05 0.01 -0.22 0.52 -1.32 0.00 0.00 176.35 175.29 2bhn n VAL 55 N 3.98 0.98 -4.40 1.68 0.31 -0.79 -0.80 118.33 119.30 2bhn n VAL 55 Ca -0.10 -0.27 -0.21 0.00 -0.01 0.00 0.00 64.34 63.75 2bhn n VAL 55 Cb 0.51 -1.64 -0.06 0.00 -0.91 0.00 0.00 33.84 31.74 2bhn n VAL 55 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 2bhn n SER 56 N -3.68 0.81 -0.08 4.52 3.41 -1.22 -4.87 113.62 112.52 2bhn n SER 56 Ca -0.35 -2.90 -0.09 0.00 -0.26 0.00 0.00 58.87 55.28 2bhn n SER 56 Cb 0.76 1.02 -0.02 0.00 -0.26 0.00 0.00 64.21 65.71 2bhn n SER 56 CO 0.00 0.00 0.00 -2.24 -0.16 0.00 0.00 175.04 172.64 2bhn h ASP 57 N 1.50 -1.05 -0.21 4.04 -0.00 -2.02 -3.18 116.42 115.49 2bhn h ASP 57 Ca -0.26 0.18 -0.04 0.00 -0.00 0.00 0.00 57.03 56.90 2bhn h ASP 57 Cb 1.06 0.48 -0.01 0.00 -0.00 0.00 0.00 39.33 40.86 2bhn h ASP 57 CO 0.41 -0.33 -0.02 0.77 -0.00 0.00 0.00 179.24 180.07 2bhn h SER 58 N -0.30 0.38 -3.46 4.15 4.64 -1.96 -3.44 113.55 113.56 2bhn h SER 58 Ca 0.15 -0.34 -0.60 0.00 -0.47 0.00 0.00 61.79 60.53 2bhn h SER 58 Cb 0.54 -0.10 -0.11 0.00 -0.31 0.00 0.00 62.40 62.42 2bhn h SER 58 CO -0.48 0.62 0.11 -0.63 -0.87 0.00 0.00 176.83 175.59 2bhn s ILE 59 N -4.87 5.01 0.23 0.95 1.01 -1.20 -2.67 121.20 119.67 2bhn s ILE 59 Ca -0.14 1.11 0.11 0.00 0.00 0.00 0.00 60.65 61.74 2bhn s ILE 59 Cb 0.07 -3.92 -0.05 0.00 0.01 0.00 0.00 42.46 38.57 2bhn s ILE 59 CO 0.74 0.07 -0.21 -0.51 0.00 0.00 0.00 174.94 175.03 2bhn s ILE 60 N 2.21 2.35 -0.05 2.92 1.10 -0.68 -1.89 121.20 127.16 2bhn s ILE 60 Ca 0.26 -2.21 -0.02 0.00 -0.51 0.00 0.00 60.65 58.17 2bhn s ILE 60 Cb -0.16 -2.18 0.04 0.00 0.15 0.00 0.00 42.46 40.31 2bhn s ILE 60 CO 0.09 -0.29 0.10 -0.69 -2.11 0.00 0.00 174.94 172.05 2bhn s VAL 61 N -2.15 -0.10 -0.17 4.00 1.01 0.44 -1.96 120.40 121.47 2bhn s VAL 61 Ca 0.25 0.25 -0.05 0.00 0.00 0.00 0.00 61.98 62.43 2bhn s VAL 61 Cb -0.06 -0.19 -0.03 0.00 0.00 0.00 0.00 36.38 36.09 2bhn s VAL 61 CO 0.12 0.10 0.00 -0.70 0.00 0.00 0.00 175.10 174.63 2bhn s GLU 62 N 1.47 3.78 -0.05 2.72 2.56 -0.98 0.29 118.70 128.49 2bhn s GLU 62 Ca -0.05 -0.45 -0.17 0.00 0.00 0.00 0.00 54.97 54.29 2bhn s GLU 62 Cb -0.12 -3.04 -0.05 0.00 2.00 0.00 0.00 34.13 32.91 2bhn s GLU 62 CO -0.05 0.23 0.47 -0.98 -0.56 0.00 0.00 175.26 174.37 2bhn s ARG 63 N 0.43 4.19 -0.10 4.30 1.70 -1.26 -2.32 118.95 125.89 2bhn s ARG 63 Ca -0.01 0.48 -0.01 0.00 -0.47 0.00 0.00 55.73 55.73 2bhn s ARG 63 Cb -0.14 -3.34 0.03 0.00 -0.57 0.00 0.00 34.95 30.93 2bhn s ARG 63 CO 0.02 0.40 -0.05 0.15 -1.08 0.00 0.00 175.30 174.74 2bhn s LYS 64 N -0.18 1.23 0.43 3.89 1.02 -0.73 -4.97 119.74 120.43 2bhn s LYS 64 Ca 0.26 -0.14 -0.24 0.00 0.02 0.00 0.00 55.97 55.87 2bhn s LYS 64 Cb -0.16 -1.39 -0.08 0.00 -0.52 0.00 0.00 37.83 35.68 2bhn s LYS 64 CO 0.13 -0.28 1.18 0.95 -0.92 0.00 0.00 175.35 176.41 2bhn s THR 65 N 1.78 3.06 0.31 2.17 -4.23 -1.26 -1.81 115.64 115.66 2bhn s THR 65 Ca 0.05 0.85 0.07 0.00 -1.18 0.00 0.00 61.69 61.48 2bhn s THR 65 Cb -0.12 -3.46 0.30 0.00 1.34 0.00 0.00 72.50 70.56 2bhn s THR 65 CO -0.07 0.04 1.70 0.28 -0.54 0.00 0.00 174.62 176.03 2bhn h SER 66 N 2.35 0.45 -0.35 3.99 0.02 -1.63 0.26 113.55 118.64 2bhn h SER 66 Ca -0.49 0.16 -0.13 0.00 -0.84 0.00 0.00 61.79 60.49 2bhn h SER 66 Cb 1.24 0.11 -0.01 0.00 0.14 0.00 0.00 62.40 63.89 2bhn h SER 66 CO 0.61 0.00 -0.29 0.77 -1.14 0.00 0.00 176.83 176.79 2bhn h SER 67 N 0.44 0.86 0.36 3.07 4.64 -1.90 0.12 113.55 121.13 2bhn h SER 67 Ca 0.61 -0.45 -0.06 0.00 -0.47 0.00 0.00 61.79 61.42 2bhn h SER 67 Cb 1.21 -0.24 -0.01 0.00 -0.31 0.00 0.00 62.40 63.05 2bhn h SER 67 CO -0.53 1.13 -0.28 0.44 -0.87 0.00 0.00 176.83 176.72 2bhn h ASP 68 N 0.60 0.00 0.55 4.97 3.32 -0.98 1.16 116.42 126.04 2bhn h ASP 68 Ca 0.06 0.00 -0.16 0.00 0.02 0.00 0.00 57.03 56.96 2bhn h ASP 68 Cb 0.86 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.40 2bhn h ASP 68 CO 0.07 0.28 -0.70 0.15 -1.72 0.00 0.00 179.24 177.33 2bhn h PHE 69 N 0.00 0.17 0.00 4.55 3.57 -0.67 -1.44 116.94 123.12 2bhn h PHE 69 Ca -0.00 -0.08 -0.12 0.00 3.53 0.00 0.00 57.97 61.30 2bhn h PHE 69 Cb 0.54 -0.03 -0.02 0.00 2.79 0.00 0.00 35.95 39.23 2bhn h PHE 69 CO 0.00 0.78 -0.58 0.00 -2.23 0.00 0.00 178.31 176.28 2bhn h ALA 70 N 1.20 0.77 0.00 2.41 0.00 0.72 -2.28 119.26 122.07 2bhn h ALA 70 Ca -0.01 -0.53 -0.07 0.00 0.00 0.00 0.00 54.91 54.30 2bhn h ALA 70 Cb 1.24 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.92 2bhn h ALA 70 CO 0.10 0.73 -0.71 1.57 0.00 0.00 0.00 179.25 180.94 2bhn h LYS 71 N 0.00 0.00 0.00 0.00 5.09 0.14 -3.20 116.57 118.60 2bhn h LYS 71 Ca -0.01 0.00 -0.35 0.00 0.09 0.00 0.00 60.65 60.39 2bhn h LYS 71 Cb 1.25 0.00 -0.06 0.00 0.10 0.00 0.00 32.23 33.51 2bhn h LYS 71 CO 0.08 0.21 -2.17 -1.13 -2.09 0.00 0.00 179.45 174.34 2bhn n SER 72 N -2.98 0.39 -0.06 7.07 3.41 -0.55 -3.08 113.62 117.82 2bhn n SER 72 Ca -0.01 0.13 -0.08 0.00 -0.26 0.00 0.00 58.87 58.66 2bhn n SER 72 Cb 0.66 0.58 -0.01 0.00 -0.26 0.00 0.00 64.21 65.18 2bhn n SER 72 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 2bhn h LEU 73 N 0.00 -0.11 0.00 1.04 3.38 -1.55 0.20 115.31 118.27 2bhn h LEU 73 Ca -0.47 0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.56 2bhn h LEU 73 Cb 2.16 0.10 0.00 0.00 0.09 0.00 0.00 40.66 43.01 2bhn h LEU 73 CO 0.04 -0.02 0.00 0.49 0.09 0.00 0.00 178.44 179.04 2bhn n PHE 74 N -5.15 0.00 -1.31 1.13 0.99 -1.21 -3.11 117.46 108.80 2bhn n PHE 74 Ca -0.01 0.00 0.05 0.00 -0.00 0.00 0.00 57.45 57.49 2bhn n PHE 74 Cb 0.13 -0.39 0.19 0.00 -1.00 0.00 0.00 39.48 38.42 2bhn n PHE 74 CO 0.00 0.00 0.00 -0.25 -0.00 0.00 0.00 176.76 176.51 2bhn n ASP 75 N -1.39 2.42 0.00 4.37 8.00 -0.66 -5.00 116.55 124.29 2bhn n ASP 75 Ca 0.10 -3.48 0.00 0.00 0.71 0.00 0.00 54.79 52.11 2bhn n ASP 75 Cb 0.26 -0.53 0.00 0.00 -0.02 0.00 0.00 41.12 40.83 2bhn n ASP 75 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2bhn n GLY 76 N -1.13 0.00 0.00 0.44 0.00 -0.03 -4.31 105.19 100.16 2bhn n GLY 76 Ca 0.22 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.24 2bhn n GLY 76 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 2bhn n ARG 77 N 0.00 0.00 0.00 1.61 0.00 -1.22 -1.19 116.66 115.86 2bhn n ARG 77 Ca 0.00 0.04 0.00 0.00 -0.00 0.00 0.00 57.85 57.89 2bhn n ARG 77 Cb 0.00 -1.93 0.00 0.00 -0.00 0.00 0.00 32.46 30.53 2bhn n ARG 77 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.63 177.52 2bhn n LEU 78 N -1.01 2.07 -0.33 2.89 7.94 -0.88 -3.44 117.00 124.24 2bhn n LEU 78 Ca 0.00 0.16 0.24 0.00 -1.11 0.00 0.00 56.01 55.31 2bhn n LEU 78 Cb 0.43 -0.04 0.53 0.00 0.53 0.00 0.00 43.42 44.87 2bhn n LEU 78 CO 0.00 -0.04 1.22 -0.26 -1.11 0.00 0.00 177.39 177.21 2bhn h PHE 79 N 0.00 0.62 0.88 1.96 -1.00 -1.43 0.35 116.94 118.32 2bhn h PHE 79 Ca 0.00 0.02 -0.04 0.00 2.81 0.00 0.00 57.97 60.76 2bhn h PHE 79 Cb 0.00 -0.18 0.00 0.00 3.61 0.00 0.00 35.95 39.38 2bhn h PHE 79 CO 0.00 0.04 -0.50 0.93 -1.61 0.00 0.00 178.31 177.18 2bhn h GLU 80 N 0.35 -1.22 -0.71 1.51 5.08 -1.73 -0.04 114.58 117.82 2bhn h GLU 80 Ca 0.61 0.08 0.15 0.00 -1.00 0.00 0.00 59.36 59.20 2bhn h GLU 80 Cb 1.61 0.28 -0.11 0.00 0.50 0.00 0.00 28.75 31.03 2bhn h GLU 80 CO -0.30 -0.82 0.16 0.37 -1.00 0.00 0.00 179.01 177.43 2bhn h GLN 81 N -1.27 0.25 -0.15 2.33 4.15 -1.17 -2.45 115.11 116.80 2bhn h GLN 81 Ca -0.12 -0.02 0.04 0.00 0.77 0.00 0.00 58.65 59.33 2bhn h GLN 81 Cb 1.00 -0.06 -0.05 0.00 0.21 0.00 0.00 27.48 28.59 2bhn h GLN 81 CO 0.15 0.17 -0.15 0.00 -1.93 0.00 0.00 178.83 177.06 2bhn h ALA 82 N 1.59 -0.05 0.05 3.38 0.00 -0.67 0.19 119.26 123.74 2bhn h ALA 82 Ca 0.40 0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.37 2bhn h ALA 82 Cb 0.66 0.32 -0.01 0.00 0.00 0.00 0.00 17.79 18.76 2bhn h ALA 82 CO -0.50 -0.60 -0.14 0.77 0.00 0.00 0.00 179.25 178.78 2bhn h SER 83 N -0.18 -0.42 -0.90 0.00 0.02 -0.84 -1.43 113.55 109.81 2bhn h SER 83 Ca 0.10 0.04 0.10 0.00 -0.84 0.00 0.00 61.79 61.19 2bhn h SER 83 Cb 0.33 0.15 -0.12 0.00 0.14 0.00 0.00 62.40 62.90 2bhn h SER 83 CO -0.26 -0.15 -0.48 0.54 -1.14 0.00 0.00 176.83 175.34 2bhn n ARG 84 N -3.24 -0.34 -0.04 3.45 3.00 -0.94 0.18 116.66 118.74 2bhn n ARG 84 Ca -0.02 1.36 0.03 0.00 -0.01 0.00 0.00 57.85 59.20 2bhn n ARG 84 Cb 0.11 -2.01 0.37 0.00 0.00 0.00 0.00 32.46 30.94 2bhn n ARG 84 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.63 177.56 2bhn h LEU 85 N 0.00 0.54 0.00 0.55 3.38 -0.61 -2.67 115.31 116.50 2bhn h LEU 85 Ca 0.19 -0.03 -0.15 0.00 0.09 0.00 0.00 57.88 57.98 2bhn h LEU 85 Cb 0.42 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 41.00 2bhn h LEU 85 CO -0.86 0.43 -1.25 0.00 0.09 0.00 0.00 178.44 176.85 2bhn h ALA 86 N 1.67 0.65 0.26 1.53 0.00 0.50 -3.11 119.26 120.75 2bhn h ALA 86 Ca 0.17 -0.75 -0.01 0.00 0.00 0.00 0.00 54.91 54.31 2bhn h ALA 86 Cb -0.01 0.21 0.00 0.00 0.00 0.00 0.00 17.79 17.99 2bhn h ALA 86 CO -0.03 0.83 -0.12 1.05 0.00 0.00 0.00 179.25 180.98 2bhn h GLU 87 N 0.00 -0.33 -0.13 0.00 9.09 0.22 -3.33 114.58 120.09 2bhn h GLU 87 Ca -0.13 0.02 -0.02 0.00 0.05 0.00 0.00 59.36 59.28 2bhn h GLU 87 Cb 1.53 0.08 -0.00 0.00 -1.65 0.00 0.00 28.75 28.70 2bhn h GLU 87 CO 0.05 -0.07 -0.00 0.45 0.05 0.00 0.00 179.01 179.48 2bhn h HIS 88 N -0.57 0.25 -1.39 2.06 -0.00 -1.62 -3.46 115.15 110.42 2bhn h HIS 88 Ca -0.04 -0.04 -0.46 0.00 -0.00 0.00 0.00 60.37 59.83 2bhn h HIS 88 Cb 0.42 -0.07 0.03 0.00 -0.00 0.00 0.00 27.41 27.80 2bhn h HIS 88 CO 0.00 0.47 -0.12 0.71 -0.00 0.00 0.00 177.93 178.99 2bhn s TYR 89 N -4.96 2.09 -0.07 2.45 1.51 -1.17 -5.09 117.35 112.10 2bhn s TYR 89 Ca -0.14 -0.47 -0.08 0.00 -1.01 0.00 0.00 57.07 55.37 2bhn s TYR 89 Cb 0.05 -2.43 -0.03 0.00 -0.11 0.00 0.00 41.96 39.44 2bhn s TYR 89 CO 0.71 -0.94 -0.16 -0.85 -1.11 0.00 0.00 175.55 173.20 2bhn n GLU 90 N -2.20 0.24 -2.78 -0.62 0.28 -1.19 -4.73 120.64 109.64 2bhn n GLU 90 Ca 0.12 0.09 -0.43 0.00 -0.16 0.00 0.00 57.16 56.79 2bhn n GLU 90 Cb 0.60 -0.87 -0.04 0.00 1.43 0.00 0.00 31.44 32.56 2bhn n GLU 90 CO 0.00 0.00 0.00 0.99 -0.16 0.00 0.00 177.13 177.96 2bhn s THR 91 N -1.98 4.30 -0.20 3.84 2.01 -1.09 -4.91 115.64 117.61 2bhn s THR 91 Ca -0.13 0.36 -0.00 0.00 0.31 0.00 0.00 61.69 62.23 2bhn s THR 91 Cb 0.02 -4.59 0.02 0.00 0.01 0.00 0.00 72.50 67.95 2bhn s THR 91 CO 0.19 -1.20 -0.14 -0.69 -0.69 0.00 0.00 174.62 172.09 2bhn s VAL 92 N 4.19 2.47 -0.16 3.82 1.01 -1.26 -1.68 120.40 128.78 2bhn s VAL 92 Ca 0.32 -0.87 -0.09 0.00 0.00 0.00 0.00 61.98 61.34 2bhn s VAL 92 Cb -0.12 -2.10 -0.05 0.00 0.00 0.00 0.00 36.38 34.11 2bhn s VAL 92 CO 0.20 0.45 0.15 -0.36 0.00 0.00 0.00 175.10 175.54 2bhn s PHE 93 N 1.33 3.51 -0.42 5.22 0.40 -0.83 -0.46 117.98 126.73 2bhn s PHE 93 Ca 0.04 0.45 -0.07 0.00 -0.60 0.00 0.00 56.93 56.75 2bhn s PHE 93 Cb -0.14 -2.07 0.10 0.00 0.51 0.00 0.00 43.02 41.42 2bhn s PHE 93 CO -0.09 0.51 0.24 0.42 0.70 0.00 0.00 175.22 177.00 2bhn s ILE 94 N -0.32 3.82 -0.14 0.64 1.09 -0.12 -2.32 121.20 123.85 2bhn s ILE 94 Ca 0.12 -1.71 -0.27 0.00 -1.10 0.00 0.00 60.65 57.69 2bhn s ILE 94 Cb -0.12 -3.46 -0.01 0.00 -1.06 0.00 0.00 42.46 37.81 2bhn s ILE 94 CO 0.01 -0.60 0.92 -0.63 -0.10 0.00 0.00 174.94 174.54 2bhn s ILE 95 N 1.30 4.83 -0.16 2.92 1.01 -0.98 -2.07 121.20 128.05 2bhn s ILE 95 Ca 0.05 1.84 -0.05 0.00 0.00 0.00 0.00 60.65 62.49 2bhn s ILE 95 Cb -0.23 -4.23 -0.04 0.00 0.01 0.00 0.00 42.46 37.97 2bhn s ILE 95 CO -0.01 0.01 0.02 -0.69 0.00 0.00 0.00 174.94 174.27 2bhn s VAL 96 N 2.13 4.42 -0.20 2.92 1.01 -0.60 -1.78 120.40 128.30 2bhn s VAL 96 Ca 0.43 -0.17 -0.14 0.00 0.00 0.00 0.00 61.98 62.10 2bhn s VAL 96 Cb -0.17 -2.96 -0.04 0.00 0.00 0.00 0.00 36.38 33.21 2bhn s VAL 96 CO 0.14 0.49 0.31 -0.70 0.00 0.00 0.00 175.10 175.35 2bhn s GLU 97 N 0.20 4.16 0.72 2.72 2.12 -0.75 0.89 118.70 128.76 2bhn s GLU 97 Ca 0.02 0.04 0.00 0.00 0.36 0.00 0.00 54.97 55.39 2bhn s GLU 97 Cb -0.13 -3.51 0.00 0.00 0.26 0.00 0.00 34.13 30.75 2bhn s GLU 97 CO 0.01 0.05 0.00 0.41 -0.54 0.00 0.00 175.26 175.19 2bhn n GLY 98 N 3.91 -0.04 3.74 -1.50 0.00 0.70 -1.63 105.19 110.37 2bhn n GLY 98 Ca -0.11 -1.64 -0.40 0.00 0.00 0.00 0.00 46.02 43.87 2bhn n GLY 98 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2bhn s PRO 99 N 0.00 4.52 0.27 1.61 0.05 -1.26 -3.51 135.00 136.68 2bhn s PRO 99 Ca 0.00 1.12 -0.06 0.00 0.05 0.00 0.00 61.00 62.11 2bhn s PRO 99 Cb 0.00 -3.36 0.49 0.00 0.05 0.00 0.00 34.50 31.68 2bhn s PRO 99 CO 0.00 0.28 1.59 -1.35 0.05 0.00 0.00 177.00 177.56 2bhn h PRO 100 N 5.64 0.02 -4.36 0.56 0.11 -1.91 -3.33 132.00 128.74 2bhn h PRO 100 Ca -0.44 -0.00 -0.61 0.00 0.11 0.00 0.00 66.00 65.06 2bhn h PRO 100 Cb 1.21 -0.00 -0.38 0.00 0.11 0.00 0.00 31.00 31.93 2bhn h PRO 100 CO 0.71 0.01 -0.78 0.14 -0.21 0.00 0.00 178.00 177.87 2bhn s VAL 101 N -6.17 1.56 1.01 3.15 -7.23 -1.26 -4.90 120.40 106.57 2bhn s VAL 101 Ca -0.14 -1.28 -0.12 0.00 -1.81 0.00 0.00 61.98 58.63 2bhn s VAL 101 Cb 0.25 -1.84 0.18 0.00 0.56 0.00 0.00 36.38 35.53 2bhn s VAL 101 CO 0.77 -0.13 0.96 -2.65 -0.31 0.00 0.00 175.10 173.73 2bhn n PRO 102 N 4.65 -1.13 0.10 4.82 -0.02 -1.25 -4.89 135.00 137.29 2bhn n PRO 102 Ca -0.11 -0.28 0.13 0.00 -2.02 0.00 0.00 63.50 61.22 2bhn n PRO 102 Cb 0.44 -2.22 0.37 0.00 -0.02 0.00 0.00 33.50 32.07 2bhn n PRO 102 CO 0.00 0.00 0.00 2.89 1.98 0.00 0.00 175.50 180.37 2bhn n ARG 103 N -4.07 0.28 0.26 -0.52 0.00 -1.26 -1.71 116.66 109.64 2bhn n ARG 103 Ca 0.08 0.21 0.16 0.00 -0.00 0.00 0.00 57.85 58.30 2bhn n ARG 103 Cb 0.53 -1.80 0.62 0.00 -0.00 0.00 0.00 32.46 31.81 2bhn n ARG 103 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.63 177.54 2bhn h ARG 104 N 0.00 0.00 0.00 2.89 2.43 -2.05 -2.68 114.38 114.97 2bhn h ARG 104 Ca 0.00 0.00 -0.05 0.00 -0.81 0.00 0.00 59.98 59.12 2bhn h ARG 104 Cb 0.75 0.00 -0.12 0.00 -0.42 0.00 0.00 29.97 30.18 2bhn h ARG 104 CO 0.00 0.00 -0.57 0.66 -1.51 0.00 0.00 179.97 178.55 2bhn n TYR 105 N -3.02 0.00 -0.69 2.20 4.02 -1.17 -4.94 117.16 113.56 2bhn n TYR 105 Ca 0.01 -0.88 -0.10 0.00 -0.01 0.00 0.00 57.90 56.93 2bhn n TYR 105 Cb 0.32 -0.17 -0.11 0.00 -0.02 0.00 0.00 39.34 39.37 2bhn n TYR 105 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 176.86 176.39 2bhn n ARG 106 N -0.52 1.46 0.00 -0.72 1.74 -0.69 -1.94 116.66 115.99 2bhn n ARG 106 Ca 0.12 -0.77 0.00 0.00 -0.77 0.00 0.00 57.85 56.43 2bhn n ARG 106 Cb 0.82 -1.90 0.00 0.00 -1.02 0.00 0.00 32.46 30.36 2bhn n ARG 106 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2bhn n GLY 107 N 2.77 0.04 0.68 -0.13 0.00 -1.26 -4.92 105.19 102.36 2bhn n GLY 107 Ca 0.31 -0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.31 2bhn n GLY 107 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2bhn n ARG 108 N -0.40 0.80 0.04 1.61 5.12 -0.82 -3.98 116.66 119.02 2bhn n ARG 108 Ca 0.00 0.00 0.12 0.00 -1.93 0.00 0.00 57.85 56.04 2bhn n ARG 108 Cb 0.00 -1.29 0.31 0.00 -1.16 0.00 0.00 32.46 30.31 2bhn n ARG 108 CO 0.00 0.00 0.00 -0.85 -1.93 0.00 0.00 177.63 174.85 2bhn n GLU 109 N 0.28 0.16 -0.10 5.56 0.00 -1.25 -3.65 120.64 121.63 2bhn n GLU 109 Ca 0.00 0.07 -0.08 0.00 0.00 0.00 0.00 57.16 57.15 2bhn n GLU 109 Cb 0.27 -1.62 -0.02 0.00 0.00 0.00 0.00 31.44 30.06 2bhn n GLU 109 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 2bhn h ARG 110 N 0.00 -0.27 -0.00 3.44 3.08 -1.95 -1.55 114.38 117.13 2bhn h ARG 110 Ca 0.00 0.02 -0.17 0.00 0.07 0.00 0.00 59.98 59.90 2bhn h ARG 110 Cb 0.63 0.06 -0.02 0.00 0.08 0.00 0.00 29.97 30.73 2bhn h ARG 110 CO 0.00 -0.18 -0.78 0.66 -1.07 0.00 0.00 179.97 178.60 2bhn h SER 111 N -0.28 0.03 0.00 7.04 4.64 -1.92 -3.24 113.55 119.81 2bhn h SER 111 Ca 0.16 -0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.45 2bhn h SER 111 Cb 0.55 -0.01 0.00 0.00 -0.31 0.00 0.00 62.40 62.63 2bhn h SER 111 CO -0.51 0.79 0.00 0.18 -0.87 0.00 0.00 176.83 176.42 2bhn n LEU 112 N -3.63 0.00 0.31 5.97 7.99 -0.61 0.14 117.00 127.17 2bhn n LEU 112 Ca -0.01 0.96 0.20 0.00 -0.01 0.00 0.00 56.01 57.15 2bhn n LEU 112 Cb 0.75 -0.46 0.93 0.00 -0.11 0.00 0.00 43.42 44.54 2bhn n LEU 112 CO 0.44 -0.46 1.08 1.88 -1.51 0.00 0.00 177.39 178.83 2bhn h TYR 113 N 0.00 0.00 -0.31 -1.77 0.05 -1.67 -1.05 116.97 112.22 2bhn h TYR 113 Ca 0.00 0.00 -0.14 0.00 0.05 0.00 0.00 58.73 58.64 2bhn h TYR 113 Cb 0.00 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 37.73 2bhn h TYR 113 CO -0.35 0.00 -0.39 0.00 -1.05 0.00 0.00 178.16 176.38 2bhn h ALA 114 N 2.00 0.73 -0.36 3.88 0.00 -1.37 -2.84 119.26 121.29 2bhn h ALA 114 Ca -0.00 -0.44 -0.03 0.00 0.00 0.00 0.00 54.91 54.43 2bhn h ALA 114 Cb 0.28 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 2bhn h ALA 114 CO 0.00 0.66 0.10 0.00 0.00 0.00 0.00 179.25 180.01 2bhn h ALA 115 N 0.96 0.48 0.50 0.00 0.00 0.26 -1.86 119.26 119.60 2bhn h ALA 115 Ca 0.05 -0.17 -0.01 0.00 0.00 0.00 0.00 54.91 54.78 2bhn h ALA 115 Cb 0.93 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.56 2bhn h ALA 115 CO 0.08 0.13 -0.45 0.52 0.00 0.00 0.00 179.25 179.54 2bhn h MET 116 N 0.44 -0.91 -0.86 0.00 2.86 -1.48 0.52 114.93 115.51 2bhn h MET 116 Ca 0.12 0.06 0.21 0.00 -2.06 0.00 0.00 59.70 58.03 2bhn h MET 116 Cb 0.28 0.21 -0.16 0.00 0.06 0.00 0.00 31.60 31.99 2bhn h MET 116 CO -0.00 -0.61 -0.02 0.00 1.06 0.00 0.00 176.91 177.34 2bhn h ALA 117 N -0.69 0.89 0.91 6.32 0.00 -1.50 0.12 119.26 125.31 2bhn h ALA 117 Ca -0.05 0.29 -0.04 0.00 0.00 0.00 0.00 54.91 55.10 2bhn h ALA 117 Cb 0.81 0.52 0.01 0.00 0.00 0.00 0.00 17.79 19.13 2bhn h ALA 117 CO -0.03 -0.46 -0.47 0.00 0.00 0.00 0.00 179.25 178.28 2bhn h ALA 118 N 1.83 -1.33 -0.62 0.00 0.00 -0.50 -1.42 119.26 117.23 2bhn h ALA 118 Ca 0.48 -0.27 0.11 0.00 0.00 0.00 0.00 54.91 55.23 2bhn h ALA 118 Cb 0.89 0.53 -0.12 0.00 0.00 0.00 0.00 17.79 19.09 2bhn h ALA 118 CO -0.80 -1.25 -0.32 -0.07 0.00 0.00 0.00 179.25 176.82 2bhn h LEU 119 N -1.26 -1.10 0.54 0.00 3.38 0.17 1.58 115.31 118.62 2bhn h LEU 119 Ca -0.12 0.23 -0.03 0.00 0.09 0.00 0.00 57.88 58.05 2bhn h LEU 119 Cb 0.98 0.56 0.00 0.00 0.09 0.00 0.00 40.66 42.29 2bhn h LEU 119 CO 0.18 -0.29 -0.28 1.56 0.09 0.00 0.00 178.44 179.70 2bhn h GLN 120 N -0.14 -0.72 -0.67 1.13 4.20 -0.87 -0.23 115.11 117.81 2bhn h GLN 120 Ca 0.25 0.05 -0.06 0.00 0.06 0.00 0.00 58.65 58.95 2bhn h GLN 120 Cb 0.55 0.16 -0.03 0.00 0.30 0.00 0.00 27.48 28.46 2bhn h GLN 120 CO -0.70 -0.48 0.17 -0.07 -0.67 0.00 0.00 178.83 177.08 2bhn h LEU 121 N -0.75 0.99 0.15 1.46 3.38 -0.73 -3.08 115.31 116.73 2bhn h LEU 121 Ca -0.07 -0.20 -0.28 0.00 0.09 0.00 0.00 57.88 57.42 2bhn h LEU 121 Cb 0.59 -0.26 0.01 0.00 0.09 0.00 0.00 40.66 41.08 2bhn h LEU 121 CO 0.10 0.95 -1.28 0.44 0.09 0.00 0.00 178.44 178.75 2bhn h ASP 122 N 1.00 0.48 -0.08 -0.43 5.19 0.22 -3.41 116.42 119.40 2bhn h ASP 122 Ca 0.21 -0.52 -0.02 0.00 -0.62 0.00 0.00 57.03 56.08 2bhn h ASP 122 Cb 0.34 -0.16 -0.01 0.00 0.18 0.00 0.00 39.33 39.68 2bhn h ASP 122 CO -0.00 1.41 -0.15 -1.22 -3.12 0.00 0.00 179.24 176.15 2bhn n TYR 123 N -3.56 0.27 -0.37 4.55 4.02 -0.10 -4.95 117.16 117.03 2bhn n TYR 123 Ca -0.10 -1.20 0.00 0.00 -0.01 0.00 0.00 57.90 56.59 2bhn n TYR 123 Cb 1.04 -0.24 0.00 0.00 -0.02 0.00 0.00 39.34 40.11 2bhn n TYR 123 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2bhn n GLY 124 N -1.18 0.63 3.77 2.72 0.00 -1.17 -4.86 105.19 105.10 2bhn n GLY 124 Ca 0.20 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.82 2bhn n GLY 124 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2bhn s ILE 125 N -1.85 2.43 -0.16 -0.61 1.01 -1.22 -4.63 121.20 116.17 2bhn s ILE 125 Ca 0.00 0.38 -0.04 0.00 0.00 0.00 0.00 60.65 60.99 2bhn s ILE 125 Cb 0.00 -3.22 -0.03 0.00 0.01 0.00 0.00 42.46 39.23 2bhn s ILE 125 CO 0.00 0.05 -0.04 0.00 0.00 0.00 0.00 174.94 174.95 2bhn s ARG 126 N -2.37 3.66 -0.22 2.79 1.04 0.39 -4.43 118.95 119.81 2bhn s ARG 126 Ca 0.59 -0.52 0.01 0.00 -1.04 0.00 0.00 55.73 54.77 2bhn s ARG 126 Cb -0.40 -2.92 0.05 0.00 -2.04 0.00 0.00 34.95 29.65 2bhn s ARG 126 CO 0.50 0.23 -0.07 -0.51 -0.04 0.00 0.00 175.30 175.41 2bhn s LEU 127 N 0.40 2.47 0.44 -1.89 1.43 -1.26 -0.94 118.68 119.32 2bhn s LEU 127 Ca -0.04 -1.08 -0.01 0.00 -1.03 0.00 0.00 54.13 51.97 2bhn s LEU 127 Cb -0.14 -1.19 -0.02 0.00 0.03 0.00 0.00 46.19 44.87 2bhn s LEU 127 CO 0.03 -0.21 0.69 -0.04 0.23 0.00 0.00 176.35 177.05 2bhn s MET 128 N 1.40 3.26 -0.18 1.70 -1.94 -0.88 -4.97 119.30 117.69 2bhn s MET 128 Ca -0.04 -0.25 0.01 0.00 -1.71 0.00 0.00 55.69 53.69 2bhn s MET 128 Cb -0.18 -2.52 0.02 0.00 2.01 0.00 0.00 34.83 34.17 2bhn s MET 128 CO -0.07 -0.19 -0.18 1.21 -0.01 0.00 0.00 175.02 175.79 2bhn s ASN 129 N -4.15 3.13 0.15 3.03 3.04 -1.26 -1.55 114.94 117.32 2bhn s ASN 129 Ca 0.46 -0.67 0.02 0.00 0.04 0.00 0.00 52.86 52.72 2bhn s ASN 129 Cb -0.10 -1.41 -0.04 0.00 -1.54 0.00 0.00 41.25 38.17 2bhn s ASN 129 CO 0.40 -0.03 0.29 0.42 -3.04 0.00 0.00 177.10 175.13 2bhn s THR 130 N 1.32 5.32 -1.50 -5.21 -4.23 0.26 -4.90 115.64 106.70 2bhn s THR 130 Ca 0.04 -0.68 0.18 0.00 -1.18 0.00 0.00 61.69 60.05 2bhn s THR 130 Cb -0.14 -3.74 0.63 0.00 1.34 0.00 0.00 72.50 70.59 2bhn s THR 130 CO -0.12 -0.09 1.53 1.15 -0.54 0.00 0.00 174.62 176.55 2bhn n MET 131 N -0.55 3.12 -3.85 3.99 0.00 -1.23 0.25 117.12 118.85 2bhn n MET 131 Ca -0.07 -2.52 0.04 0.00 0.00 0.00 0.00 57.70 55.16 2bhn n MET 131 Cb 0.54 -1.71 0.01 0.00 0.00 0.00 0.00 33.22 32.05 2bhn n MET 131 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 175.97 176.13 2bhn s ASP 132 N -0.91 -0.00 0.13 3.17 3.84 -1.26 -4.00 116.67 117.64 2bhn s ASP 132 Ca 0.46 -0.01 -0.24 0.00 -0.00 0.00 0.00 52.55 52.76 2bhn s ASP 132 Cb 0.27 0.01 -0.02 0.00 -1.38 0.00 0.00 42.92 41.80 2bhn s ASP 132 CO 0.25 -0.01 1.64 -0.65 -0.00 0.00 0.00 175.17 176.40 2bhn h PRO 133 N 2.00 -0.29 -0.80 2.11 0.11 -1.97 -3.07 132.00 130.10 2bhn h PRO 133 Ca -0.25 0.02 0.01 0.00 0.11 0.00 0.00 66.00 65.89 2bhn h PRO 133 Cb 1.18 0.07 -0.04 0.00 0.11 0.00 0.00 31.00 32.31 2bhn h PRO 133 CO 0.29 -0.19 0.53 0.87 -0.21 0.00 0.00 178.00 179.29 2bhn h LYS 134 N -0.30 1.05 -0.22 1.05 6.56 -1.96 0.29 116.57 123.04 2bhn h LYS 134 Ca 0.09 -0.06 0.03 0.00 -1.06 0.00 0.00 60.65 59.65 2bhn h LYS 134 Cb 0.44 -0.24 -0.05 0.00 -0.57 0.00 0.00 32.23 31.81 2bhn h LYS 134 CO -0.28 0.69 -0.35 0.78 -2.06 0.00 0.00 179.45 178.23 2bhn h GLY 135 N 1.08 -1.34 -0.65 3.86 0.00 -1.95 3.30 103.07 107.36 2bhn h GLY 135 Ca 0.29 0.74 0.06 0.00 0.00 0.00 0.00 47.33 48.43 2bhn h GLY 135 CO -0.06 -0.35 -0.39 2.41 0.00 0.00 0.00 176.54 178.15 2bhn n THR 136 N -4.38 -0.45 -0.03 4.70 -1.04 -0.58 0.23 114.28 112.73 2bhn n THR 136 Ca -0.03 1.99 0.06 0.00 -2.04 0.00 0.00 64.05 64.04 2bhn n THR 136 Cb 0.22 -2.50 0.44 0.00 -1.82 0.00 0.00 70.33 66.67 2bhn n THR 136 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2bhn h ALA 137 N 0.06 1.78 -0.23 2.41 0.00 0.11 0.85 119.26 124.24 2bhn h ALA 137 Ca 0.10 -0.02 -0.06 0.00 0.00 0.00 0.00 54.91 54.93 2bhn h ALA 137 Cb 0.27 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 2bhn h ALA 137 CO -0.62 0.16 -0.08 -0.07 0.00 0.00 0.00 179.25 178.65 2bhn h LEU 138 N 0.53 0.47 0.12 0.00 3.38 0.80 -0.17 115.31 120.44 2bhn h LEU 138 Ca 0.19 -0.38 0.02 0.00 0.09 0.00 0.00 57.88 57.80 2bhn h LEU 138 Cb 0.11 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 40.70 2bhn h LEU 138 CO -0.05 0.75 -0.25 0.58 0.09 0.00 0.00 178.44 179.55 2bhn h VAL 139 N 0.19 0.44 -0.74 1.22 2.07 0.47 -2.06 116.25 117.85 2bhn h VAL 139 Ca 0.06 0.00 -0.05 0.00 0.82 0.00 0.00 66.70 67.52 2bhn h VAL 139 Cb 0.55 0.44 -0.03 0.00 -1.52 0.00 0.00 31.29 30.73 2bhn h VAL 139 CO 0.03 0.00 0.25 0.40 0.02 0.00 0.00 177.57 178.27 2bhn h ILE 140 N -0.46 1.26 0.28 4.57 2.04 0.82 -2.22 117.51 123.79 2bhn h ILE 140 Ca 0.03 -0.88 0.00 0.00 1.00 0.00 0.00 64.86 65.02 2bhn h ILE 140 Cb 0.49 0.43 -0.02 0.00 -0.74 0.00 0.00 36.82 36.97 2bhn h ILE 140 CO -0.14 0.35 -0.31 -0.08 0.00 0.00 0.00 178.15 177.96 2bhn h GLU 141 N 1.10 -0.61 -1.00 2.37 4.81 -0.97 -2.20 114.58 118.07 2bhn h GLU 141 Ca 0.24 0.04 0.30 0.00 -0.13 0.00 0.00 59.36 59.82 2bhn h GLU 141 Cb 0.28 0.14 -0.18 0.00 0.63 0.00 0.00 28.75 29.61 2bhn h GLU 141 CO -0.01 -0.41 0.13 0.77 -0.73 0.00 0.00 179.01 178.76 2bhn h SER 142 N -0.64 -0.32 0.33 1.04 0.02 -0.79 0.62 113.55 113.81 2bhn h SER 142 Ca -0.01 0.28 -0.02 0.00 -0.84 0.00 0.00 61.79 61.21 2bhn h SER 142 Cb 0.59 0.45 0.00 0.00 0.14 0.00 0.00 62.40 63.58 2bhn h SER 142 CO -0.08 -0.38 -0.16 -0.07 -1.14 0.00 0.00 176.83 175.00 2bhn h LEU 143 N 0.00 -0.38 0.00 5.07 3.38 -1.20 -0.80 115.31 121.39 2bhn h LEU 143 Ca 0.66 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.62 2bhn h LEU 143 Cb 1.45 0.10 0.00 0.00 0.09 0.00 0.00 40.66 42.30 2bhn h LEU 143 CO -0.90 0.07 0.00 0.00 0.09 0.00 0.00 178.44 177.70 2bhn n ALA 144 N -2.74 0.00 -0.31 1.53 0.00 -0.85 -0.50 120.51 117.64 2bhn n ALA 144 Ca -0.06 0.00 -0.06 0.00 0.00 0.00 0.00 53.44 53.32 2bhn n ALA 144 Cb 0.18 0.43 -0.05 0.00 0.00 0.00 0.00 19.45 20.02 2bhn n ALA 144 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2bhn n ARG 145 N -2.71 -0.29 0.00 0.00 5.12 0.16 -0.57 116.66 118.36 2bhn n ARG 145 Ca 0.00 1.16 0.00 0.00 -1.93 0.00 0.00 57.85 57.08 2bhn n ARG 145 Cb 0.00 -1.71 0.00 0.00 -1.16 0.00 0.00 32.46 29.59 2bhn n ARG 145 CO 0.00 0.00 0.00 1.28 -1.93 0.00 0.00 177.63 176.98 2bhn n LEU 146 N -5.00 0.45 0.00 0.55 4.77 0.34 -1.92 117.00 116.19 2bhn n LEU 146 Ca 0.03 -0.23 0.00 0.00 -0.03 0.00 0.00 56.01 55.79 2bhn n LEU 146 Cb 0.23 -0.20 0.00 0.00 -2.33 0.00 0.00 43.42 41.12 2bhn n LEU 146 CO -0.12 0.11 -0.02 -1.54 -1.33 0.00 0.00 177.39 174.49 2bhn n SER 147 N 0.32 0.17 -4.15 -1.43 3.41 0.26 -4.78 113.62 107.42 2bhn n SER 147 Ca 0.00 -0.02 -0.44 0.00 -0.26 0.00 0.00 58.87 58.15 2bhn n SER 147 Cb 0.11 0.07 0.01 0.00 -0.26 0.00 0.00 64.21 64.14 2bhn n SER 147 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 2bhn n THR 148 N -0.09 4.98 -3.66 6.66 -1.04 -0.81 -4.92 114.28 115.41 2bhn n THR 148 Ca 0.00 -5.65 -0.10 0.00 -2.04 0.00 0.00 64.05 56.26 2bhn n THR 148 Cb 0.00 -2.30 -0.11 0.00 -1.82 0.00 0.00 70.33 66.10 2bhn n THR 148 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2bhn s ARG 149 N -2.00 0.26 0.22 -2.82 1.70 -1.25 -4.86 118.95 110.20 2bhn s ARG 149 Ca 0.32 0.93 -0.22 0.00 -0.47 0.00 0.00 55.73 56.29 2bhn s ARG 149 Cb -0.01 0.20 -0.14 0.00 -0.57 0.00 0.00 34.95 34.43 2bhn s ARG 149 CO 0.03 -0.27 0.31 -0.85 -1.08 0.00 0.00 175.30 173.44 2bhn n GLU 150 N 5.38 0.00 0.00 3.89 -0.00 -1.26 -3.77 120.64 124.88 2bhn n GLU 150 Ca -0.08 0.00 0.00 0.00 -0.00 0.00 0.00 57.16 57.08 2bhn n GLU 150 Cb 0.49 -0.84 0.00 0.00 -0.00 0.00 0.00 31.44 31.10 2bhn n GLU 150 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2bhn n GLY 151 N 1.77 1.80 0.83 -1.84 0.00 -1.26 -4.91 105.19 101.58 2bhn n GLY 151 Ca 0.13 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.28 2bhn n GLY 151 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2bhn n GLY 152 N 0.00 0.73 2.96 -0.02 0.00 -1.25 -4.96 105.19 102.66 2bhn n GLY 152 Ca 0.00 -0.62 -0.13 0.00 0.00 0.00 0.00 46.02 45.27 2bhn n GLY 152 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2bhn s GLN 153 N -1.99 0.12 0.06 1.61 -0.21 -1.26 -5.12 119.66 112.87 2bhn s GLN 153 Ca 0.31 0.41 -0.27 0.00 0.02 0.00 0.00 55.36 55.84 2bhn s GLN 153 Cb 0.20 -0.16 -0.05 0.00 1.00 0.00 0.00 33.01 34.00 2bhn s GLN 153 CO 0.31 -0.16 0.83 1.03 -2.12 0.00 0.00 175.29 175.18 2bhn s ARG 154 N 1.17 4.56 -0.35 2.91 0.52 -1.26 -5.03 118.95 121.47 2bhn s ARG 154 Ca -0.09 1.19 0.03 0.00 -0.52 0.00 0.00 55.73 56.34 2bhn s ARG 154 Cb -0.11 -3.37 0.10 0.00 0.52 0.00 0.00 34.95 32.09 2bhn s ARG 154 CO -0.07 0.25 0.07 0.42 0.02 0.00 0.00 175.30 175.99 2bhn s ILE 155 N 0.02 2.39 0.08 1.52 1.01 -1.26 -5.08 121.20 119.87 2bhn s ILE 155 Ca 0.41 -2.31 -0.18 0.00 0.00 0.00 0.00 60.65 58.57 2bhn s ILE 155 Cb -0.21 -2.75 -0.07 0.00 0.01 0.00 0.00 42.46 39.44 2bhn s ILE 155 CO 0.25 -0.61 0.55 -0.69 0.00 0.00 0.00 174.94 174.44 2bhn s VAL 156 N 0.93 4.78 -0.48 2.92 1.01 -1.26 -5.06 120.40 123.25 2bhn s VAL 156 Ca 0.11 1.12 0.03 0.00 0.00 0.00 0.00 61.98 63.24 2bhn s VAL 156 Cb -0.19 -3.85 0.13 0.00 0.00 0.00 0.00 36.38 32.46 2bhn s VAL 156 CO -0.08 0.51 0.24 -0.63 0.00 0.00 0.00 175.10 175.14 2bhn s ILE 157 N -1.16 2.16 0.13 2.22 1.01 -1.26 -5.10 121.20 119.19 2bhn s ILE 157 Ca 0.30 -2.98 -0.30 0.00 0.00 0.00 0.00 60.65 57.66 2bhn s ILE 157 Cb -0.19 -2.51 -0.06 0.00 0.01 0.00 0.00 42.46 39.71 2bhn s ILE 157 CO 0.18 -0.82 1.01 -1.00 0.00 0.00 0.00 174.94 174.32 2bhn s HIS 158 N 0.02 3.74 0.84 3.97 3.76 -1.26 -5.06 115.29 121.30 2bhn s HIS 158 Ca 0.17 1.73 -0.12 0.00 -0.15 0.00 0.00 55.06 56.68 2bhn s HIS 158 Cb -0.25 -3.13 0.10 0.00 1.11 0.00 0.00 32.58 30.41 2bhn s HIS 158 CO -0.01 -0.07 1.18 -1.59 -0.85 0.00 0.00 174.74 173.40 2bhn s LYS 159 N -0.08 1.68 0.04 1.40 -2.85 -1.26 -5.08 119.74 113.60 2bhn s LYS 159 Ca 0.48 0.13 0.09 0.00 -1.00 0.00 0.00 55.97 55.67 2bhn s LYS 159 Cb -0.25 -1.92 -0.03 0.00 -2.06 0.00 0.00 37.83 33.57 2bhn s LYS 159 CO 0.31 -1.79 -0.25 0.15 0.10 0.00 0.00 175.35 173.86 2bhn s LYS 160 N -5.52 1.73 0.27 1.78 1.02 -1.26 -5.08 119.74 112.68 2bhn s LYS 160 Ca 0.63 -1.08 -0.30 0.00 0.02 0.00 0.00 55.97 55.24 2bhn s LYS 160 Cb -0.12 -1.90 -0.14 0.00 -0.52 0.00 0.00 37.83 35.16 2bhn s LYS 160 CO 0.50 0.49 1.24 -2.30 -0.92 0.00 0.00 175.35 174.36 2bhn n PRO 161 N 1.80 1.77 -2.69 -1.68 -0.02 -1.26 -4.88 135.00 128.04 2bhn n PRO 161 Ca -0.17 0.62 -0.43 0.00 -2.02 0.00 0.00 63.50 61.50 2bhn n PRO 161 Cb 0.52 -2.16 -0.00 0.00 -0.02 0.00 0.00 33.50 31.84 2bhn n PRO 161 CO 0.00 0.00 0.00 -0.98 1.98 0.00 0.00 175.50 176.50 2bhn s ARG 162 N -1.10 4.01 0.07 -0.52 3.03 -1.26 -4.99 118.95 118.20 2bhn s ARG 162 Ca 0.63 -2.17 -0.16 0.00 2.03 0.00 0.00 55.73 56.06 2bhn s ARG 162 Cb -0.67 -5.39 -0.06 0.00 -1.03 0.00 0.00 34.95 27.80 2bhn s ARG 162 CO 0.56 -2.11 0.51 -0.51 -1.13 0.00 0.00 175.30 172.62 2bhn s LEU 163 N 3.42 4.46 0.00 -1.89 1.02 -1.26 -5.06 118.68 119.37 2bhn s LEU 163 Ca 0.50 1.11 0.00 0.00 0.02 0.00 0.00 54.13 55.76 2bhn s LEU 163 Cb 0.02 -2.90 0.00 0.00 0.02 0.00 0.00 46.19 43.33 2bhn s LEU 163 CO 0.05 0.24 0.00 -1.20 0.02 0.00 0.00 176.35 175.47 2bhn n SER 164 N 1.49 0.00 -4.40 2.29 7.64 -1.26 -4.95 113.62 114.42 2bhn n SER 164 Ca -0.10 0.00 -0.44 0.00 1.01 0.00 0.00 58.87 59.34 2bhn n SER 164 Cb 0.52 0.00 -0.01 0.00 -1.01 0.00 0.00 64.21 63.71 2bhn n SER 164 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 2bhn n ASP 165 N -0.64 -1.44 -0.35 6.43 9.92 -1.26 -4.87 116.55 124.34 2bhn n ASP 165 Ca 0.00 0.97 0.12 0.00 -0.53 0.00 0.00 54.79 55.35 2bhn n ASP 165 Cb 0.00 -1.00 0.31 0.00 -0.64 0.00 0.00 41.12 39.79 2bhn n ASP 165 CO 0.00 0.00 0.00 0.58 0.13 0.00 0.00 177.20 177.91 2bhn h VAL 166 N 0.82 0.74 0.00 2.53 2.07 -2.00 -2.84 116.25 117.57 2bhn h VAL 166 Ca -0.35 -0.27 -0.02 0.00 0.82 0.00 0.00 66.70 66.87 2bhn h VAL 166 Cb 1.42 -0.13 -0.00 0.00 -1.52 0.00 0.00 31.29 31.06 2bhn h VAL 166 CO 0.53 0.15 -0.09 0.03 0.02 0.00 0.00 177.57 178.20 2bhn h ARG 167 N 0.80 0.00 0.37 1.57 -0.00 -1.99 -0.30 114.38 114.84 2bhn h ARG 167 Ca 0.57 0.00 -0.02 0.00 -0.50 0.00 0.00 59.98 60.03 2bhn h ARG 167 Cb 0.84 0.00 0.00 0.00 0.00 0.00 0.00 29.97 30.81 2bhn h ARG 167 CO -0.36 0.09 -0.18 1.05 0.00 0.00 0.00 179.97 180.57 2bhn h GLU 168 N 0.00 -0.48 -0.57 0.04 4.11 -1.85 -3.06 114.58 112.76 2bhn h GLU 168 Ca -0.00 0.03 0.11 0.00 0.07 0.00 0.00 59.36 59.57 2bhn h GLU 168 Cb 0.70 0.11 -0.11 0.00 0.50 0.00 0.00 28.75 29.94 2bhn h GLU 168 CO 0.01 -0.17 -0.27 -1.49 0.07 0.00 0.00 179.01 177.17 2bhn h TRP 169 N -0.90 -0.69 -0.88 2.06 4.06 -1.41 0.24 115.95 118.43 2bhn h TRP 169 Ca -0.05 0.06 0.22 0.00 2.06 0.00 0.00 58.89 61.18 2bhn h TRP 169 Cb 0.54 0.39 -0.13 0.00 -1.00 0.00 0.00 29.16 28.97 2bhn h TRP 169 CO 0.02 -0.34 0.35 1.96 -3.56 0.00 0.00 178.44 176.87 2bhn h GLN 170 N -0.12 0.34 0.10 0.49 4.20 -1.12 0.22 115.11 119.22 2bhn h GLN 170 Ca 0.25 -0.02 -0.29 0.00 0.06 0.00 0.00 58.65 58.65 2bhn h GLN 170 Cb 0.52 -0.08 0.03 0.00 0.30 0.00 0.00 27.48 28.25 2bhn h GLN 170 CO -0.65 0.23 -1.21 -0.07 -0.67 0.00 0.00 178.83 176.46 2bhn h LEU 171 N 0.35 0.89 0.14 1.46 3.38 -0.57 -1.98 115.31 118.99 2bhn h LEU 171 Ca 0.55 -0.80 0.02 0.00 0.09 0.00 0.00 57.88 57.73 2bhn h LEU 171 Cb 1.04 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 41.48 2bhn h LEU 171 CO -0.55 1.60 -0.29 0.22 0.09 0.00 0.00 178.44 179.52 2bhn h TYR 172 N 0.30 -0.78 -0.17 1.13 3.20 0.08 -1.26 116.97 119.46 2bhn h TYR 172 Ca -0.18 0.02 0.05 0.00 3.14 0.00 0.00 58.73 61.76 2bhn h TYR 172 Cb 1.88 0.33 -0.06 0.00 1.54 0.00 0.00 36.73 40.42 2bhn h TYR 172 CO 0.11 -0.40 -0.20 0.82 -1.64 0.00 0.00 178.16 176.86 2bhn h ILE 173 N -0.52 0.49 -0.82 1.81 2.04 -0.59 -2.41 117.51 117.51 2bhn h ILE 173 Ca 0.03 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.88 2bhn h ILE 173 Cb 0.54 0.49 -0.04 0.00 -0.74 0.00 0.00 36.82 37.07 2bhn h ILE 173 CO -0.16 0.00 0.50 -0.07 0.00 0.00 0.00 178.15 178.42 2bhn h LEU 174 N -0.23 0.99 -2.74 1.44 3.38 -1.32 -0.27 115.31 116.56 2bhn h LEU 174 Ca 0.11 -0.06 -0.00 0.00 0.09 0.00 0.00 57.88 58.03 2bhn h LEU 174 Cb 0.40 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 40.90 2bhn h LEU 174 CO -0.31 0.76 -0.00 1.56 0.09 0.00 0.00 178.44 180.54 2bhn h GLN 175 N 1.14 0.00 0.00 1.13 4.20 -0.73 -2.27 115.11 118.59 2bhn h GLN 175 Ca 0.30 0.00 -0.02 0.00 0.06 0.00 0.00 58.65 58.98 2bhn h GLN 175 Cb -0.05 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 27.73 2bhn h GLN 175 CO -0.06 0.00 -0.11 0.77 -0.67 0.00 0.00 178.83 178.77 2bhn h SER 176 N 0.00 0.00 -3.89 1.46 0.02 -0.82 -3.43 113.55 106.89 2bhn h SER 176 Ca -0.00 0.00 -0.50 0.00 -0.84 0.00 0.00 61.79 60.45 2bhn h SER 176 Cb 0.08 0.00 0.03 0.00 0.14 0.00 0.00 62.40 62.65 2bhn h SER 176 CO 0.00 0.11 0.47 -0.36 -1.14 0.00 0.00 176.83 175.91 2bhn s PHE 177 N -4.07 3.34 0.16 3.45 0.40 -0.85 -4.98 117.98 115.44 2bhn s PHE 177 Ca -0.02 1.64 -0.31 0.00 -0.60 0.00 0.00 56.93 57.64 2bhn s PHE 177 Cb 0.12 -3.28 -0.08 0.00 0.51 0.00 0.00 43.02 40.29 2bhn s PHE 177 CO 0.57 -0.81 1.34 -1.25 0.70 0.00 0.00 175.22 175.78 2bhn s PRO 178 N -1.97 4.36 0.00 0.24 0.04 -1.26 -2.66 135.00 133.74 2bhn s PRO 178 Ca 0.52 2.06 0.00 0.00 0.04 0.00 0.00 61.00 63.62 2bhn s PRO 178 Cb -0.29 -3.22 0.00 0.00 0.04 0.00 0.00 34.50 31.03 2bhn s PRO 178 CO 0.37 -0.33 0.00 0.41 0.04 0.00 0.00 177.00 177.49 2bhn n GLY 179 N 2.85 2.90 3.70 0.56 0.00 -1.26 -4.91 105.19 109.03 2bhn n GLY 179 Ca 0.08 -0.75 -0.42 0.00 0.00 0.00 0.00 46.02 44.93 2bhn n GLY 179 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2bhn s ILE 180 N 0.00 3.02 0.00 -0.61 1.09 -1.09 -5.01 121.20 118.60 2bhn s ILE 180 Ca 0.00 0.58 0.00 0.00 -1.10 0.00 0.00 60.65 60.13 2bhn s ILE 180 Cb 0.00 -3.37 0.00 0.00 -1.06 0.00 0.00 42.46 38.03 2bhn s ILE 180 CO 0.00 0.01 0.00 0.61 -0.10 0.00 0.00 174.94 175.46 2bhn n GLY 181 N 3.85 4.10 0.28 6.18 0.00 -1.26 -4.64 105.19 113.70 2bhn n GLY 181 Ca 0.15 -2.13 -0.11 0.00 0.00 0.00 0.00 46.02 43.93 2bhn n GLY 181 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 2bhn h ARG 182 N 0.00 0.96 0.14 1.61 1.12 -1.95 -1.22 114.38 115.04 2bhn h ARG 182 Ca 0.00 -0.36 -0.01 0.00 -1.11 0.00 0.00 59.98 58.50 2bhn h ARG 182 Cb 0.00 -0.06 0.00 0.00 -0.01 0.00 0.00 29.97 29.91 2bhn h ARG 182 CO 0.00 1.03 -0.07 -0.09 -3.11 0.00 0.00 179.97 177.73 2bhn h ARG 183 N 0.81 -0.18 -0.86 0.20 9.65 -2.00 -2.49 114.38 119.52 2bhn h ARG 183 Ca 0.13 0.01 0.20 0.00 -1.10 0.00 0.00 59.98 59.22 2bhn h ARG 183 Cb 0.67 0.04 -0.12 0.00 -1.39 0.00 0.00 29.97 29.17 2bhn h ARG 183 CO 0.05 0.27 0.33 1.15 2.80 0.00 0.00 179.97 184.57 2bhn h THR 184 N -0.76 0.48 -0.28 0.20 2.02 -1.85 0.48 112.91 113.20 2bhn h THR 184 Ca -0.02 -0.13 0.04 0.00 0.77 0.00 0.00 66.41 67.07 2bhn h THR 184 Cb 0.53 0.08 -0.07 0.00 -1.74 0.00 0.00 68.15 66.96 2bhn h THR 184 CO 0.03 0.07 -0.53 0.00 0.37 0.00 0.00 175.52 175.46 2bhn h ALA 185 N 1.69 -0.82 -0.66 6.16 0.00 -1.12 0.32 119.26 124.83 2bhn h ALA 185 Ca 0.52 -0.03 0.09 0.00 0.00 0.00 0.00 54.91 55.49 2bhn h ALA 185 Cb 0.96 1.07 -0.07 0.00 0.00 0.00 0.00 17.79 19.75 2bhn h ALA 185 CO -0.53 -1.04 0.31 0.93 0.00 0.00 0.00 179.25 178.92 2bhn h GLU 186 N -0.46 0.53 -0.56 0.00 5.08 -0.51 0.03 114.58 118.69 2bhn h GLU 186 Ca 0.05 -0.03 0.07 0.00 -1.00 0.00 0.00 59.36 58.45 2bhn h GLU 186 Cb 0.61 -0.12 -0.06 0.00 0.50 0.00 0.00 28.75 29.68 2bhn h GLU 186 CO -0.51 0.35 0.23 0.00 -1.00 0.00 0.00 179.01 178.08 2bhn h ARG 187 N 0.54 0.42 0.16 2.33 3.08 0.06 0.72 114.38 121.69 2bhn h ARG 187 Ca 0.33 -0.03 0.01 0.00 0.07 0.00 0.00 59.98 60.36 2bhn h ARG 187 Cb 0.34 -0.10 -0.02 0.00 0.08 0.00 0.00 29.97 30.27 2bhn h ARG 187 CO -0.27 0.28 -0.21 0.82 -1.07 0.00 0.00 179.97 179.52 2bhn h ILE 188 N 0.43 0.53 -0.35 2.04 2.04 0.99 0.29 117.51 123.47 2bhn h ILE 188 Ca 0.27 0.00 -0.04 0.00 1.00 0.00 0.00 64.86 66.08 2bhn h ILE 188 Cb 0.27 0.53 -0.02 0.00 -0.74 0.00 0.00 36.82 36.86 2bhn h ILE 188 CO -0.24 0.00 0.04 -0.07 0.00 0.00 0.00 178.15 177.88 2bhn h LEU 189 N -0.43 0.50 0.97 1.44 3.38 0.14 0.98 115.31 122.28 2bhn h LEU 189 Ca 0.01 -0.08 -0.05 0.00 0.09 0.00 0.00 57.88 57.86 2bhn h LEU 189 Cb 0.42 -0.13 0.01 0.00 0.09 0.00 0.00 40.66 41.05 2bhn h LEU 189 CO -0.09 0.54 -0.47 -0.33 0.09 0.00 0.00 178.44 178.18 2bhn h GLU 190 N 0.52 -1.26 -0.85 1.13 5.08 0.69 0.83 114.58 120.72 2bhn h GLU 190 Ca 0.12 0.09 0.05 0.00 -1.00 0.00 0.00 59.36 58.61 2bhn h GLU 190 Cb 0.27 0.29 -0.06 0.00 0.50 0.00 0.00 28.75 29.75 2bhn h GLU 190 CO 0.00 -0.84 0.53 0.00 -1.00 0.00 0.00 179.01 177.70 2bhn h ARG 191 N -1.31 0.97 0.00 2.33 3.08 0.27 -3.37 114.38 116.35 2bhn h ARG 191 Ca -0.13 -0.06 -0.34 0.00 0.07 0.00 0.00 59.98 59.52 2bhn h ARG 191 Cb 1.01 -0.22 -0.06 0.00 0.08 0.00 0.00 29.97 30.78 2bhn h ARG 191 CO 0.21 0.64 -2.24 1.19 -1.07 0.00 0.00 179.97 178.70 2bhn n PHE 192 N -4.60 0.00 0.00 3.04 3.01 0.33 -5.02 117.46 114.22 2bhn n PHE 192 Ca 0.11 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.57 2bhn n PHE 192 Cb 0.14 -0.83 0.00 0.00 -0.01 0.00 0.00 39.48 38.78 2bhn n PHE 192 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2bhn n GLY 193 N 2.27 3.06 3.10 1.37 0.00 0.28 -4.80 105.19 110.48 2bhn n GLY 193 Ca -0.40 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.40 2bhn n GLY 193 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2bhn s SER 194 N -0.85 1.61 0.12 1.61 0.01 -1.26 -5.01 113.70 109.93 2bhn s SER 194 Ca 0.00 -0.25 -0.23 0.00 1.31 0.00 0.00 55.95 56.78 2bhn s SER 194 Cb 0.00 -0.19 -0.04 0.00 0.21 0.00 0.00 66.02 65.99 2bhn s SER 194 CO 0.00 0.17 1.68 -0.07 0.41 0.00 0.00 173.24 175.42 2bhn h LEU 195 N 5.83 -0.41 -0.91 2.44 3.38 -1.98 -1.25 115.31 122.41 2bhn h LEU 195 Ca -0.34 0.07 0.08 0.00 0.09 0.00 0.00 57.88 57.78 2bhn h LEU 195 Cb 1.16 0.19 -0.11 0.00 0.09 0.00 0.00 40.66 41.99 2bhn h LEU 195 CO 0.49 -0.18 -0.53 -0.62 0.09 0.00 0.00 178.44 177.68 2bhn n GLU 196 N -5.28 -0.40 -0.26 1.13 -0.58 -1.26 0.10 120.64 114.09 2bhn n GLU 196 Ca -0.04 1.40 -0.05 0.00 -0.42 0.00 0.00 57.16 58.04 2bhn n GLU 196 Cb 0.19 -2.05 0.06 0.00 -0.57 0.00 0.00 31.44 29.07 2bhn n GLU 196 CO 0.00 0.00 0.00 -0.09 -0.48 0.00 0.00 177.13 176.56 2bhn h ARG 197 N 0.00 0.99 -0.41 3.49 2.43 -1.81 -0.55 114.38 118.52 2bhn h ARG 197 Ca 0.14 -0.09 -0.03 0.00 -0.81 0.00 0.00 59.98 59.19 2bhn h ARG 197 Cb 0.37 -0.21 -0.02 0.00 -0.42 0.00 0.00 29.97 29.70 2bhn h ARG 197 CO -0.85 0.70 0.14 0.35 -1.51 0.00 0.00 179.97 178.80 2bhn h PHE 198 N 0.99 0.65 -0.04 2.20 3.57 0.05 -0.47 116.94 123.89 2bhn h PHE 198 Ca 0.26 -0.06 0.01 0.00 3.53 0.00 0.00 57.97 61.71 2bhn h PHE 198 Cb -0.03 -0.19 -0.00 0.00 2.79 0.00 0.00 35.95 38.52 2bhn h PHE 198 CO -0.01 0.59 0.05 0.74 -2.23 0.00 0.00 178.31 177.45 2bhn h PHE 199 N 0.52 0.00 -0.20 0.41 0.05 0.21 -0.47 116.94 117.47 2bhn h PHE 199 Ca 0.13 0.00 0.00 0.00 3.82 0.00 0.00 57.97 61.92 2bhn h PHE 199 Cb 0.24 0.00 0.00 0.00 2.00 0.00 0.00 35.95 38.19 2bhn h PHE 199 CO 0.01 0.00 0.00 2.41 -0.18 0.00 0.00 178.31 180.55 2bhn n THR 200 N -3.70 0.33 -0.50 -1.55 -1.04 -0.38 -4.99 114.28 102.45 2bhn n THR 200 Ca -0.02 -0.66 -0.29 0.00 -2.04 0.00 0.00 64.05 61.04 2bhn n THR 200 Cb 0.14 1.08 0.27 0.00 -1.82 0.00 0.00 70.33 70.00 2bhn n THR 200 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2bhn s ALA 201 N -1.32 -0.65 0.27 2.41 0.00 -0.19 -5.03 121.76 117.25 2bhn s ALA 201 Ca 0.26 -0.34 0.06 0.00 0.00 0.00 0.00 51.96 51.94 2bhn s ALA 201 Cb 0.16 -3.16 -0.02 0.00 0.00 0.00 0.00 23.12 20.10 2bhn s ALA 201 CO 0.23 -4.11 0.38 -1.54 0.00 0.00 0.00 175.76 170.73 2bhn s SER 202 N -2.68 6.15 0.16 0.00 1.04 -1.26 -4.98 113.70 112.14 2bhn s SER 202 Ca 0.69 -0.04 -0.18 0.00 0.48 0.00 0.00 55.95 56.90 2bhn s SER 202 Cb -0.22 -1.63 0.09 0.00 0.10 0.00 0.00 66.02 64.36 2bhn s SER 202 CO 0.63 -0.18 1.65 0.07 0.98 0.00 0.00 173.24 176.39 2bhn h LYS 203 N 1.11 -0.08 0.00 4.02 -0.00 -1.96 -1.95 116.57 117.71 2bhn h LYS 203 Ca -0.50 0.01 0.00 0.00 -0.00 0.00 0.00 60.65 60.16 2bhn h LYS 203 Cb 1.24 0.02 0.00 0.00 -0.00 0.00 0.00 32.23 33.49 2bhn h LYS 203 CO 0.58 -0.05 0.00 0.00 -0.00 0.00 0.00 179.45 179.98 2bhn n ALA 204 N -2.77 -0.10 -0.40 0.07 0.00 -1.26 -1.19 120.51 114.86 2bhn n ALA 204 Ca 0.02 0.00 0.32 0.00 0.00 0.00 0.00 53.44 53.78 2bhn n ALA 204 Cb 0.25 0.30 0.60 0.00 0.00 0.00 0.00 19.45 20.60 2bhn n ALA 204 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 2bhn h GLU 205 N 0.00 0.16 0.01 0.00 5.08 -1.81 -1.61 114.58 116.41 2bhn h GLU 205 Ca 0.00 -0.01 -0.09 0.00 -1.00 0.00 0.00 59.36 58.26 2bhn h GLU 205 Cb 0.00 -0.04 0.01 0.00 0.50 0.00 0.00 28.75 29.22 2bhn h GLU 205 CO 0.00 0.11 -0.35 0.82 -1.00 0.00 0.00 179.01 178.59 2bhn h ILE 206 N 0.17 1.54 0.00 3.13 2.04 -1.00 -3.30 117.51 120.10 2bhn h ILE 206 Ca 0.77 -2.06 0.00 0.00 1.00 0.00 0.00 64.86 64.57 2bhn h ILE 206 Cb 2.24 2.84 0.00 0.00 -0.74 0.00 0.00 36.82 41.15 2bhn h ILE 206 CO -0.45 0.57 0.00 -1.54 0.00 0.00 0.00 178.15 176.73 2bhn n SER 207 N -4.42 0.00 0.05 1.72 3.41 -0.33 -1.19 113.62 112.86 2bhn n SER 207 Ca -0.10 0.38 -0.01 0.00 -0.26 0.00 0.00 58.87 58.88 2bhn n SER 207 Cb 0.56 -0.42 -0.07 0.00 -0.26 0.00 0.00 64.21 64.02 2bhn n SER 207 CO 0.00 0.00 0.00 0.07 -0.16 0.00 0.00 175.04 174.95 2bhn h LYS 208 N 0.00 0.00 -5.83 4.33 2.10 -1.63 -3.40 116.57 112.14 2bhn h LYS 208 Ca 0.00 0.00 -0.60 0.00 -2.00 0.00 0.00 60.65 58.05 2bhn h LYS 208 Cb 0.09 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 31.40 2bhn h LYS 208 CO 0.00 0.41 1.51 0.28 -2.00 0.00 0.00 179.45 179.64 2bhn n VAL 209 N -3.01 0.15 -1.47 0.07 0.31 -0.33 -4.80 118.33 109.26 2bhn n VAL 209 Ca -0.08 -0.39 -0.62 0.00 -0.01 0.00 0.00 64.34 63.24 2bhn n VAL 209 Cb 0.85 -1.97 -0.11 0.00 -0.91 0.00 0.00 33.84 31.70 2bhn n VAL 209 CO 0.00 0.00 0.00 1.21 -1.32 0.00 0.00 176.83 176.72 2bhn n GLU 210 N 8.51 0.13 0.00 5.55 2.13 -1.26 -0.74 120.64 134.95 2bhn n GLU 210 Ca 0.40 0.04 0.00 0.00 0.66 0.00 0.00 57.16 58.26 2bhn n GLU 210 Cb 0.32 -1.59 0.00 0.00 0.27 0.00 0.00 31.44 30.44 2bhn n GLU 210 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2bhn n GLY 211 N 5.97 2.18 3.19 8.31 0.00 -1.26 -4.76 105.19 118.83 2bhn n GLY 211 Ca 0.44 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 46.10 2bhn n GLY 211 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2bhn s ILE 212 N -2.00 3.17 0.00 -0.61 1.01 0.08 -4.90 121.20 117.96 2bhn s ILE 212 Ca 0.00 -1.38 0.00 0.00 0.00 0.00 0.00 60.65 59.27 2bhn s ILE 212 Cb 0.00 -2.84 0.00 0.00 0.01 0.00 0.00 42.46 39.63 2bhn s ILE 212 CO 0.00 -0.16 0.00 0.61 0.00 0.00 0.00 174.94 175.39 2bhn n GLY 213 N 4.66 -0.44 0.00 6.18 0.00 -1.26 -4.24 105.19 110.08 2bhn n GLY 213 Ca -0.12 -1.53 0.00 0.00 0.00 0.00 0.00 46.02 44.36 2bhn n GLY 213 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2bhn n GLU 214 N 0.00 0.00 -0.38 1.61 -0.58 -1.26 -3.54 120.64 116.49 2bhn n GLU 214 Ca 0.00 0.36 -0.05 0.00 -0.42 0.00 0.00 57.16 57.05 2bhn n GLU 214 Cb 0.00 -1.30 -0.02 0.00 -0.57 0.00 0.00 31.44 29.54 2bhn n GLU 214 CO 0.00 0.00 0.00 0.36 -0.48 0.00 0.00 177.13 177.01 2bhn n LYS 215 N -1.58 -0.31 0.29 3.49 -0.00 -1.26 -0.33 118.16 118.46 2bhn n LYS 215 Ca 0.00 1.43 0.17 0.00 -0.00 0.00 0.00 58.31 59.91 2bhn n LYS 215 Cb 0.00 -2.11 0.97 0.00 -0.00 0.00 0.00 35.03 33.89 2bhn n LYS 215 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2bhn h ARG 216 N 0.00 0.00 0.19 -1.58 3.08 -1.93 -1.60 114.38 112.55 2bhn h ARG 216 Ca 0.24 0.00 -0.31 0.00 0.07 0.00 0.00 59.98 59.98 2bhn h ARG 216 Cb 0.48 0.00 0.02 0.00 0.08 0.00 0.00 29.97 30.55 2bhn h ARG 216 CO -0.91 0.00 -1.40 0.00 -1.07 0.00 0.00 179.97 176.59 2bhn h ALA 217 N 1.93 -0.02 -0.60 0.04 0.00 -0.72 -1.56 119.26 118.32 2bhn h ALA 217 Ca 0.02 -0.90 0.11 0.00 0.00 0.00 0.00 54.91 54.14 2bhn h ALA 217 Cb 0.12 0.13 -0.08 0.00 0.00 0.00 0.00 17.79 17.95 2bhn h ALA 217 CO -0.00 0.85 0.14 0.93 0.00 0.00 0.00 179.25 181.17 2bhn h GLU 218 N 0.11 0.27 -0.27 0.00 4.39 -0.98 -1.11 114.58 116.99 2bhn h GLU 218 Ca -0.21 -0.02 -0.07 0.00 0.34 0.00 0.00 59.36 59.41 2bhn h GLU 218 Cb 2.08 -0.06 -0.01 0.00 -0.10 0.00 0.00 28.75 30.66 2bhn h GLU 218 CO 0.24 0.18 -0.10 0.93 -1.16 0.00 0.00 179.01 179.09 2bhn h GLU 219 N 0.28 0.54 -0.49 2.33 4.39 -1.38 0.44 114.58 120.69 2bhn h GLU 219 Ca 0.31 -0.22 -0.01 0.00 0.34 0.00 0.00 59.36 59.78 2bhn h GLU 219 Cb 0.46 -0.02 -0.02 0.00 -0.10 0.00 0.00 28.75 29.06 2bhn h GLU 219 CO -0.39 0.77 0.24 0.82 -1.16 0.00 0.00 179.01 179.30 2bhn h ILE 220 N 0.28 1.16 0.00 3.13 2.04 -1.15 0.20 117.51 123.16 2bhn h ILE 220 Ca 0.06 -0.44 -0.15 0.00 1.00 0.00 0.00 64.86 65.34 2bhn h ILE 220 Cb 0.60 0.53 -0.02 0.00 -0.74 0.00 0.00 36.82 37.18 2bhn h ILE 220 CO 0.03 0.18 -0.96 0.11 0.00 0.00 0.00 178.15 177.51 2bhn h LYS 221 N 0.68 0.00 -0.21 2.37 1.57 -0.84 0.18 116.57 120.32 2bhn h LYS 221 Ca 0.17 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.94 2bhn h LYS 221 Cb 0.06 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.36 2bhn h LYS 221 CO -0.03 0.46 0.09 0.87 -0.57 0.00 0.00 179.45 180.27 2bhn h LYS 222 N 0.00 0.31 -0.48 3.15 1.79 0.22 -0.22 116.57 121.34 2bhn h LYS 222 Ca -0.08 -0.05 0.02 0.00 -2.18 0.00 0.00 60.65 58.36 2bhn h LYS 222 Cb 1.52 -0.05 -0.03 0.00 -1.58 0.00 0.00 32.23 32.09 2bhn h LYS 222 CO 0.06 0.36 0.29 0.82 -1.08 0.00 0.00 179.45 179.91 2bhn h ILE 223 N 0.19 1.06 0.00 1.86 2.04 -0.57 0.14 117.51 122.22 2bhn h ILE 223 Ca 0.07 -0.20 -0.09 0.00 1.00 0.00 0.00 64.86 65.64 2bhn h ILE 223 Cb 0.17 0.42 -0.01 0.00 -0.74 0.00 0.00 36.82 36.66 2bhn h ILE 223 CO -0.01 0.11 -0.44 -0.07 0.00 0.00 0.00 178.15 177.74 2bhn h LEU 224 N 0.58 0.00 -1.02 1.44 3.38 -0.46 -3.37 115.31 115.86 2bhn h LEU 224 Ca 0.19 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.16 2bhn h LEU 224 Cb 0.01 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.76 2bhn h LEU 224 CO -0.08 0.44 0.00 1.15 0.09 0.00 0.00 178.44 180.04 2bhn n MET 225 N -3.79 -0.07 -2.37 1.13 0.00 -0.11 -5.00 117.12 106.91 2bhn n MET 225 Ca -0.01 -0.51 -0.42 0.00 0.00 0.00 0.00 57.70 56.76 2bhn n MET 225 Cb 0.50 -0.82 -0.03 0.00 0.00 0.00 0.00 33.22 32.87 2bhn n MET 225 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 175.97 176.96 2bhn s THR 226 N -0.15 3.91 1.18 3.17 2.01 0.46 -5.04 115.64 121.19 2bhn s THR 226 Ca 0.00 1.36 -0.20 0.00 0.31 0.00 0.00 61.69 63.17 2bhn s THR 226 Cb 0.00 -3.87 0.30 0.00 0.01 0.00 0.00 72.50 68.93 2bhn s THR 226 CO 0.00 0.09 0.93 -2.65 -0.69 0.00 0.00 174.62 172.30 2bhn n PRO 227 N 4.07 -3.46 -4.52 4.92 -0.02 -1.26 -4.97 135.00 129.76 2bhn n PRO 227 Ca 0.10 -1.50 -0.32 0.00 -2.02 0.00 0.00 63.50 59.76 2bhn n PRO 227 Cb 0.46 -1.55 -0.11 0.00 -0.02 0.00 0.00 33.50 32.27 2bhn n PRO 227 CO 0.00 0.00 0.00 -0.47 1.98 0.00 0.00 175.50 177.01 2bhn s TYR 228 N -2.55 2.81 -2.32 6.00 5.04 -1.26 -5.19 117.35 119.88 2bhn s TYR 228 Ca 0.63 -0.09 0.29 0.00 -2.44 0.00 0.00 57.07 55.46 2bhn s TYR 228 Cb -0.08 -1.58 1.36 0.00 0.35 0.00 0.00 41.96 42.02 2bhn s TYR 228 CO 0.50 0.34 1.92 0.36 -1.34 0.00 0.00 175.55 177.33