#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1biz n GLY 59 N 0.00 4.66 3.66 -1.23 0.00 -1.26 -4.87 105.19 106.15 1biz n GLY 59 Ca 0.00 -1.01 -0.37 0.00 0.00 0.00 0.00 46.02 44.64 1biz n GLY 59 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1biz s ILE 60 N -2.66 5.30 0.30 -0.61 1.09 -1.26 -0.84 121.20 122.51 1biz s ILE 60 Ca 0.29 0.36 0.05 0.00 -1.10 0.00 0.00 60.65 60.25 1biz s ILE 60 Cb 0.25 -3.58 -0.06 0.00 -1.06 0.00 0.00 42.46 38.01 1biz s ILE 60 CO 0.03 0.30 -0.01 0.26 -0.10 0.00 0.00 174.94 175.42 1biz s TRP 61 N 1.22 1.98 -0.05 3.97 0.52 0.10 -2.86 118.94 123.82 1biz s TRP 61 Ca 0.11 -0.80 0.03 0.00 0.02 0.00 0.00 56.10 55.46 1biz s TRP 61 Cb -0.14 -1.21 0.01 0.00 -1.15 0.00 0.00 33.47 30.97 1biz s TRP 61 CO 0.06 0.18 -0.12 -1.14 0.02 0.00 0.00 176.95 175.95 1biz s GLN 62 N -3.79 1.41 -0.07 4.98 2.00 -0.32 -0.38 119.66 123.49 1biz s GLN 62 Ca 0.32 -0.40 0.02 0.00 -2.00 0.00 0.00 55.36 53.30 1biz s GLN 62 Cb 0.06 -1.23 0.02 0.00 0.80 0.00 0.00 33.01 32.66 1biz s GLN 62 CO 0.13 0.10 -0.11 -1.17 -0.50 0.00 0.00 175.29 173.75 1biz s LEU 63 N 0.38 1.56 0.21 3.68 2.96 0.26 -0.71 118.68 127.02 1biz s LEU 63 Ca -0.08 -0.27 -0.10 0.00 -0.22 0.00 0.00 54.13 53.46 1biz s LEU 63 Cb -0.12 -0.77 -0.01 0.00 0.50 0.00 0.00 46.19 45.79 1biz s LEU 63 CO 0.02 0.01 0.37 -1.81 -1.32 0.00 0.00 176.35 173.62 1biz s ASP 64 N 0.79 -0.02 0.08 3.68 1.01 -0.66 -4.35 116.67 117.20 1biz s ASP 64 Ca -0.12 -0.96 0.10 0.00 0.71 0.00 0.00 52.55 52.27 1biz s ASP 64 Cb -0.15 0.51 -0.03 0.00 1.01 0.00 0.00 42.92 44.25 1biz s ASP 64 CO 0.02 -1.02 -0.26 0.00 0.21 0.00 0.00 175.17 174.12 1biz s THR 66 N -0.90 0.51 -0.05 0.00 -1.32 -0.16 -4.95 115.64 108.77 1biz s THR 66 Ca 0.12 -1.89 0.05 0.00 -1.21 0.00 0.00 61.69 58.76 1biz s THR 66 Cb -0.10 -1.66 -0.02 0.00 -1.51 0.00 0.00 72.50 69.21 1biz s THR 66 CO 0.03 -0.89 -0.20 -1.00 -2.21 0.00 0.00 174.62 170.36 1biz s HIS 67 N -3.74 2.55 -0.14 9.09 3.76 -1.26 -0.05 115.29 125.50 1biz s HIS 67 Ca 0.11 -0.42 -0.08 0.00 -0.15 0.00 0.00 55.06 54.52 1biz s HIS 67 Cb 0.06 -1.61 0.05 0.00 1.11 0.00 0.00 32.58 32.20 1biz s HIS 67 CO -0.06 -0.01 0.34 -1.17 -0.85 0.00 0.00 174.74 172.99 1biz s LEU 68 N -0.45 0.16 -1.54 0.89 0.20 -0.46 -4.91 118.68 112.58 1biz s LEU 68 Ca 0.05 0.74 -0.14 0.00 0.69 0.00 0.00 54.13 55.47 1biz s LEU 68 Cb -0.12 1.11 0.09 0.00 -0.43 0.00 0.00 46.19 46.85 1biz s LEU 68 CO 0.01 -0.18 0.91 -0.62 -0.29 0.00 0.00 176.35 176.19 1biz n GLU 69 N 4.12 -5.05 -1.30 1.98 1.02 -1.26 -0.41 120.64 119.74 1biz n GLU 69 Ca -0.23 0.57 -0.10 0.00 -0.02 0.00 0.00 57.16 57.38 1biz n GLU 69 Cb 0.55 -5.43 -0.04 0.00 -0.02 0.00 0.00 31.44 26.49 1biz n GLU 69 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1biz n GLY 70 N -1.61 1.13 3.45 0.62 0.00 -1.26 -4.99 105.19 102.53 1biz n GLY 70 Ca 0.04 -0.33 -0.24 0.00 0.00 0.00 0.00 46.02 45.49 1biz n GLY 70 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1biz s LYS 71 N -2.71 1.63 -0.17 1.61 1.02 0.45 -5.07 119.74 116.50 1biz s LYS 71 Ca 0.00 -1.73 -0.06 0.00 0.02 0.00 0.00 55.97 54.20 1biz s LYS 71 Cb 0.00 -1.70 -0.03 0.00 -0.52 0.00 0.00 37.83 35.58 1biz s LYS 71 CO 0.00 0.32 0.02 0.08 -0.92 0.00 0.00 175.35 174.85 1biz s VAL 72 N -2.50 4.37 -0.26 3.17 1.01 -1.22 -1.35 120.40 123.61 1biz s VAL 72 Ca 0.28 -0.18 -0.03 0.00 0.00 0.00 0.00 61.98 62.05 1biz s VAL 72 Cb -0.05 -2.95 0.02 0.00 0.00 0.00 0.00 36.38 33.40 1biz s VAL 72 CO 0.14 0.47 -0.01 -0.63 0.00 0.00 0.00 175.10 175.07 1biz s ILE 73 N 0.40 3.27 -0.38 2.22 1.01 0.93 -0.77 121.20 127.87 1biz s ILE 73 Ca -0.00 -0.88 -0.23 0.00 0.00 0.00 0.00 60.65 59.54 1biz s ILE 73 Cb -0.13 -2.66 0.01 0.00 0.01 0.00 0.00 42.46 39.69 1biz s ILE 73 CO 0.01 0.18 0.78 -0.22 0.00 0.00 0.00 174.94 175.69 1biz s LEU 74 N 1.39 4.15 -0.22 2.97 2.96 0.72 -0.99 118.68 129.67 1biz s LEU 74 Ca 0.01 0.29 -0.04 0.00 -0.22 0.00 0.00 54.13 54.17 1biz s LEU 74 Cb -0.17 -3.01 -0.01 0.00 0.50 0.00 0.00 46.19 43.50 1biz s LEU 74 CO -0.02 -0.76 -0.04 -0.69 -1.32 0.00 0.00 176.35 173.52 1biz s VAL 75 N 3.12 3.39 -0.16 1.68 1.01 0.65 -1.54 120.40 128.55 1biz s VAL 75 Ca 0.31 -0.49 -0.03 0.00 0.00 0.00 0.00 61.98 61.77 1biz s VAL 75 Cb -0.13 -2.54 -0.02 0.00 0.00 0.00 0.00 36.38 33.69 1biz s VAL 75 CO 0.18 0.43 -0.05 0.00 0.00 0.00 0.00 175.10 175.66 1biz s ALA 76 N 1.42 2.94 -0.10 5.51 0.00 0.23 -1.65 121.76 130.10 1biz s ALA 76 Ca 0.05 -0.87 0.04 0.00 0.00 0.00 0.00 51.96 51.17 1biz s ALA 76 Cb -0.14 -1.54 0.00 0.00 0.00 0.00 0.00 23.12 21.44 1biz s ALA 76 CO -0.03 0.14 -0.22 0.08 0.00 0.00 0.00 175.76 175.72 1biz s VAL 77 N 0.50 1.96 -0.69 0.00 1.01 0.11 -1.35 120.40 121.94 1biz s VAL 77 Ca -0.04 -0.95 -0.25 0.00 0.00 0.00 0.00 61.98 60.74 1biz s VAL 77 Cb -0.14 -1.71 0.05 0.00 0.00 0.00 0.00 36.38 34.58 1biz s VAL 77 CO 0.03 0.54 1.10 -2.28 0.00 0.00 0.00 175.10 174.49 1biz s HIS 78 N 0.46 2.51 0.27 5.22 2.46 -0.01 -1.18 115.29 125.01 1biz s HIS 78 Ca -0.17 -0.31 -0.04 0.00 0.47 0.00 0.00 55.06 55.02 1biz s HIS 78 Cb -0.17 -4.43 0.55 0.00 -0.13 0.00 0.00 32.58 28.40 1biz s HIS 78 CO 0.07 -1.82 1.61 0.28 -2.47 0.00 0.00 174.74 172.41 1biz h VAL 79 N 6.00 0.22 -0.22 0.89 2.07 -1.84 0.15 116.25 123.52 1biz h VAL 79 Ca -0.28 -0.03 -0.10 0.00 0.82 0.00 0.00 66.70 67.11 1biz h VAL 79 Cb 1.06 0.13 -0.01 0.00 -1.52 0.00 0.00 31.29 30.95 1biz h VAL 79 CO 1.22 0.01 -0.29 0.00 0.02 0.00 0.00 177.57 178.54 1biz h ALA 80 N 1.82 1.11 0.00 1.67 0.00 -1.91 -3.34 119.26 118.61 1biz h ALA 80 Ca 0.48 -0.36 -0.33 0.00 0.00 0.00 0.00 54.91 54.71 1biz h ALA 80 Cb 0.90 -0.11 -0.06 0.00 0.00 0.00 0.00 17.79 18.52 1biz h ALA 80 CO -0.77 0.56 -2.25 -1.13 0.00 0.00 0.00 179.25 175.66 1biz n SER 81 N -4.11 0.86 0.00 0.00 3.41 -0.96 -5.00 113.62 107.83 1biz n SER 81 Ca -0.01 -0.02 0.00 0.00 -0.26 0.00 0.00 58.87 58.58 1biz n SER 81 Cb 0.42 0.71 0.00 0.00 -0.26 0.00 0.00 64.21 65.08 1biz n SER 81 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1biz n GLY 82 N 1.98 0.62 3.78 5.00 0.00 0.48 -4.60 105.19 112.44 1biz n GLY 82 Ca -0.31 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.30 1biz n GLY 82 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1biz s TYR 83 N -2.26 2.71 0.09 1.61 5.04 -1.24 -4.76 117.35 118.53 1biz s TYR 83 Ca 0.00 1.25 0.09 0.00 -2.44 0.00 0.00 57.07 55.97 1biz s TYR 83 Cb 0.00 -3.91 -0.03 0.00 0.35 0.00 0.00 41.96 38.37 1biz s TYR 83 CO 0.00 -2.65 -0.24 0.42 -1.34 0.00 0.00 175.55 171.74 1biz s ILE 84 N -1.14 2.01 -0.03 3.14 1.01 -1.26 -0.83 121.20 124.10 1biz s ILE 84 Ca 0.52 -1.51 -0.00 0.00 0.00 0.00 0.00 60.65 59.66 1biz s ILE 84 Cb -0.44 -1.76 0.03 0.00 0.01 0.00 0.00 42.46 40.29 1biz s ILE 84 CO 0.59 0.16 0.02 -0.70 0.00 0.00 0.00 174.94 175.01 1biz s GLU 85 N -1.64 0.11 0.15 2.79 2.12 -0.46 -4.93 118.70 116.84 1biz s GLU 85 Ca 0.11 0.16 0.01 0.00 0.36 0.00 0.00 54.97 55.60 1biz s GLU 85 Cb -0.10 -0.38 -0.04 0.00 0.26 0.00 0.00 34.13 33.87 1biz s GLU 85 CO 0.04 -0.17 0.02 0.00 -0.54 0.00 0.00 175.26 174.61 1biz s ALA 86 N 1.17 1.15 -0.23 6.30 0.00 -1.26 -0.60 121.76 128.29 1biz s ALA 86 Ca -0.08 -1.54 -0.20 0.00 0.00 0.00 0.00 51.96 50.15 1biz s ALA 86 Cb -0.13 0.66 0.06 0.00 0.00 0.00 0.00 23.12 23.71 1biz s ALA 86 CO -0.03 -0.38 0.59 -2.00 0.00 0.00 0.00 175.76 173.94 1biz s GLU 87 N -3.97 0.68 -0.18 0.00 2.56 -0.59 -4.95 118.70 112.25 1biz s GLU 87 Ca 0.23 0.86 -0.16 0.00 0.00 0.00 0.00 54.97 55.91 1biz s GLU 87 Cb 0.07 0.30 -0.04 0.00 2.00 0.00 0.00 34.13 36.45 1biz s GLU 87 CO 0.03 -0.09 0.38 0.08 -0.56 0.00 0.00 175.26 175.09 1biz s VAL 88 N 0.51 5.23 0.27 3.70 1.01 -1.26 -0.20 120.40 129.66 1biz s VAL 88 Ca -0.02 0.70 0.11 0.00 0.00 0.00 0.00 61.98 62.77 1biz s VAL 88 Cb -0.04 -3.71 -0.05 0.00 0.00 0.00 0.00 36.38 32.57 1biz s VAL 88 CO -0.02 0.30 -0.18 0.27 0.00 0.00 0.00 175.10 175.47 1biz s ILE 89 N 0.99 2.32 0.17 2.22 -4.36 0.05 -4.98 121.20 117.60 1biz s ILE 89 Ca 0.19 -2.36 -0.14 0.00 -0.26 0.00 0.00 60.65 58.08 1biz s ILE 89 Cb -0.14 -2.28 0.06 0.00 1.25 0.00 0.00 42.46 41.35 1biz s ILE 89 CO 0.07 -0.42 1.75 -0.65 0.24 0.00 0.00 174.94 175.93 1biz h PRO 90 N 2.30 0.29 -2.36 0.37 0.11 -1.98 -3.24 132.00 127.50 1biz h PRO 90 Ca -0.40 -0.02 0.12 0.00 0.11 0.00 0.00 66.00 65.81 1biz h PRO 90 Cb 1.25 -0.07 -0.13 0.00 0.11 0.00 0.00 31.00 32.16 1biz h PRO 90 CO 0.61 0.19 0.47 0.00 -0.21 0.00 0.00 178.00 179.06 1biz s ALA 91 N -6.15 -1.76 -0.49 -0.75 0.00 -1.26 -4.62 121.76 106.74 1biz s ALA 91 Ca -0.13 0.75 -0.27 0.00 0.00 0.00 0.00 51.96 52.31 1biz s ALA 91 Cb 0.13 0.51 -0.02 0.00 0.00 0.00 0.00 23.12 23.74 1biz s ALA 91 CO 0.72 -0.78 1.88 -1.21 0.00 0.00 0.00 175.76 176.37 1biz s GLU 92 N -3.22 2.87 0.09 0.00 2.02 -1.26 -4.88 118.70 114.32 1biz s GLU 92 Ca 0.06 1.01 0.02 0.00 0.02 0.00 0.00 54.97 56.08 1biz s GLU 92 Cb -0.01 -4.33 -0.04 0.00 0.10 0.00 0.00 34.13 29.85 1biz s GLU 92 CO -0.07 -2.42 -0.07 0.95 0.02 0.00 0.00 175.26 173.68 1biz s THR 93 N 8.45 0.66 0.27 3.63 -4.23 -1.26 -5.04 115.64 118.11 1biz s THR 93 Ca 0.75 -1.77 -0.04 0.00 -1.18 0.00 0.00 61.69 59.44 1biz s THR 93 Cb -0.17 -1.48 0.23 0.00 1.34 0.00 0.00 72.50 72.43 1biz s THR 93 CO 0.26 -0.78 1.91 1.23 -0.54 0.00 0.00 174.62 176.70 1biz h GLY 94 N 3.26 1.24 0.68 3.99 0.00 -1.93 -2.46 103.07 107.86 1biz h GLY 94 Ca -0.35 -0.52 0.04 0.00 0.00 0.00 0.00 47.33 46.49 1biz h GLY 94 CO 0.60 0.51 0.05 1.46 0.00 0.00 0.00 176.54 179.16 1biz h GLN 95 N 1.18 0.14 -0.57 4.80 1.08 -1.96 0.03 115.11 119.81 1biz h GLN 95 Ca 0.31 -0.01 -0.04 0.00 -1.45 0.00 0.00 58.65 57.45 1biz h GLN 95 Cb -0.03 -0.03 -0.02 0.00 -0.05 0.00 0.00 27.48 27.34 1biz h GLN 95 CO -0.06 0.09 0.20 0.93 -0.95 0.00 0.00 178.83 179.04 1biz h GLU 96 N 0.15 0.88 -0.48 1.46 4.39 -1.84 -0.47 114.58 118.67 1biz h GLU 96 Ca 0.12 -0.18 -0.03 0.00 0.34 0.00 0.00 59.36 59.62 1biz h GLU 96 Cb 0.13 -0.13 -0.02 0.00 -0.10 0.00 0.00 28.75 28.63 1biz h GLU 96 CO -0.17 0.78 0.19 1.15 -1.16 0.00 0.00 179.01 179.80 1biz h THR 97 N 0.80 1.21 -0.18 1.13 2.02 -1.16 -0.44 112.91 116.30 1biz h THR 97 Ca 0.19 -0.66 -0.00 0.00 0.77 0.00 0.00 66.41 66.71 1biz h THR 97 Cb 0.26 0.74 -0.01 0.00 -1.74 0.00 0.00 68.15 67.40 1biz h THR 97 CO -0.01 0.25 0.11 0.00 0.37 0.00 0.00 175.52 176.24 1biz h ALA 98 N 1.04 0.23 -0.45 6.16 0.00 -0.77 -0.85 119.26 124.61 1biz h ALA 98 Ca 0.16 -0.03 0.01 0.00 0.00 0.00 0.00 54.91 55.05 1biz h ALA 98 Cb 0.20 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 17.89 1biz h ALA 98 CO -0.01 -0.26 0.28 -0.92 0.00 0.00 0.00 179.25 178.34 1biz h TYR 99 N 0.22 0.53 -0.21 0.00 3.20 -0.93 -1.94 116.97 117.84 1biz h TYR 99 Ca 0.07 0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.95 1biz h TYR 99 Cb 0.02 -0.18 -0.01 0.00 1.54 0.00 0.00 36.73 38.10 1biz h TYR 99 CO -0.05 0.32 0.13 0.35 -1.64 0.00 0.00 178.16 177.27 1biz h PHE 100 N 0.57 0.26 -0.93 -3.82 3.57 -0.81 -2.26 116.94 113.54 1biz h PHE 100 Ca 0.17 0.00 0.05 0.00 3.53 0.00 0.00 57.97 61.73 1biz h PHE 100 Cb -0.03 -0.09 -0.06 0.00 2.79 0.00 0.00 35.95 38.57 1biz h PHE 100 CO -0.06 0.18 0.59 -0.07 -2.23 0.00 0.00 178.31 176.73 1biz h LEU 101 N 0.27 0.96 -0.72 0.59 3.38 -0.89 -0.67 115.31 118.23 1biz h LEU 101 Ca 0.07 0.01 -0.01 0.00 0.09 0.00 0.00 57.88 58.04 1biz h LEU 101 Cb -0.01 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 40.51 1biz h LEU 101 CO -0.02 0.63 0.40 -0.07 0.09 0.00 0.00 178.44 179.47 1biz h LEU 102 N 1.10 0.90 0.18 1.67 3.38 -0.95 0.20 115.31 121.79 1biz h LEU 102 Ca 0.39 -0.09 -0.01 0.00 0.09 0.00 0.00 57.88 58.26 1biz h LEU 102 Cb 0.11 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 40.63 1biz h LEU 102 CO -0.15 0.73 -0.09 0.11 0.09 0.00 0.00 178.44 179.14 1biz h LYS 103 N 0.99 -0.23 -0.49 1.13 1.57 -0.79 -2.07 116.57 116.68 1biz h LYS 103 Ca 0.25 0.02 0.07 0.00 -1.87 0.00 0.00 60.65 59.12 1biz h LYS 103 Cb 0.03 0.05 -0.06 0.00 0.08 0.00 0.00 32.23 32.33 1biz h LYS 103 CO -0.04 -0.06 0.14 1.25 -0.57 0.00 0.00 179.45 180.17 1biz h LEU 104 N -0.36 0.10 -0.57 2.94 5.85 -0.92 -2.80 115.31 119.56 1biz h LEU 104 Ca -0.02 0.07 0.00 0.00 0.84 0.00 0.00 57.88 58.77 1biz h LEU 104 Cb 0.28 0.07 -0.03 0.00 0.37 0.00 0.00 40.66 41.35 1biz h LEU 104 CO 0.04 0.09 0.37 0.00 -0.34 0.00 0.00 178.44 178.60 1biz h ALA 105 N 1.35 0.72 0.00 1.25 0.00 -0.87 -0.81 119.26 120.90 1biz h ALA 105 Ca 0.24 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.10 1biz h ALA 105 Cb 0.28 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.84 1biz h ALA 105 CO -0.27 0.16 0.00 0.41 0.00 0.00 0.00 179.25 179.55 1biz n GLY 106 N -1.24 -0.91 0.23 0.00 0.00 -0.79 -3.69 105.19 98.79 1biz n GLY 106 Ca 0.04 -0.09 -0.24 0.00 0.00 0.00 0.00 46.02 45.73 1biz n GLY 106 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1biz n ARG 107 N -1.29 0.52 -4.49 1.61 0.63 -0.72 -5.05 116.66 107.87 1biz n ARG 107 Ca 0.09 0.21 -0.23 0.00 -0.92 0.00 0.00 57.85 56.99 1biz n ARG 107 Cb 0.15 -1.37 -0.11 0.00 0.45 0.00 0.00 32.46 31.58 1biz n ARG 107 CO 0.00 0.00 0.00 -1.58 -2.51 0.00 0.00 177.63 173.54 1biz s TRP 108 N -2.44 2.14 -0.89 -0.14 0.52 -0.39 -5.07 118.94 112.67 1biz s TRP 108 Ca -0.33 -0.75 -0.23 0.00 0.02 0.00 0.00 56.10 54.81 1biz s TRP 108 Cb 0.12 -1.35 0.06 0.00 -1.15 0.00 0.00 33.47 31.15 1biz s TRP 108 CO 0.44 0.27 1.29 -1.25 0.02 0.00 0.00 176.95 177.71 1biz s PRO 109 N -3.76 3.43 -0.34 4.98 0.04 -1.26 -4.49 135.00 133.60 1biz s PRO 109 Ca 0.33 -0.98 -0.18 0.00 0.04 0.00 0.00 61.00 60.21 1biz s PRO 109 Cb 0.07 -4.84 -0.00 0.00 0.04 0.00 0.00 34.50 29.76 1biz s PRO 109 CO 0.15 -2.07 0.53 0.08 0.04 0.00 0.00 177.00 175.73 1biz s VAL 110 N 4.64 5.01 -0.13 -0.36 1.01 -1.26 -4.27 120.40 125.04 1biz s VAL 110 Ca 0.38 0.41 0.02 0.00 0.00 0.00 0.00 61.98 62.78 1biz s VAL 110 Cb -0.05 -3.96 -0.09 0.00 0.00 0.00 0.00 36.38 32.27 1biz s VAL 110 CO -0.01 -0.20 -0.11 0.29 0.00 0.00 0.00 175.10 175.07 1biz n LYS 111 N 5.76 0.46 -4.07 2.72 4.76 -0.02 -4.52 118.16 123.25 1biz n LYS 111 Ca -0.04 0.07 -0.17 0.00 -2.87 0.00 0.00 58.31 55.30 1biz n LYS 111 Cb 0.49 -1.27 -0.15 0.00 -1.84 0.00 0.00 35.03 32.26 1biz n LYS 111 CO 0.00 0.00 0.00 0.99 -1.37 0.00 0.00 177.40 177.02 1biz s THR 112 N -2.27 0.33 -0.17 -0.18 2.01 -0.71 -0.40 115.64 114.25 1biz s THR 112 Ca -0.17 -0.09 0.00 0.00 0.31 0.00 0.00 61.69 61.74 1biz s THR 112 Cb 0.05 -0.34 0.03 0.00 0.01 0.00 0.00 72.50 72.25 1biz s THR 112 CO 0.32 0.14 -0.12 -0.69 -0.69 0.00 0.00 174.62 173.58 1biz s VAL 113 N 0.43 1.55 0.54 3.82 1.01 -0.26 -0.72 120.40 126.76 1biz s VAL 113 Ca -0.05 -0.78 0.01 0.00 0.00 0.00 0.00 61.98 61.17 1biz s VAL 113 Cb -0.08 -1.55 0.03 0.00 0.00 0.00 0.00 36.38 34.78 1biz s VAL 113 CO -0.01 0.31 0.76 -1.00 0.00 0.00 0.00 175.10 175.17 1biz s HIS 114 N 1.47 2.91 0.18 5.22 3.76 0.49 -3.97 115.29 125.34 1biz s HIS 114 Ca 0.02 0.02 -0.23 0.00 -0.15 0.00 0.00 55.06 54.72 1biz s HIS 114 Cb -0.14 -2.69 0.06 0.00 1.11 0.00 0.00 32.58 30.91 1biz s HIS 114 CO -0.09 -0.81 0.64 -0.08 -0.85 0.00 0.00 174.74 173.55 1biz s THR 115 N -2.73 0.00 -1.30 1.30 -1.32 -1.26 -0.57 115.64 109.76 1biz s THR 115 Ca 0.56 -0.24 0.22 0.00 -1.21 0.00 0.00 61.69 61.02 1biz s THR 115 Cb -0.10 -1.25 -0.12 0.00 -1.51 0.00 0.00 72.50 69.52 1biz s THR 115 CO 0.38 0.00 1.05 0.47 -2.21 0.00 0.00 174.62 174.32 1biz n ASP 116 N -0.40 1.19 -3.67 8.08 8.00 -1.26 -4.67 116.55 123.82 1biz n ASP 116 Ca -0.14 -1.02 -0.29 0.00 0.71 0.00 0.00 54.79 54.05 1biz n ASP 116 Cb 0.63 0.72 -0.13 0.00 -0.02 0.00 0.00 41.12 42.33 1biz n ASP 116 CO 0.00 0.00 0.00 0.21 -0.39 0.00 0.00 177.20 177.02 1biz s ASN 117 N -2.84 3.53 0.43 -2.24 3.04 -1.26 -5.00 114.94 110.59 1biz s ASN 117 Ca 0.12 -2.53 0.17 0.00 0.04 0.00 0.00 52.86 50.65 1biz s ASN 117 Cb 0.17 -0.92 1.07 0.00 -1.54 0.00 0.00 41.25 40.03 1biz s ASN 117 CO 0.75 -0.28 1.91 1.23 -3.04 0.00 0.00 177.10 177.68 1biz h GLY 118 N 6.80 0.71 1.86 1.21 0.00 -1.99 -1.07 103.07 110.59 1biz h GLY 118 Ca 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 47.33 47.16 1biz h GLY 118 CO 0.44 0.05 0.07 1.48 0.00 0.00 0.00 176.54 178.58 1biz h SER 119 N 0.40 0.00 -0.60 0.19 4.64 -2.00 -0.90 113.55 115.28 1biz h SER 119 Ca 0.39 0.00 0.08 0.00 -0.47 0.00 0.00 61.79 61.79 1biz h SER 119 Cb 0.93 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.98 1biz h SER 119 CO -0.13 0.00 0.40 0.78 -0.87 0.00 0.00 176.83 177.01 1biz h ASN 120 N 0.00 0.44 -0.56 4.97 2.35 -1.63 -2.61 115.58 118.54 1biz h ASN 120 Ca 0.00 0.01 0.00 0.00 -0.55 0.00 0.00 56.30 55.76 1biz h ASN 120 Cb 0.14 -0.09 0.00 0.00 0.05 0.00 0.00 38.32 38.42 1biz h ASN 120 CO -0.00 0.28 0.00 0.49 -1.65 0.00 0.00 177.43 176.55 1biz n PHE 121 N -4.48 1.71 0.06 1.19 3.72 -0.34 -4.54 117.46 114.79 1biz n PHE 121 Ca 0.09 -0.62 -0.01 0.00 -0.05 0.00 0.00 57.45 56.86 1biz n PHE 121 Cb 0.30 -0.38 -0.06 0.00 -0.94 0.00 0.00 39.48 38.40 1biz n PHE 121 CO 0.00 0.00 0.00 1.79 -0.05 0.00 0.00 176.76 178.50 1biz h THR 122 N 3.74 0.80 -4.10 4.37 1.35 -1.59 -3.41 112.91 114.06 1biz h THR 122 Ca 0.00 -2.31 -0.56 0.00 -0.55 0.00 0.00 66.41 62.99 1biz h THR 122 Cb 1.67 2.29 0.15 0.00 -1.73 0.00 0.00 68.15 70.54 1biz h THR 122 CO 0.36 0.46 0.53 -0.94 -0.25 0.00 0.00 175.52 175.67 1biz s SER 123 N -6.14 4.72 0.51 5.36 1.04 -1.26 -4.84 113.70 113.09 1biz s SER 123 Ca -0.00 2.63 0.28 0.00 0.48 0.00 0.00 55.95 59.34 1biz s SER 123 Cb 0.08 -2.62 1.32 0.00 0.10 0.00 0.00 66.02 64.90 1biz s SER 123 CO 0.79 -1.93 1.99 0.71 0.98 0.00 0.00 173.24 175.79 1biz h THR 124 N 0.69 0.45 -0.13 2.02 1.35 -1.99 -1.37 112.91 113.93 1biz h THR 124 Ca -0.51 -0.70 -0.19 0.00 -0.55 0.00 0.00 66.41 64.46 1biz h THR 124 Cb 1.33 1.49 -0.00 0.00 -1.73 0.00 0.00 68.15 69.24 1biz h THR 124 CO 0.54 0.13 -0.69 0.71 -0.25 0.00 0.00 175.52 175.96 1biz h THR 125 N 0.00 1.34 -0.14 6.82 1.35 -1.91 -1.35 112.91 119.01 1biz h THR 125 Ca -0.00 -2.00 -0.11 0.00 -0.55 0.00 0.00 66.41 63.75 1biz h THR 125 Cb 0.48 1.98 0.00 0.00 -1.73 0.00 0.00 68.15 68.88 1biz h THR 125 CO 0.02 0.62 -0.34 0.58 -0.25 0.00 0.00 175.52 176.14 1biz h VAL 126 N 0.39 1.36 -0.73 6.82 2.07 -1.65 -1.59 116.25 122.92 1biz h VAL 126 Ca -0.02 -1.61 0.04 0.00 0.82 0.00 0.00 66.70 65.92 1biz h VAL 126 Cb 1.27 2.02 -0.05 0.00 -1.52 0.00 0.00 31.29 33.02 1biz h VAL 126 CO 0.13 0.48 0.45 0.11 0.02 0.00 0.00 177.57 178.77 1biz h LYS 127 N 0.10 0.85 -0.63 1.57 1.57 -1.26 0.25 116.57 119.02 1biz h LYS 127 Ca -0.00 -0.05 -0.08 0.00 -1.87 0.00 0.00 60.65 58.65 1biz h LYS 127 Cb 0.95 -0.19 -0.02 0.00 0.08 0.00 0.00 32.23 33.04 1biz h LYS 127 CO 0.07 0.56 0.09 0.00 -0.57 0.00 0.00 179.45 179.61 1biz h ALA 128 N 1.32 0.84 -0.13 3.86 0.00 -1.21 0.44 119.26 124.38 1biz h ALA 128 Ca 0.30 -0.27 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 1biz h ALA 128 Cb 0.05 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 1biz h ALA 128 CO -0.12 0.60 0.04 0.00 0.00 0.00 0.00 179.25 179.77 1biz h ALA 129 N 1.03 0.17 -0.74 0.00 0.00 -0.75 -0.12 119.26 118.84 1biz h ALA 129 Ca 0.19 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.97 1biz h ALA 129 Cb 0.45 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 18.15 1biz h ALA 129 CO 0.01 -0.21 0.46 0.00 0.00 0.00 0.00 179.25 179.52 1biz h TRP 131 N 1.00 0.08 -0.51 0.00 7.01 -0.77 0.38 115.95 123.14 1biz h TRP 131 Ca 0.27 -0.01 0.00 0.00 2.11 0.00 0.00 58.89 61.26 1biz h TRP 131 Cb -0.07 -0.02 -0.03 0.00 -2.10 0.00 0.00 29.16 26.94 1biz h TRP 131 CO -0.02 0.21 0.32 2.35 -2.79 0.00 0.00 178.44 178.52 1biz h TRP 132 N -0.08 0.67 0.00 2.65 7.01 -0.72 -2.75 115.95 122.73 1biz h TRP 132 Ca 0.02 0.01 0.00 0.00 2.11 0.00 0.00 58.89 61.02 1biz h TRP 132 Cb 0.17 -0.22 0.00 0.00 -2.10 0.00 0.00 29.16 27.01 1biz h TRP 132 CO -0.02 0.45 -0.15 0.00 -2.79 0.00 0.00 178.44 175.93 1biz n ALA 133 N -2.25 2.65 -2.37 2.65 0.00 -0.30 -4.94 120.51 115.94 1biz n ALA 133 Ca 0.03 -0.16 -0.02 0.00 0.00 0.00 0.00 53.44 53.28 1biz n ALA 133 Cb 0.04 -1.37 0.00 0.00 0.00 0.00 0.00 19.45 18.12 1biz n ALA 133 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1biz n GLY 134 N 1.47 0.58 3.82 0.00 0.00 0.11 -5.00 105.19 106.16 1biz n GLY 134 Ca 0.06 -0.68 -0.36 0.00 0.00 0.00 0.00 46.02 45.04 1biz n GLY 134 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1biz s ILE 135 N -2.63 5.21 0.29 -0.61 1.01 0.11 -4.73 121.20 119.84 1biz s ILE 135 Ca 0.03 0.10 0.11 0.00 0.00 0.00 0.00 60.65 60.89 1biz s ILE 135 Cb -0.02 -3.26 -0.05 0.00 0.01 0.00 0.00 42.46 39.14 1biz s ILE 135 CO 0.04 0.60 -0.14 -0.75 0.00 0.00 0.00 174.94 174.69 1biz s LYS 136 N -0.89 1.83 0.06 2.79 2.20 0.47 -4.43 119.74 121.78 1biz s LYS 136 Ca 0.14 -1.71 0.04 0.00 -0.36 0.00 0.00 55.97 54.08 1biz s LYS 136 Cb -0.12 -1.85 -0.03 0.00 -1.51 0.00 0.00 37.83 34.33 1biz s LYS 136 CO 0.03 0.31 -0.12 -1.14 -0.36 0.00 0.00 175.35 174.08 1biz s GLN 137 N -3.56 0.73 -0.48 4.03 -0.44 -1.26 -1.10 119.66 117.57 1biz s GLN 137 Ca 0.31 -0.91 -0.16 0.00 -2.50 0.00 0.00 55.36 52.10 1biz s GLN 137 Cb -0.04 -0.63 0.08 0.00 -1.64 0.00 0.00 33.01 30.77 1biz s GLN 137 CO 0.16 0.13 0.41 -2.00 0.50 0.00 0.00 175.29 174.49 1biz s GLU 138 N -1.77 2.98 -0.33 1.67 2.56 -1.25 -4.97 118.70 117.59 1biz s GLU 138 Ca -0.04 -1.38 -0.28 0.00 0.00 0.00 0.00 54.97 53.27 1biz s GLU 138 Cb -0.09 -4.15 -0.02 0.00 2.00 0.00 0.00 34.13 31.87 1biz s GLU 138 CO 0.02 -1.06 1.76 0.12 -0.56 0.00 0.00 175.26 175.54 1biz s PHE 139 N 1.65 1.87 0.00 5.30 2.19 -1.26 -4.87 117.98 122.86 1biz s PHE 139 Ca 0.04 0.62 0.00 0.00 0.33 0.00 0.00 56.93 57.92 1biz s PHE 139 Cb -0.25 -4.15 0.00 0.00 -1.31 0.00 0.00 43.02 37.31 1biz s PHE 139 CO 0.06 -2.88 0.00 0.41 1.83 0.00 0.00 175.22 174.64 1biz n GLY 140 N 5.38 -0.10 5.00 13.12 0.00 -1.26 -5.24 105.19 122.09 1biz n GLY 140 Ca 0.22 -0.62 0.00 0.00 0.00 0.00 0.00 46.02 45.63 1biz n GLY 140 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1biz n SER 153 N -0.04 0.00 -0.33 1.61 2.88 -1.26 -4.99 113.62 111.49 1biz n SER 153 Ca 0.00 0.00 0.03 0.00 -1.33 0.00 0.00 58.87 57.57 1biz n SER 153 Cb 0.00 0.00 0.10 0.00 -0.75 0.00 0.00 64.21 63.56 1biz n SER 153 CO 0.00 0.00 0.00 0.23 -1.23 0.00 0.00 175.04 174.04 1biz n MET 154 N 0.00 -0.12 -0.09 -1.46 2.00 -1.26 -0.00 117.12 116.19 1biz n MET 154 Ca 0.00 1.41 -0.10 0.00 0.00 0.00 0.00 57.70 59.01 1biz n MET 154 Cb 0.00 -2.11 -0.03 0.00 0.00 0.00 0.00 33.22 31.08 1biz n MET 154 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 175.97 175.06 1biz h ASN 155 N 0.00 0.39 0.04 7.83 2.35 -2.01 0.21 115.58 124.39 1biz h ASN 155 Ca 0.40 -0.17 -0.12 0.00 -0.55 0.00 0.00 56.30 55.85 1biz h ASN 155 Cb 0.63 -0.10 -0.01 0.00 0.05 0.00 0.00 38.32 38.88 1biz h ASN 155 CO -0.93 0.46 -0.40 0.50 -1.65 0.00 0.00 177.43 175.41 1biz h LYS 156 N 0.30 0.47 -0.23 0.81 3.64 -1.55 -2.74 116.57 117.27 1biz h LYS 156 Ca 0.09 -0.23 -0.08 0.00 -1.27 0.00 0.00 60.65 59.17 1biz h LYS 156 Cb 0.19 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.01 1biz h LYS 156 CO -0.01 0.79 -0.15 1.49 -2.27 0.00 0.00 179.45 179.30 1biz h GLU 157 N 0.39 0.50 -0.78 1.90 4.57 -0.24 -2.67 114.58 118.25 1biz h GLU 157 Ca 0.03 -0.24 0.03 0.00 -1.18 0.00 0.00 59.36 58.01 1biz h GLU 157 Cb 0.87 -0.00 -0.05 0.00 -0.16 0.00 0.00 28.75 29.41 1biz h GLU 157 CO 0.07 0.80 0.49 1.25 -1.18 0.00 0.00 179.01 180.45 1biz h LEU 158 N 0.21 0.81 -0.82 1.64 5.85 -0.48 -0.57 115.31 121.94 1biz h LEU 158 Ca 0.05 -0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.76 1biz h LEU 158 Cb 0.67 -0.17 -0.04 0.00 0.37 0.00 0.00 40.66 41.49 1biz h LEU 158 CO 0.04 0.55 0.51 0.11 -0.34 0.00 0.00 178.44 179.31 1biz h LYS 159 N 0.95 1.11 0.07 1.25 1.79 -1.44 0.27 116.57 120.58 1biz h LYS 159 Ca 0.31 -0.09 -0.00 0.00 -2.18 0.00 0.00 60.65 58.69 1biz h LYS 159 Cb 0.03 -0.24 0.00 0.00 -1.58 0.00 0.00 32.23 30.44 1biz h LYS 159 CO -0.12 0.77 -0.04 -0.22 -1.08 0.00 0.00 179.45 178.77 1biz h LYS 160 N 1.13 -0.10 -0.88 3.15 3.64 -0.93 -1.74 116.57 120.84 1biz h LYS 160 Ca 0.30 0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.68 1biz h LYS 160 Cb -0.06 0.02 -0.04 0.00 -0.41 0.00 0.00 32.23 31.74 1biz h LYS 160 CO -0.06 -0.04 0.53 0.82 -2.27 0.00 0.00 179.45 178.43 1biz h ILE 161 N -0.12 1.25 -0.37 2.00 2.04 -0.76 -1.20 117.51 120.35 1biz h ILE 161 Ca -0.01 -0.55 -0.02 0.00 1.00 0.00 0.00 64.86 65.28 1biz h ILE 161 Cb 0.10 0.01 -0.02 0.00 -0.74 0.00 0.00 36.82 36.17 1biz h ILE 161 CO 0.02 0.26 0.13 0.40 0.00 0.00 0.00 178.15 178.96 1biz h ILE 162 N 1.22 1.15 -0.24 -0.67 2.04 -0.76 -1.62 117.51 118.63 1biz h ILE 162 Ca 0.32 -0.49 -0.03 0.00 1.00 0.00 0.00 64.86 65.65 1biz h ILE 162 Cb -0.04 0.74 -0.01 0.00 -0.74 0.00 0.00 36.82 36.77 1biz h ILE 162 CO -0.06 0.19 0.02 1.23 0.00 0.00 0.00 178.15 179.53 1biz h GLY 163 N 0.70 0.44 1.69 5.37 0.00 -0.32 0.21 103.07 111.16 1biz h GLY 163 Ca 0.13 -0.31 -0.04 0.00 0.00 0.00 0.00 47.33 47.10 1biz h GLY 163 CO -0.01 0.29 -0.03 1.46 0.00 0.00 0.00 176.54 178.25 1biz h GLN 164 N 0.19 0.39 -0.00 4.80 4.20 -0.82 -2.99 115.11 120.89 1biz h GLN 164 Ca 0.07 -0.08 0.00 0.00 0.06 0.00 0.00 58.65 58.70 1biz h GLN 164 Cb 0.37 -0.06 0.00 0.00 0.30 0.00 0.00 27.48 28.09 1biz h GLN 164 CO 0.01 0.45 -0.77 0.28 -0.67 0.00 0.00 178.83 178.12 1biz n VAL 165 N -4.30 0.00 -0.21 -0.54 0.31 -0.66 -4.64 118.33 108.29 1biz n VAL 165 Ca 0.01 -0.03 0.01 0.00 -0.01 0.00 0.00 64.34 64.31 1biz n VAL 165 Cb 0.23 0.79 0.09 0.00 -0.91 0.00 0.00 33.84 34.04 1biz n VAL 165 CO 0.00 0.00 0.00 -0.09 -1.32 0.00 0.00 176.83 175.42 1biz h ARG 166 N 0.29 0.07 0.00 5.55 9.65 -0.42 0.81 114.38 130.34 1biz h ARG 166 Ca 0.00 -0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.88 1biz h ARG 166 Cb 0.52 -0.02 0.00 0.00 -1.39 0.00 0.00 29.97 29.09 1biz h ARG 166 CO 0.00 0.05 0.00 -0.40 2.80 0.00 0.00 179.97 182.42 1biz n ASP 167 N -5.33 0.00 -1.26 -3.80 5.75 -1.26 -2.70 116.55 107.95 1biz n ASP 167 Ca 0.09 -0.17 0.12 0.00 -0.01 0.00 0.00 54.79 54.82 1biz n ASP 167 Cb 0.35 -0.16 0.29 0.00 -1.03 0.00 0.00 41.12 40.57 1biz n ASP 167 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1biz n GLN 168 N -1.16 2.59 -3.85 0.11 6.02 0.28 -4.91 117.38 116.46 1biz n GLN 168 Ca 0.09 -2.46 -0.12 0.00 -0.01 0.00 0.00 57.00 54.50 1biz n GLN 168 Cb 0.09 -1.54 -0.11 0.00 1.02 0.00 0.00 30.24 29.70 1biz n GLN 168 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1biz s ALA 169 N -1.19 -0.35 -0.01 -1.58 0.00 -1.10 -5.00 121.76 112.54 1biz s ALA 169 Ca 0.45 0.08 -0.25 0.00 0.00 0.00 0.00 51.96 52.23 1biz s ALA 169 Cb 0.24 -0.03 -0.20 0.00 0.00 0.00 0.00 23.12 23.14 1biz s ALA 169 CO 0.32 -0.16 1.33 1.49 0.00 0.00 0.00 175.76 178.74 1biz h GLU 170 N 4.88 0.00 -6.30 0.00 4.57 -1.91 -3.46 114.58 112.36 1biz h GLU 170 Ca -0.29 -0.00 -0.63 0.00 -1.18 0.00 0.00 59.36 57.26 1biz h GLU 170 Cb 1.20 -0.00 -0.11 0.00 -0.16 0.00 0.00 28.75 29.68 1biz h GLU 170 CO 0.41 0.43 -0.64 -1.01 -1.18 0.00 0.00 179.01 177.01 1biz s HIS 171 N -4.50 3.01 0.29 0.92 3.76 -1.26 -5.02 115.29 112.49 1biz s HIS 171 Ca -0.16 -0.03 0.02 0.00 -0.15 0.00 0.00 55.06 54.74 1biz s HIS 171 Cb 0.02 -1.51 0.56 0.00 1.11 0.00 0.00 32.58 32.76 1biz s HIS 171 CO 0.67 0.50 1.86 1.25 -0.85 0.00 0.00 174.74 178.17 1biz h LEU 172 N 3.12 0.91 -0.31 0.89 5.85 -1.95 -2.30 115.31 121.51 1biz h LEU 172 Ca -0.47 0.03 0.05 0.00 0.84 0.00 0.00 57.88 58.33 1biz h LEU 172 Cb 1.18 -0.15 -0.08 0.00 0.37 0.00 0.00 40.66 41.98 1biz h LEU 172 CO 0.61 0.52 -0.52 0.11 -0.34 0.00 0.00 178.44 178.82 1biz h LYS 173 N 1.00 -0.43 -0.62 1.25 1.57 -1.97 0.14 116.57 117.50 1biz h LYS 173 Ca 0.46 0.03 0.06 0.00 -1.87 0.00 0.00 60.65 59.34 1biz h LYS 173 Cb 0.42 0.10 -0.06 0.00 0.08 0.00 0.00 32.23 32.77 1biz h LYS 173 CO -0.22 -0.28 0.32 1.15 -0.57 0.00 0.00 179.45 179.84 1biz h THR 174 N -0.44 0.92 -0.93 -0.16 2.02 -1.84 -1.23 112.91 111.25 1biz h THR 174 Ca 0.08 -0.20 -0.01 0.00 0.77 0.00 0.00 66.41 67.05 1biz h THR 174 Cb 0.62 0.28 -0.04 0.00 -1.74 0.00 0.00 68.15 67.27 1biz h THR 174 CO -0.54 0.11 0.55 0.00 0.37 0.00 0.00 175.52 176.01 1biz h ALA 175 N 1.35 1.22 -0.34 6.16 0.00 -1.03 -1.18 119.26 125.44 1biz h ALA 175 Ca 0.29 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 55.08 1biz h ALA 175 Cb 0.22 -0.37 -0.02 0.00 0.00 0.00 0.00 17.79 17.62 1biz h ALA 175 CO -0.20 0.66 0.19 0.28 0.00 0.00 0.00 179.25 180.18 1biz h VAL 176 N 1.28 1.13 -0.31 0.00 2.07 0.39 -0.07 116.25 120.75 1biz h VAL 176 Ca 0.33 -0.34 -0.08 0.00 0.82 0.00 0.00 66.70 67.43 1biz h VAL 176 Cb -0.04 0.74 -0.02 0.00 -1.52 0.00 0.00 31.29 30.45 1biz h VAL 176 CO -0.06 0.14 -0.13 1.56 0.02 0.00 0.00 177.57 179.09 1biz h GLN 177 N 0.43 0.54 -0.41 1.57 1.08 -0.99 -0.46 115.11 116.88 1biz h GLN 177 Ca 0.12 -0.16 -0.03 0.00 -1.45 0.00 0.00 58.65 57.13 1biz h GLN 177 Cb 0.05 -0.05 -0.02 0.00 -0.05 0.00 0.00 27.48 27.41 1biz h GLN 177 CO -0.02 0.67 0.14 0.52 -0.95 0.00 0.00 178.83 179.18 1biz h MET 178 N 0.50 0.64 -0.60 1.46 2.86 -0.81 -0.64 114.93 118.33 1biz h MET 178 Ca 0.09 -0.13 -0.05 0.00 -2.06 0.00 0.00 59.70 57.55 1biz h MET 178 Cb 0.53 -0.09 -0.03 0.00 0.06 0.00 0.00 31.60 32.07 1biz h MET 178 CO 0.03 0.63 0.19 0.00 1.06 0.00 0.00 176.91 178.82 1biz h ALA 179 N 0.98 1.20 -0.41 6.32 0.00 -0.59 -0.00 119.26 126.76 1biz h ALA 179 Ca 0.13 -0.19 -0.04 0.00 0.00 0.00 0.00 54.91 54.81 1biz h ALA 179 Cb 0.25 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 1biz h ALA 179 CO -0.01 0.56 0.09 0.28 0.00 0.00 0.00 179.25 180.18 1biz h VAL 180 N 0.88 1.23 -0.11 0.00 2.07 -0.71 -0.80 116.25 118.81 1biz h VAL 180 Ca 0.20 -0.82 0.02 0.00 0.82 0.00 0.00 66.70 66.92 1biz h VAL 180 Cb 0.26 0.99 -0.02 0.00 -1.52 0.00 0.00 31.29 30.99 1biz h VAL 180 CO -0.01 0.28 -0.03 0.15 0.02 0.00 0.00 177.57 177.99 1biz h PHE 181 N 0.52 -0.05 -0.59 1.57 3.04 -0.62 -0.24 116.94 120.57 1biz h PHE 181 Ca 0.13 0.01 0.05 0.00 3.98 0.00 0.00 57.97 62.14 1biz h PHE 181 Cb 0.33 0.04 -0.05 0.00 2.56 0.00 0.00 35.95 38.83 1biz h PHE 181 CO 0.02 -0.04 0.31 0.82 -2.02 0.00 0.00 178.31 177.40 1biz h ILE 182 N 0.00 0.95 0.07 1.41 1.08 -0.79 -1.67 117.51 118.57 1biz h ILE 182 Ca 0.05 -0.20 -0.00 0.00 -0.39 0.00 0.00 64.86 64.32 1biz h ILE 182 Cb 0.08 0.32 0.00 0.00 -3.07 0.00 0.00 36.82 34.14 1biz h ILE 182 CO -0.11 0.11 -0.03 -0.74 -0.69 0.00 0.00 178.15 176.69 1biz h HIS 183 N 0.59 -0.09 0.00 1.37 2.76 -0.62 -1.36 115.15 117.80 1biz h HIS 183 Ca 0.26 -0.00 -0.02 0.00 -2.20 0.00 0.00 60.37 58.41 1biz h HIS 183 Cb 0.17 0.03 -0.00 0.00 1.55 0.00 0.00 27.41 29.15 1biz h HIS 183 CO -0.09 0.04 -0.12 -0.91 -1.30 0.00 0.00 177.93 175.55 1biz h ASN 184 N -0.19 0.00 0.55 3.26 2.35 -0.81 -3.10 115.58 117.64 1biz h ASN 184 Ca -0.01 0.00 -0.05 0.00 -0.55 0.00 0.00 56.30 55.69 1biz h ASN 184 Cb 0.16 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.52 1biz h ASN 184 CO 0.02 0.12 -1.49 0.29 -1.65 0.00 0.00 177.43 174.71 1biz n LYS 185 N -3.41 0.63 -1.66 0.81 4.01 -0.65 -1.64 118.16 116.26 1biz n LYS 185 Ca -0.01 0.02 -0.46 0.00 -0.51 0.00 0.00 58.31 57.36 1biz n LYS 185 Cb 0.29 -1.70 -0.03 0.00 -0.51 0.00 0.00 35.03 33.07 1biz n LYS 185 CO 0.00 0.00 0.00 1.17 -1.11 0.00 0.00 177.40 177.46 1biz n LYS 186 N -2.58 1.92 -3.89 1.97 4.81 -0.52 -4.82 118.16 115.04 1biz n LYS 186 Ca -0.05 0.69 -0.36 0.00 -0.87 0.00 0.00 58.31 57.72 1biz n LYS 186 Cb 0.64 -2.35 -0.12 0.00 0.02 0.00 0.00 35.03 33.22 1biz n LYS 186 CO 0.00 0.00 0.00 1.03 1.17 0.00 0.00 177.40 179.60 1biz s ARG 187 N -0.04 3.69 -0.87 1.64 0.52 -1.26 -4.26 118.95 118.36 1biz s ARG 187 Ca 0.72 -0.47 -0.25 0.00 -0.52 0.00 0.00 55.73 55.21 1biz s ARG 187 Cb -0.70 -3.23 -0.03 0.00 0.52 0.00 0.00 34.95 31.52 1biz s ARG 187 CO 0.47 -0.06 1.84 -1.59 0.02 0.00 0.00 175.30 175.97 1biz s LYS 188 N 1.25 2.75 -0.85 3.54 0.00 -1.24 -4.91 119.74 120.27 1biz s LYS 188 Ca 0.04 -0.29 -0.26 0.00 0.00 0.00 0.00 55.97 55.46 1biz s LYS 188 Cb -0.15 -4.98 -0.14 0.00 0.00 0.00 0.00 37.83 32.56 1biz s LYS 188 CO 0.03 -3.07 2.32 0.20 0.00 0.00 0.00 175.35 174.83 1biz s GLY 189 N 7.43 -0.75 0.00 0.59 0.00 -1.26 -3.70 107.32 109.63 1biz s GLY 189 Ca 0.65 -0.98 0.00 0.00 0.00 0.00 0.00 44.72 44.39 1biz s GLY 189 CO 0.01 4.16 0.00 0.61 0.00 0.00 0.00 173.10 177.88 1biz n GLY 190 N 6.73 -0.63 3.74 0.20 0.00 -1.26 -5.06 105.19 108.92 1biz n GLY 190 Ca 0.45 -0.19 -0.42 0.00 0.00 0.00 0.00 46.02 45.86 1biz n GLY 190 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1biz s ILE 191 N -2.78 2.33 0.00 -0.61 -5.25 -1.26 -3.39 121.20 110.24 1biz s ILE 191 Ca 0.00 0.27 0.00 0.00 -0.99 0.00 0.00 60.65 59.93 1biz s ILE 191 Cb 0.00 -3.17 0.00 0.00 2.95 0.00 0.00 42.46 42.24 1biz s ILE 191 CO 0.00 0.04 0.00 0.61 -1.79 0.00 0.00 174.94 173.80 1biz n GLY 192 N 2.67 2.00 2.46 6.27 0.00 -1.26 -4.79 105.19 112.54 1biz n GLY 192 Ca 0.10 -0.40 -0.11 0.00 0.00 0.00 0.00 46.02 45.60 1biz n GLY 192 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1biz n GLY 193 N 0.00 0.15 3.13 -0.02 0.00 -1.22 -5.06 105.19 102.18 1biz n GLY 193 Ca 0.00 -0.20 -0.09 0.00 0.00 0.00 0.00 46.02 45.73 1biz n GLY 193 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1biz s TYR 194 N -3.17 0.73 0.36 1.61 5.04 -1.26 -4.88 117.35 115.78 1biz s TYR 194 Ca 0.21 -1.06 0.04 0.00 -2.44 0.00 0.00 57.07 53.82 1biz s TYR 194 Cb -0.09 -0.46 -0.01 0.00 0.35 0.00 0.00 41.96 41.74 1biz s TYR 194 CO 0.37 -0.34 0.52 -1.54 -1.34 0.00 0.00 175.55 173.22 1biz s SER 195 N -3.00 5.99 0.22 4.32 1.04 -1.26 -3.73 113.70 117.28 1biz s SER 195 Ca 0.13 0.01 -0.08 0.00 0.48 0.00 0.00 55.95 56.48 1biz s SER 195 Cb 0.07 -1.43 0.25 0.00 0.10 0.00 0.00 66.02 65.02 1biz s SER 195 CO -0.05 -0.46 1.82 0.00 0.98 0.00 0.00 173.24 175.53 1biz h ALA 196 N 0.78 0.96 -0.34 5.32 0.00 -1.73 0.31 119.26 124.56 1biz h ALA 196 Ca -0.47 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.41 1biz h ALA 196 Cb 1.25 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.86 1biz h ALA 196 CO 0.55 0.13 0.07 0.78 0.00 0.00 0.00 179.25 180.79 1biz h GLY 197 N 0.78 0.53 1.29 0.00 0.00 -1.64 -1.83 103.07 102.21 1biz h GLY 197 Ca 0.31 -0.27 -0.29 0.00 0.00 0.00 0.00 47.33 47.08 1biz h GLY 197 CO -0.17 0.26 -1.22 0.83 0.00 0.00 0.00 176.54 176.24 1biz h GLU 198 N 0.48 0.59 -0.62 4.80 5.08 -1.51 -3.23 114.58 120.18 1biz h GLU 198 Ca 0.11 -0.77 -0.01 0.00 -1.00 0.00 0.00 59.36 57.69 1biz h GLU 198 Cb 0.20 0.25 -0.03 0.00 0.50 0.00 0.00 28.75 29.68 1biz h GLU 198 CO -0.00 1.35 0.34 0.00 -1.00 0.00 0.00 179.01 179.69 1biz h ARG 199 N 0.27 0.87 -0.37 2.33 3.08 -0.70 -0.36 114.38 119.50 1biz h ARG 199 Ca -0.17 -0.11 -0.02 0.00 0.07 0.00 0.00 59.98 59.76 1biz h ARG 199 Cb 1.89 -0.17 -0.02 0.00 0.08 0.00 0.00 29.97 31.75 1biz h ARG 199 CO 0.23 0.67 0.17 0.97 -1.07 0.00 0.00 179.97 180.94 1biz h ILE 200 N 0.85 1.17 -0.70 2.04 2.10 -1.45 0.68 117.51 122.20 1biz h ILE 200 Ca 0.22 -0.50 -0.02 0.00 1.08 0.00 0.00 64.86 65.64 1biz h ILE 200 Cb 0.05 0.82 -0.03 0.00 -1.09 0.00 0.00 36.82 36.57 1biz h ILE 200 CO -0.03 0.19 0.37 0.58 -1.08 0.00 0.00 178.15 178.17 1biz h VAL 201 N 0.46 1.21 0.21 2.19 2.07 -1.51 -1.26 116.25 119.62 1biz h VAL 201 Ca 0.13 -0.55 -0.01 0.00 0.82 0.00 0.00 66.70 67.09 1biz h VAL 201 Cb 0.14 0.28 0.00 0.00 -1.52 0.00 0.00 31.29 30.19 1biz h VAL 201 CO -0.01 0.24 -0.10 -0.78 0.02 0.00 0.00 177.57 176.94 1biz h ASP 202 N 0.98 -0.24 -0.62 0.57 3.58 -0.56 -0.96 116.42 119.16 1biz h ASP 202 Ca 0.25 -0.19 0.07 0.00 0.42 0.00 0.00 57.03 57.58 1biz h ASP 202 Cb 0.04 0.06 -0.06 0.00 1.72 0.00 0.00 39.33 41.10 1biz h ASP 202 CO -0.04 0.07 0.30 0.40 -2.88 0.00 0.00 179.24 177.10 1biz h ILE 203 N -0.56 0.89 -0.35 2.25 2.04 -0.60 -0.11 117.51 121.06 1biz h ILE 203 Ca -0.03 -0.19 -0.14 0.00 1.00 0.00 0.00 64.86 65.50 1biz h ILE 203 Cb 0.41 0.29 -0.01 0.00 -0.74 0.00 0.00 36.82 36.78 1biz h ILE 203 CO 0.05 0.10 -0.31 0.40 0.00 0.00 0.00 178.15 178.39 1biz h ILE 204 N 0.55 1.28 -0.53 -0.67 2.04 -1.21 -2.19 117.51 116.79 1biz h ILE 204 Ca 0.29 -1.48 -0.03 0.00 1.00 0.00 0.00 64.86 64.65 1biz h ILE 204 Cb 0.26 1.43 -0.02 0.00 -0.74 0.00 0.00 36.82 37.75 1biz h ILE 204 CO -0.22 0.49 0.23 0.00 0.00 0.00 0.00 178.15 178.65 1biz h ALA 205 N 0.76 0.68 -0.31 1.87 0.00 -0.75 -1.66 119.26 119.86 1biz h ALA 205 Ca 0.06 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 54.83 1biz h ALA 205 Cb 0.89 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.46 1biz h ALA 205 CO 0.08 0.27 0.17 1.15 0.00 0.00 0.00 179.25 180.92 1biz h THR 206 N 0.71 1.13 -0.70 0.00 2.02 -0.99 -1.41 112.91 113.67 1biz h THR 206 Ca 0.18 -0.32 0.05 0.00 0.77 0.00 0.00 66.41 67.08 1biz h THR 206 Cb 0.16 0.78 -0.05 0.00 -1.74 0.00 0.00 68.15 67.30 1biz h THR 206 CO -0.02 0.13 0.42 -0.78 0.37 0.00 0.00 175.52 175.64 1biz h ASP 207 N 0.38 0.65 -0.29 4.18 3.58 -1.15 -0.92 116.42 122.85 1biz h ASP 207 Ca 0.11 0.02 -0.00 0.00 0.42 0.00 0.00 57.03 57.57 1biz h ASP 207 Cb 0.05 -0.12 -0.01 0.00 1.72 0.00 0.00 39.33 40.97 1biz h ASP 207 CO -0.02 0.44 0.17 0.40 -2.88 0.00 0.00 179.24 177.34 1biz h ILE 208 N 0.79 1.12 -0.80 2.25 2.04 -0.99 -2.50 117.51 119.42 1biz h ILE 208 Ca 0.30 -0.31 0.09 0.00 1.00 0.00 0.00 64.86 65.93 1biz h ILE 208 Cb 0.12 0.80 -0.07 0.00 -0.74 0.00 0.00 36.82 36.92 1biz h ILE 208 CO -0.15 0.12 0.46 1.56 0.00 0.00 0.00 178.15 180.14 1biz h GLN 209 N 0.36 0.77 0.00 2.37 4.20 -0.37 -1.13 115.11 121.31 1biz h GLN 209 Ca 0.10 -0.05 -0.08 0.00 0.06 0.00 0.00 58.65 58.68 1biz h GLN 209 Cb 0.05 -0.17 -0.01 0.00 0.30 0.00 0.00 27.48 27.64 1biz h GLN 209 CO -0.02 0.51 -0.40 1.79 -0.67 0.00 0.00 178.83 180.04 1biz h THR 210 N 0.79 1.09 0.00 -0.54 1.35 -0.95 -3.14 112.91 111.52 1biz h THR 210 Ca 0.38 -1.47 0.00 0.00 -0.55 0.00 0.00 66.41 64.77 1biz h THR 210 Cb 0.31 1.84 0.00 0.00 -1.73 0.00 0.00 68.15 68.57 1biz h THR 210 CO -0.23 0.39 -0.64 0.29 -0.25 0.00 0.00 175.52 175.08 1biz n LYS 211 N -3.78 0.05 0.00 4.72 5.02 -0.70 -5.12 118.16 118.35 1biz n LYS 211 Ca -0.01 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.28 1biz n LYS 211 Cb 0.47 -1.52 0.00 0.00 -0.02 0.00 0.00 35.03 33.96 1biz n LYS 211 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27