#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dno s SER 60 N 0.00 -0.40 -0.21 1.61 0.15 -1.26 -5.17 113.70 108.41 2dno s SER 60 Ca 0.00 0.22 -0.12 0.00 0.70 0.00 0.00 55.95 56.75 2dno s SER 60 Cb 0.00 0.38 0.07 0.00 -1.71 0.00 0.00 66.02 64.75 2dno s SER 60 CO 0.00 -0.53 0.52 -0.55 1.20 0.00 0.00 173.24 173.88 2dno s SER 61 N -1.86 -0.68 0.00 5.45 0.15 -1.26 -5.17 113.70 110.33 2dno s SER 61 Ca 0.01 1.13 0.00 0.00 0.70 0.00 0.00 55.95 57.79 2dno s SER 61 Cb -0.01 1.01 0.00 0.00 -1.71 0.00 0.00 66.02 65.31 2dno s SER 61 CO -0.03 -0.21 0.00 0.61 1.20 0.00 0.00 173.24 174.81 2dno n GLY 62 N 4.25 3.60 3.29 9.45 0.00 -1.26 -5.16 105.19 119.36 2dno n GLY 62 Ca -0.22 -1.93 -0.13 0.00 0.00 0.00 0.00 46.02 43.74 2dno n GLY 62 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2dno s SER 63 N -0.19 -0.41 0.20 1.61 1.04 -1.26 -5.17 113.70 109.52 2dno s SER 63 Ca 0.00 0.78 -0.16 0.00 0.48 0.00 0.00 55.95 57.05 2dno s SER 63 Cb 0.00 0.79 0.02 0.00 0.10 0.00 0.00 66.02 66.93 2dno s SER 63 CO 0.00 -0.14 0.48 -0.94 0.98 0.00 0.00 173.24 173.62 2dno s SER 64 N 0.17 -0.20 -0.31 7.02 1.04 -1.26 -5.12 113.70 115.05 2dno s SER 64 Ca -0.00 -0.58 -0.04 0.00 0.48 0.00 0.00 55.95 55.81 2dno s SER 64 Cb -0.03 0.56 0.27 0.00 0.10 0.00 0.00 66.02 66.92 2dno s SER 64 CO 0.01 -1.04 1.26 0.61 0.98 0.00 0.00 173.24 175.06 2dno n GLY 65 N -0.32 -1.92 3.78 7.32 0.00 -1.26 -5.16 105.19 107.63 2dno n GLY 65 Ca -0.09 1.10 -0.36 0.00 0.00 0.00 0.00 46.02 46.67 2dno n GLY 65 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2dno s SER 66 N -0.06 6.50 -0.22 1.61 0.15 -1.26 -5.06 113.70 115.36 2dno s SER 66 Ca 0.25 2.10 -0.15 0.00 0.70 0.00 0.00 55.95 58.85 2dno s SER 66 Cb 0.20 -2.59 0.06 0.00 -1.71 0.00 0.00 66.02 61.99 2dno s SER 66 CO -0.07 -0.68 0.55 -0.60 1.20 0.00 0.00 173.24 173.65 2dno s ARG 67 N -2.70 0.59 0.05 5.44 3.52 -1.26 -5.16 118.95 119.44 2dno s ARG 67 Ca 0.61 0.92 0.07 0.00 -0.13 0.00 0.00 55.73 57.20 2dno s ARG 67 Cb -0.23 0.16 -0.03 0.00 -1.56 0.00 0.00 34.95 33.29 2dno s ARG 67 CO 0.28 -0.12 -0.18 0.20 -0.81 0.00 0.00 175.30 174.66 2dno s GLY 68 N 1.05 1.02 -0.10 8.12 0.00 -1.26 -5.07 107.32 111.08 2dno s GLY 68 Ca -0.06 -1.01 -0.09 0.00 0.00 0.00 0.00 44.72 43.56 2dno s GLY 68 CO -0.10 -0.96 -0.17 1.18 0.00 0.00 0.00 173.10 173.05 2dno n GLU 69 N 1.75 0.30 -3.64 2.90 -0.58 -1.26 -4.97 120.64 115.14 2dno n GLU 69 Ca -0.18 0.23 -0.38 0.00 -0.42 0.00 0.00 57.16 56.42 2dno n GLU 69 Cb 0.54 -1.16 -0.06 0.00 -0.57 0.00 0.00 31.44 30.19 2dno n GLU 69 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 2dno s ASP 70 N -5.04 6.63 -0.27 1.62 1.01 -1.26 -5.01 116.67 114.35 2dno s ASP 70 Ca -0.14 0.75 -0.14 0.00 0.71 0.00 0.00 52.55 53.72 2dno s ASP 70 Cb 0.02 -2.18 -0.13 0.00 1.01 0.00 0.00 42.92 41.64 2dno s ASP 70 CO 0.21 0.34 -0.29 0.54 0.21 0.00 0.00 175.17 176.18 2dno n ARG 71 N 2.03 0.59 -1.11 8.23 1.74 -1.26 -4.94 116.66 121.94 2dno n ARG 71 Ca -0.16 0.29 -0.39 0.00 -0.77 0.00 0.00 57.85 56.82 2dno n ARG 71 Cb 0.53 -1.52 -0.03 0.00 -1.02 0.00 0.00 32.46 30.42 2dno n ARG 71 CO 0.00 0.00 0.00 1.17 -1.52 0.00 0.00 177.63 177.28 2dno n LYS 72 N -4.24 0.00 -5.07 5.56 4.81 -1.26 -4.55 118.16 113.41 2dno n LYS 72 Ca -0.52 0.00 -0.31 0.00 -0.87 0.00 0.00 58.31 56.61 2dno n LYS 72 Cb 0.87 -0.84 -0.15 0.00 0.02 0.00 0.00 35.03 34.94 2dno n LYS 72 CO 0.00 0.00 0.00 -0.51 1.17 0.00 0.00 177.40 178.06 2dno s LEU 73 N 2.06 2.28 -0.38 3.14 1.43 0.13 -2.17 118.68 125.17 2dno s LEU 73 Ca 0.53 -0.43 -0.17 0.00 -1.03 0.00 0.00 54.13 53.03 2dno s LEU 73 Cb -0.77 -1.40 0.00 0.00 0.03 0.00 0.00 46.19 44.06 2dno s LEU 73 CO 0.44 0.31 0.45 0.12 0.23 0.00 0.00 176.35 177.90 2dno s PHE 74 N -0.71 3.18 -0.16 0.29 5.36 0.18 -1.94 117.98 124.17 2dno s PHE 74 Ca 0.11 -0.08 -0.04 0.00 -0.96 0.00 0.00 56.93 55.96 2dno s PHE 74 Cb -0.10 -2.87 -0.03 0.00 -0.34 0.00 0.00 43.02 39.68 2dno s PHE 74 CO 0.01 -0.59 -0.02 0.08 -1.46 0.00 0.00 175.22 173.24 2dno s VAL 75 N 2.23 4.04 0.05 3.12 1.01 -0.80 -1.69 120.40 128.36 2dno s VAL 75 Ca 0.15 -0.30 0.00 0.00 0.00 0.00 0.00 61.98 61.82 2dno s VAL 75 Cb -0.16 -2.78 -0.00 0.00 0.00 0.00 0.00 36.38 33.44 2dno s VAL 75 CO 0.13 0.48 0.00 0.61 0.00 0.00 0.00 175.10 176.33 2dno n GLY 76 N 3.57 4.13 3.90 4.51 0.00 0.63 -1.74 105.19 120.19 2dno n GLY 76 Ca -0.17 -2.21 -0.29 0.00 0.00 0.00 0.00 46.02 43.35 2dno n GLY 76 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2dno n MET 77 N -0.13 -5.22 -3.72 1.61 2.81 -1.08 -3.36 117.12 108.03 2dno n MET 77 Ca -0.02 0.58 -0.31 0.00 -1.81 0.00 0.00 57.70 56.14 2dno n MET 77 Cb 0.07 -5.38 -0.04 0.00 -0.71 0.00 0.00 33.22 27.16 2dno n MET 77 CO 0.00 0.00 0.00 -0.51 1.51 0.00 0.00 175.97 176.97 2dno s LEU 78 N -7.17 4.28 0.08 4.03 1.43 -0.94 -4.67 118.68 115.72 2dno s LEU 78 Ca 0.53 0.50 0.05 0.00 -1.03 0.00 0.00 54.13 54.18 2dno s LEU 78 Cb -0.27 -3.22 -0.04 0.00 0.03 0.00 0.00 46.19 42.69 2dno s LEU 78 CO 0.84 0.06 -0.05 -0.83 0.23 0.00 0.00 176.35 176.59 2dno s GLY 79 N -2.57 1.84 0.34 -3.19 0.00 -1.26 -4.46 107.32 98.02 2dno s GLY 79 Ca 0.39 -1.15 0.11 0.00 0.00 0.00 0.00 44.72 44.07 2dno s GLY 79 CO 0.26 -1.11 1.59 0.07 0.00 0.00 0.00 173.10 173.90 2dno h LYS 80 N 3.68 0.04 -0.30 2.90 2.10 -1.92 0.20 116.57 123.27 2dno h LYS 80 Ca -0.48 -0.00 0.06 0.00 -2.00 0.00 0.00 60.65 58.23 2dno h LYS 80 Cb 1.17 -0.01 -0.08 0.00 -0.90 0.00 0.00 32.23 32.41 2dno h LYS 80 CO 0.56 0.03 -0.39 0.37 -2.00 0.00 0.00 179.45 178.01 2dno h GLN 81 N 0.04 -0.35 -6.34 0.07 5.75 -1.94 -3.39 115.11 108.95 2dno h GLN 81 Ca 0.71 0.02 -0.54 0.00 -0.15 0.00 0.00 58.65 58.70 2dno h GLN 81 Cb 1.69 0.08 0.00 0.00 1.07 0.00 0.00 27.48 30.33 2dno h GLN 81 CO -0.82 -0.23 1.04 -0.65 -2.65 0.00 0.00 178.83 175.52 2dno s GLN 82 N -5.91 4.19 0.35 1.69 1.11 0.68 -4.96 119.66 116.82 2dno s GLN 82 Ca -0.15 2.24 0.08 0.00 0.01 0.00 0.00 55.36 57.54 2dno s GLN 82 Cb 0.11 -3.84 -0.07 0.00 -1.01 0.00 0.00 33.01 28.21 2dno s GLN 82 CO 0.66 -0.79 -0.05 0.95 0.01 0.00 0.00 175.29 176.06 2dno s THR 83 N 3.47 2.03 0.54 -0.19 -4.23 -1.26 -4.70 115.64 111.30 2dno s THR 83 Ca 0.74 -2.12 0.42 0.00 -1.18 0.00 0.00 61.69 59.54 2dno s THR 83 Cb -0.36 -2.73 0.61 0.00 1.34 0.00 0.00 72.50 71.36 2dno s THR 83 CO 0.31 -0.14 1.41 -0.90 -0.54 0.00 0.00 174.62 174.76 2dno n ASP 84 N -0.81 0.00 -0.02 3.99 5.68 -1.26 0.22 116.55 124.35 2dno n ASP 84 Ca -0.05 0.88 -0.16 0.00 -0.50 0.00 0.00 54.79 54.96 2dno n ASP 84 Cb 0.65 -0.41 -0.09 0.00 -1.14 0.00 0.00 41.12 40.13 2dno n ASP 84 CO 0.00 0.00 0.00 -0.08 -1.33 0.00 0.00 177.20 175.79 2dno h GLU 85 N 0.00 0.52 0.69 0.11 4.57 -1.98 -2.82 114.58 115.66 2dno h GLU 85 Ca 0.78 -0.45 -0.03 0.00 -1.18 0.00 0.00 59.36 58.48 2dno h GLU 85 Cb 3.38 0.10 0.01 0.00 -0.16 0.00 0.00 28.75 32.08 2dno h GLU 85 CO -0.01 1.08 -0.33 -0.44 -1.18 0.00 0.00 179.01 178.13 2dno h ASP 86 N 0.10 -0.78 -0.50 1.04 3.32 0.22 -2.09 116.42 117.73 2dno h ASP 86 Ca -0.05 0.03 0.08 0.00 0.02 0.00 0.00 57.03 57.12 2dno h ASP 86 Cb 1.21 0.20 -0.10 0.00 0.22 0.00 0.00 39.33 40.86 2dno h ASP 86 CO 0.11 -0.44 -0.39 0.58 -1.72 0.00 0.00 179.24 177.38 2dno h VAL 87 N -1.17 0.14 0.09 -1.35 2.07 -1.52 1.04 116.25 115.55 2dno h VAL 87 Ca -0.09 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.43 2dno h VAL 87 Cb 0.71 0.14 -0.03 0.00 -1.52 0.00 0.00 31.29 30.58 2dno h VAL 87 CO 0.15 0.00 -0.33 -0.09 0.02 0.00 0.00 177.57 177.33 2dno h ARG 88 N -0.25 -0.46 -0.01 1.57 2.43 -1.56 1.38 114.38 117.47 2dno h ARG 88 Ca 0.18 0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.38 2dno h ARG 88 Cb 0.56 0.11 -0.00 0.00 -0.42 0.00 0.00 29.97 30.22 2dno h ARG 88 CO -0.63 -0.31 0.04 -0.22 -1.51 0.00 0.00 179.97 177.34 2dno h LYS 89 N -0.48 0.00 0.00 0.20 3.64 -0.91 0.76 116.57 119.77 2dno h LYS 89 Ca -0.01 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 2dno h LYS 89 Cb 0.48 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.30 2dno h LYS 89 CO -0.17 0.00 -0.84 1.98 -2.27 0.00 0.00 179.45 178.16 2dno h MET 90 N 0.00 0.00 0.00 1.90 4.05 0.30 -3.34 114.93 117.83 2dno h MET 90 Ca 0.01 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.43 2dno h MET 90 Cb 0.08 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 30.88 2dno h MET 90 CO -0.00 0.00 -1.56 1.19 0.23 0.00 0.00 176.91 176.77 2dno n PHE 91 N -2.61 0.00 -0.24 1.39 3.01 0.45 -4.43 117.46 115.03 2dno n PHE 91 Ca 0.01 0.00 -0.07 0.00 1.01 0.00 0.00 57.45 58.40 2dno n PHE 91 Cb 0.53 -0.30 0.04 0.00 -0.01 0.00 0.00 39.48 39.73 2dno n PHE 91 CO 0.00 0.00 0.00 0.93 1.01 0.00 0.00 176.76 178.70 2dno h GLU 92 N 0.00 0.96 0.00 -1.08 5.08 0.25 -2.47 114.58 117.32 2dno h GLU 92 Ca 0.00 -0.15 0.00 0.00 -1.00 0.00 0.00 59.36 58.21 2dno h GLU 92 Cb 0.72 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 29.80 2dno h GLU 92 CO 0.00 0.77 0.46 -1.35 -1.00 0.00 0.00 179.01 177.89 2dno h PRO 93 N 0.92 0.00 -0.13 2.33 0.11 -1.78 0.91 132.00 134.36 2dno h PRO 93 Ca 0.22 0.00 -0.08 0.00 0.11 0.00 0.00 66.00 66.25 2dno h PRO 93 Cb 0.14 0.00 -0.06 0.00 0.11 0.00 0.00 31.00 31.19 2dno h PRO 93 CO -0.03 0.00 -0.48 1.19 -0.21 0.00 0.00 178.00 178.48 2dno n PHE 94 N -2.01 0.44 0.00 0.65 3.72 -0.93 -5.07 117.46 114.26 2dno n PHE 94 Ca -0.01 -1.60 0.00 0.00 -0.05 0.00 0.00 57.45 55.80 2dno n PHE 94 Cb 0.48 -0.30 0.00 0.00 -0.94 0.00 0.00 39.48 38.72 2dno n PHE 94 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2dno n GLY 95 N -1.08 2.89 3.69 1.37 0.00 0.31 -4.41 105.19 107.97 2dno n GLY 95 Ca 0.24 -1.89 -0.39 0.00 0.00 0.00 0.00 46.02 43.98 2dno n GLY 95 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2dno s THR 96 N -1.96 5.15 -0.17 2.61 2.01 -1.26 -4.06 115.64 117.95 2dno s THR 96 Ca 0.00 0.95 -0.19 0.00 0.31 0.00 0.00 61.69 62.76 2dno s THR 96 Cb 0.00 -3.83 -0.03 0.00 0.01 0.00 0.00 72.50 68.65 2dno s THR 96 CO 0.00 0.25 0.52 -0.63 -0.69 0.00 0.00 174.62 174.07 2dno s ILE 97 N 1.16 5.12 -0.09 1.82 1.01 -1.26 0.01 121.20 128.98 2dno s ILE 97 Ca 0.25 0.99 0.12 0.00 0.00 0.00 0.00 60.65 62.01 2dno s ILE 97 Cb -0.15 -3.85 -0.24 0.00 0.01 0.00 0.00 42.46 38.23 2dno s ILE 97 CO 0.10 0.22 0.50 -0.67 0.00 0.00 0.00 174.94 175.09 2dno n ASP 98 N 4.42 0.81 -3.85 3.58 2.03 -0.50 -4.88 116.55 118.17 2dno n ASP 98 Ca -0.05 0.30 -0.12 0.00 0.52 0.00 0.00 54.79 55.44 2dno n ASP 98 Cb 0.51 0.09 -0.14 0.00 -0.72 0.00 0.00 41.12 40.86 2dno n ASP 98 CO 0.00 0.00 0.00 -0.70 -1.92 0.00 0.00 177.20 174.58 2dno s GLU 99 N -2.57 0.04 -0.13 -0.67 -6.30 -1.19 -5.03 118.70 102.85 2dno s GLU 99 Ca -0.08 0.08 -0.06 0.00 -2.50 0.00 0.00 54.97 52.41 2dno s GLU 99 Cb 0.07 -0.01 0.05 0.00 0.00 0.00 0.00 34.13 34.25 2dno s GLU 99 CO 0.82 -0.03 0.30 0.00 0.02 0.00 0.00 175.26 176.37 2dno s THR 101 N 1.53 0.00 0.09 0.00 2.01 -0.90 -5.05 115.64 113.32 2dno s THR 101 Ca -0.08 -0.03 0.04 0.00 0.31 0.00 0.00 61.69 61.93 2dno s THR 101 Cb -0.10 -0.80 -0.04 0.00 0.01 0.00 0.00 72.50 71.57 2dno s THR 101 CO -0.10 -0.02 0.06 -0.69 -0.69 0.00 0.00 174.62 173.18 2dno s VAL 102 N 0.03 4.38 -0.28 3.82 1.01 -1.26 -0.30 120.40 127.80 2dno s VAL 102 Ca -0.02 -0.85 -0.12 0.00 0.00 0.00 0.00 61.98 61.00 2dno s VAL 102 Cb -0.04 -3.11 -0.05 0.00 0.00 0.00 0.00 36.38 33.19 2dno s VAL 102 CO 0.02 0.11 0.21 -0.76 0.00 0.00 0.00 175.10 174.69 2dno s LEU 103 N -2.39 4.07 0.00 3.92 1.43 -0.83 -4.95 118.68 119.93 2dno s LEU 103 Ca 0.28 -0.02 0.03 0.00 -1.03 0.00 0.00 54.13 53.39 2dno s LEU 103 Cb -0.12 -2.15 0.03 0.00 0.03 0.00 0.00 46.19 43.98 2dno s LEU 103 CO 0.21 -0.08 0.26 0.54 0.23 0.00 0.00 176.35 177.51 2dno n ARG 104 N 5.09 0.80 -0.78 1.70 1.74 -1.26 -2.36 116.66 121.59 2dno n ARG 104 Ca -0.13 -3.17 0.00 0.00 -0.77 0.00 0.00 57.85 53.78 2dno n ARG 104 Cb 0.52 0.50 0.00 0.00 -1.02 0.00 0.00 32.46 32.45 2dno n ARG 104 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2dno n GLY 105 N -0.82 3.92 0.33 -0.13 0.00 -1.08 -4.76 105.19 102.65 2dno n GLY 105 Ca -0.07 -2.11 -0.10 0.00 0.00 0.00 0.00 46.02 43.74 2dno n GLY 105 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2dno h PRO 106 N 0.00 -0.33 -0.45 1.61 0.11 -2.02 -2.35 132.00 128.57 2dno h PRO 106 Ca 0.00 0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.14 2dno h PRO 106 Cb 0.00 0.08 -0.02 0.00 0.11 0.00 0.00 31.00 31.16 2dno h PRO 106 CO 0.00 -0.22 0.30 -0.44 -0.21 0.00 0.00 178.00 177.42 2dno h ASP 107 N -0.34 0.52 0.00 -2.05 5.19 -2.07 -3.46 116.42 114.20 2dno h ASP 107 Ca 0.04 -0.02 0.00 0.00 -0.62 0.00 0.00 57.03 56.43 2dno h ASP 107 Cb 0.45 -0.13 0.00 0.00 0.18 0.00 0.00 39.33 39.83 2dno h ASP 107 CO -0.37 0.38 0.00 0.61 -3.12 0.00 0.00 179.24 176.73 2dno n GLY 108 N -1.21 1.10 3.78 2.75 0.00 -0.89 -5.13 105.19 105.59 2dno n GLY 108 Ca 0.01 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.66 2dno n GLY 108 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2dno s THR 109 N -1.31 4.33 -0.65 2.61 -4.23 -1.26 -4.68 115.64 110.44 2dno s THR 109 Ca 0.00 1.68 -0.27 0.00 -1.18 0.00 0.00 61.69 61.93 2dno s THR 109 Cb 0.00 -4.04 -0.12 0.00 1.34 0.00 0.00 72.50 69.68 2dno s THR 109 CO 0.00 0.30 2.48 -0.24 -0.54 0.00 0.00 174.62 176.62 2dno n SER 110 N 0.99 1.69 -0.40 3.99 2.88 -1.26 -2.63 113.62 118.88 2dno n SER 110 Ca -0.02 -0.45 0.36 0.00 -1.33 0.00 0.00 58.87 57.43 2dno n SER 110 Cb 0.50 -1.41 0.69 0.00 -0.75 0.00 0.00 64.21 63.24 2dno n SER 110 CO 0.00 0.00 0.00 0.11 -1.23 0.00 0.00 175.04 173.92 2dno h LYS 111 N 17.03 0.10 0.00 -1.46 1.79 -1.77 -3.44 116.57 128.83 2dno h LYS 111 Ca -0.17 -0.01 0.00 0.00 -2.18 0.00 0.00 60.65 58.30 2dno h LYS 111 Cb 1.25 -0.02 0.00 0.00 -1.58 0.00 0.00 32.23 31.88 2dno h LYS 111 CO 1.21 0.06 0.00 0.41 -1.08 0.00 0.00 179.45 180.06 2dno n GLY 112 N -1.69 1.77 3.29 3.86 0.00 -1.26 -4.99 105.19 106.17 2dno n GLY 112 Ca 0.30 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.18 2dno n GLY 112 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dno s ALA 114 N -1.43 -0.20 -0.12 0.00 0.00 -0.71 -1.95 121.76 117.34 2dno s ALA 114 Ca -0.12 -0.70 -0.01 0.00 0.00 0.00 0.00 51.96 51.14 2dno s ALA 114 Cb -0.04 0.74 -0.02 0.00 0.00 0.00 0.00 23.12 23.80 2dno s ALA 114 CO 0.04 -0.62 -0.11 -0.06 0.00 0.00 0.00 175.76 175.02 2dno s PHE 115 N -3.92 2.86 -0.16 0.00 0.08 0.59 -1.90 117.98 115.53 2dno s PHE 115 Ca 0.12 -0.48 0.00 0.00 0.12 0.00 0.00 56.93 56.70 2dno s PHE 115 Cb 0.03 -1.84 0.03 0.00 -0.57 0.00 0.00 43.02 40.67 2dno s PHE 115 CO -0.04 -0.10 -0.13 0.08 -0.10 0.00 0.00 175.22 174.92 2dno s VAL 116 N 0.18 1.59 -0.19 -0.44 1.01 -0.82 -2.13 120.40 119.61 2dno s VAL 116 Ca -0.06 -0.72 -0.07 0.00 0.00 0.00 0.00 61.98 61.13 2dno s VAL 116 Cb -0.15 -1.54 -0.04 0.00 0.00 0.00 0.00 36.38 34.66 2dno s VAL 116 CO 0.04 0.40 0.06 -0.75 0.00 0.00 0.00 175.10 174.85 2dno s LYS 117 N 1.46 3.95 0.23 2.72 2.20 0.62 0.18 119.74 131.10 2dno s LYS 117 Ca 0.04 -0.36 0.04 0.00 -0.36 0.00 0.00 55.97 55.33 2dno s LYS 117 Cb -0.14 -3.23 -0.03 0.00 -1.51 0.00 0.00 37.83 32.93 2dno s LYS 117 CO -0.10 0.23 0.35 -0.06 -0.36 0.00 0.00 175.35 175.41 2dno s PHE 118 N 0.49 3.46 0.35 4.03 0.40 -1.26 -1.40 117.98 124.04 2dno s PHE 118 Ca 0.03 0.02 0.09 0.00 -0.60 0.00 0.00 56.93 56.47 2dno s PHE 118 Cb -0.13 -1.60 0.65 0.00 0.51 0.00 0.00 43.02 42.45 2dno s PHE 118 CO 0.01 0.44 1.82 0.37 0.70 0.00 0.00 175.22 178.56 2dno h GLN 119 N 1.35 0.18 -4.17 0.44 5.75 -0.76 -3.42 115.11 114.49 2dno h GLN 119 Ca -0.51 -0.06 -0.12 0.00 -0.15 0.00 0.00 58.65 57.80 2dno h GLN 119 Cb 1.22 -0.01 -0.16 0.00 1.07 0.00 0.00 27.48 29.60 2dno h GLN 119 CO 0.63 0.46 -0.66 0.95 -2.65 0.00 0.00 178.83 177.56 2dno s THR 120 N -4.39 0.20 0.12 2.39 -4.23 -1.26 -5.05 115.64 103.42 2dno s THR 120 Ca -0.04 -1.65 -0.15 0.00 -1.18 0.00 0.00 61.69 58.67 2dno s THR 120 Cb 0.14 -1.35 -0.02 0.00 1.34 0.00 0.00 72.50 72.61 2dno s THR 120 CO 0.75 -0.91 1.58 -0.74 -0.54 0.00 0.00 174.62 174.76 2dno h HIS 121 N 3.30 0.74 -0.84 3.99 2.76 -1.95 -2.61 115.15 120.53 2dno h HIS 121 Ca -0.34 -0.12 0.19 0.00 -2.20 0.00 0.00 60.37 57.90 2dno h HIS 121 Cb 1.15 -0.20 -0.11 0.00 1.55 0.00 0.00 27.41 29.80 2dno h HIS 121 CO 0.54 0.75 0.35 0.00 -1.30 0.00 0.00 177.93 178.26 2dno h ALA 122 N 0.90 1.27 -0.00 5.26 0.00 -2.00 -1.03 119.26 123.66 2dno h ALA 122 Ca 0.12 0.14 -0.00 0.00 0.00 0.00 0.00 54.91 55.17 2dno h ALA 122 Cb 0.43 0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.35 2dno h ALA 122 CO 0.01 -0.28 -0.00 0.93 0.00 0.00 0.00 179.25 179.92 2dno h GLU 123 N 0.42 0.01 -0.89 0.00 4.39 -1.81 -2.29 114.58 114.42 2dno h GLU 123 Ca 0.50 -0.00 0.20 0.00 0.34 0.00 0.00 59.36 60.40 2dno h GLU 123 Cb 0.87 -0.00 -0.12 0.00 -0.10 0.00 0.00 28.75 29.40 2dno h GLU 123 CO -0.48 0.42 0.41 0.00 -1.16 0.00 0.00 179.01 178.20 2dno h ALA 124 N 0.59 1.40 -0.37 3.43 0.00 -0.90 0.91 119.26 124.32 2dno h ALA 124 Ca 0.00 0.14 -0.15 0.00 0.00 0.00 0.00 54.91 54.90 2dno h ALA 124 Cb 0.42 0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 2dno h ALA 124 CO 0.00 -0.28 -0.37 0.37 0.00 0.00 0.00 179.25 178.97 2dno h GLN 125 N 0.46 0.88 -0.40 0.00 -0.00 -1.19 -3.19 115.11 111.68 2dno h GLN 125 Ca 0.54 -0.45 0.08 0.00 -0.00 0.00 0.00 58.65 58.81 2dno h GLN 125 Cb 0.96 0.01 -0.07 0.00 0.00 0.00 0.00 27.48 28.38 2dno h GLN 125 CO -0.49 1.10 -0.05 0.00 0.00 0.00 0.00 178.83 179.39 2dno h ALA 126 N 0.85 0.32 0.27 3.38 0.00 -0.23 -1.55 119.26 122.29 2dno h ALA 126 Ca 0.06 0.14 -0.01 0.00 0.00 0.00 0.00 54.91 55.10 2dno h ALA 126 Cb 0.95 0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.98 2dno h ALA 126 CO 0.09 -0.43 -0.32 0.00 0.00 0.00 0.00 179.25 178.59 2dno h ALA 127 N 1.38 -0.97 -0.66 0.00 0.00 -1.40 -2.96 119.26 114.64 2dno h ALA 127 Ca 0.20 -0.11 0.10 0.00 0.00 0.00 0.00 54.91 55.10 2dno h ALA 127 Cb 0.29 0.60 -0.12 0.00 0.00 0.00 0.00 17.79 18.56 2dno h ALA 127 CO -0.37 -1.00 -0.40 0.82 0.00 0.00 0.00 179.25 178.30 2dno h ILE 128 N -0.60 0.10 -0.75 0.00 2.04 -1.51 0.99 117.51 117.78 2dno h ILE 128 Ca -0.03 0.00 0.30 0.00 1.00 0.00 0.00 64.86 66.13 2dno h ILE 128 Cb 0.54 0.10 -0.13 0.00 -0.74 0.00 0.00 36.82 36.58 2dno h ILE 128 CO -0.07 0.00 0.37 -3.20 0.00 0.00 0.00 178.15 175.25 2dno n ASN 129 N -5.42 0.23 -0.00 1.72 2.85 -0.60 -0.39 115.26 113.65 2dno n ASN 129 Ca 0.04 1.24 -0.00 0.00 -0.11 0.00 0.00 54.58 55.75 2dno n ASN 129 Cb 0.36 -0.59 -0.00 0.00 1.24 0.00 0.00 39.78 40.78 2dno n ASN 129 CO 0.00 0.00 0.00 0.41 -2.11 0.00 0.00 177.26 175.56 2dno n THR 130 N -4.72 0.00 -0.27 -0.44 -1.04 0.63 -4.67 114.28 103.77 2dno n THR 130 Ca 0.27 0.31 0.14 0.00 -2.04 0.00 0.00 64.05 62.73 2dno n THR 130 Cb 0.93 -1.31 0.27 0.00 -1.82 0.00 0.00 70.33 68.40 2dno n THR 130 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 2dno n LEU 131 N -2.50 -0.03 -4.70 -4.42 4.77 0.31 -3.81 117.00 106.62 2dno n LEU 131 Ca -0.00 1.31 -0.55 0.00 -0.03 0.00 0.00 56.01 56.75 2dno n LEU 131 Cb 0.00 -0.51 -0.06 0.00 -2.33 0.00 0.00 43.42 40.52 2dno n LEU 131 CO 0.00 -1.36 1.39 1.57 -1.33 0.00 0.00 177.39 177.67 2dno n HIS 132 N -5.03 2.14 -4.05 -1.77 -0.00 0.47 -0.99 115.22 106.00 2dno n HIS 132 Ca 0.20 0.36 -0.29 0.00 0.46 0.00 0.00 57.72 58.45 2dno n HIS 132 Cb 0.67 -2.53 -0.03 0.00 -0.12 0.00 0.00 29.99 27.98 2dno n HIS 132 CO 0.00 0.00 0.00 -1.13 0.46 0.00 0.00 176.34 175.67 2dno n SER 133 N 5.89 -1.01 0.00 0.26 3.41 -0.40 -4.91 113.62 116.87 2dno n SER 133 Ca 0.26 -1.03 0.00 0.00 -0.26 0.00 0.00 58.87 57.84 2dno n SER 133 Cb 0.18 -2.88 0.00 0.00 -0.26 0.00 0.00 64.21 61.26 2dno n SER 133 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 2dno n SER 134 N -2.90 0.00 -5.00 4.04 2.88 -0.16 -4.93 113.62 107.55 2dno n SER 134 Ca -0.21 0.04 -0.18 0.00 -1.33 0.00 0.00 58.87 57.19 2dno n SER 134 Cb 0.64 -0.25 0.01 0.00 -0.75 0.00 0.00 64.21 63.86 2dno n SER 134 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2dno s ARG 135 N -0.50 2.85 -0.60 -1.46 1.70 -1.26 -4.94 118.95 114.74 2dno s ARG 135 Ca 0.00 -1.11 0.05 0.00 -0.47 0.00 0.00 55.73 54.20 2dno s ARG 135 Cb 0.00 -2.73 0.17 0.00 -0.57 0.00 0.00 34.95 31.82 2dno s ARG 135 CO 0.00 -0.27 0.44 0.99 -1.08 0.00 0.00 175.30 175.38 2dno s THR 136 N -2.38 2.03 0.64 4.99 2.01 -1.26 -1.43 115.64 120.24 2dno s THR 136 Ca 0.53 -3.72 -0.17 0.00 0.31 0.00 0.00 61.69 58.63 2dno s THR 136 Cb -0.10 -2.35 -0.11 0.00 0.01 0.00 0.00 72.50 69.96 2dno s THR 136 CO 0.34 -1.08 0.08 0.18 -0.69 0.00 0.00 174.62 173.44 2dno n LEU 137 N 2.27 -1.97 -4.72 4.42 4.77 -1.26 -4.86 117.00 115.66 2dno n LEU 137 Ca 0.23 0.59 -0.42 0.00 -0.03 0.00 0.00 56.01 56.38 2dno n LEU 137 Cb 0.39 -0.99 -0.03 0.00 -2.33 0.00 0.00 43.42 40.46 2dno n LEU 137 CO 0.21 -4.19 0.98 -2.16 -1.33 0.00 0.00 177.39 170.90 2dno s PRO 138 N -1.79 4.38 0.00 3.23 0.04 -1.26 -3.09 135.00 136.50 2dno s PRO 138 Ca 0.59 1.95 0.00 0.00 0.04 0.00 0.00 61.00 63.58 2dno s PRO 138 Cb -0.41 -3.28 0.00 0.00 0.04 0.00 0.00 34.50 30.85 2dno s PRO 138 CO 0.64 -0.34 0.00 0.41 0.04 0.00 0.00 177.00 177.75 2dno n GLY 139 N 3.26 0.71 2.95 0.56 0.00 -1.26 -4.81 105.19 106.60 2dno n GLY 139 Ca 0.10 -0.41 -0.30 0.00 0.00 0.00 0.00 46.02 45.40 2dno n GLY 139 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dno s ALA 140 N -2.00 1.92 0.00 4.61 0.00 -1.18 -4.94 121.76 120.17 2dno s ALA 140 Ca 0.00 -1.25 0.00 0.00 0.00 0.00 0.00 51.96 50.71 2dno s ALA 140 Cb 0.00 -1.35 0.00 0.00 0.00 0.00 0.00 23.12 21.77 2dno s ALA 140 CO 0.00 -1.02 0.43 0.43 0.00 0.00 0.00 175.76 175.60 2dno n SER 141 N 4.70 0.00 -3.50 0.00 7.64 -1.26 -4.59 113.62 116.60 2dno n SER 141 Ca -0.13 0.43 -0.12 0.00 1.01 0.00 0.00 58.87 60.06 2dno n SER 141 Cb 0.45 -0.12 0.06 0.00 -1.01 0.00 0.00 64.21 63.58 2dno n SER 141 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 2dno n SER 142 N -1.53 0.91 -3.37 6.43 7.64 -1.26 -5.10 113.62 117.33 2dno n SER 142 Ca 0.00 -1.72 -0.25 0.00 1.01 0.00 0.00 58.87 57.92 2dno n SER 142 Cb 0.00 -0.32 0.20 0.00 -1.01 0.00 0.00 64.21 63.09 2dno n SER 142 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 2dno n SER 143 N -2.83 -1.85 -4.62 6.43 7.64 -1.26 -4.75 113.62 112.37 2dno n SER 143 Ca 0.09 -1.06 -0.43 0.00 1.01 0.00 0.00 58.87 58.49 2dno n SER 143 Cb 0.33 -0.82 -0.02 0.00 -1.01 0.00 0.00 64.21 62.69 2dno n SER 143 CO 0.00 0.00 0.00 -0.22 -3.01 0.00 0.00 175.04 171.81 2dno s LEU 144 N 0.00 3.79 -0.45 -3.43 2.96 -0.51 -4.76 118.68 116.28 2dno s LEU 144 Ca 0.58 1.27 -0.26 0.00 -0.22 0.00 0.00 54.13 55.50 2dno s LEU 144 Cb -0.06 -3.54 0.03 0.00 0.50 0.00 0.00 46.19 43.12 2dno s LEU 144 CO 0.45 -1.27 0.96 -0.69 -1.32 0.00 0.00 176.35 174.48 2dno s VAL 145 N 5.08 4.44 -0.20 1.68 1.01 -1.21 -1.28 120.40 129.92 2dno s VAL 145 Ca 0.64 0.88 -0.00 0.00 0.00 0.00 0.00 61.98 63.50 2dno s VAL 145 Cb -0.19 -4.45 0.01 0.00 0.00 0.00 0.00 36.38 31.75 2dno s VAL 145 CO 0.28 -0.83 -0.14 -0.69 0.00 0.00 0.00 175.10 173.72 2dno s VAL 146 N 3.84 2.49 0.28 2.92 1.01 -1.26 -0.27 120.40 129.41 2dno s VAL 146 Ca 0.39 -0.85 0.00 0.00 0.00 0.00 0.00 61.98 61.52 2dno s VAL 146 Cb -0.10 -2.11 0.00 0.00 0.00 0.00 0.00 36.38 34.17 2dno s VAL 146 CO 0.26 0.46 0.36 2.29 0.00 0.00 0.00 175.10 178.47 2dno n LYS 147 N 4.67 0.52 -2.13 2.72 2.85 -0.68 -4.64 118.16 121.47 2dno n LYS 147 Ca -0.20 -2.37 -0.32 0.00 -1.05 0.00 0.00 58.31 54.37 2dno n LYS 147 Cb 0.50 2.20 -0.01 0.00 -0.65 0.00 0.00 35.03 37.07 2dno n LYS 147 CO 0.00 0.00 0.00 -0.06 -0.05 0.00 0.00 177.40 177.29 2dno s PHE 148 N -3.26 3.35 0.67 5.58 0.40 -1.26 0.48 117.98 123.94 2dno s PHE 148 Ca 0.26 1.44 -0.12 0.00 -0.60 0.00 0.00 56.93 57.90 2dno s PHE 148 Cb -0.00 -2.83 -0.01 0.00 0.51 0.00 0.00 43.02 40.69 2dno s PHE 148 CO 0.18 -0.68 1.05 0.00 0.70 0.00 0.00 175.22 176.47 2dno s ALA 149 N -2.74 2.74 -1.15 5.36 0.00 -0.92 -3.88 121.76 121.16 2dno s ALA 149 Ca 0.59 0.12 -0.05 0.00 0.00 0.00 0.00 51.96 52.62 2dno s ALA 149 Cb -0.12 -3.17 0.01 0.00 0.00 0.00 0.00 23.12 19.84 2dno s ALA 149 CO 0.40 -1.08 0.10 -0.25 0.00 0.00 0.00 175.76 174.93 2dno n ASP 150 N -2.88 0.02 -4.65 0.00 8.00 -1.26 -4.75 116.55 111.04 2dno n ASP 150 Ca 0.08 -0.99 -0.42 0.00 0.71 0.00 0.00 54.79 54.16 2dno n ASP 150 Cb 0.53 -1.23 -0.03 0.00 -0.02 0.00 0.00 41.12 40.38 2dno n ASP 150 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 2dno s THR 151 N -4.03 3.35 0.24 -3.53 2.01 -1.25 -4.88 115.64 107.55 2dno s THR 151 Ca 0.07 0.41 -0.04 0.00 0.31 0.00 0.00 61.69 62.44 2dno s THR 151 Cb -0.04 -3.31 0.22 0.00 0.01 0.00 0.00 72.50 69.38 2dno s THR 151 CO 0.77 -0.09 1.72 -0.08 -0.69 0.00 0.00 174.62 176.26 2dno h GLU 152 N 10.87 0.41 -6.27 4.92 4.81 -1.95 -3.38 114.58 123.99 2dno h GLU 152 Ca -0.42 -0.02 -0.57 0.00 -0.13 0.00 0.00 59.36 58.22 2dno h GLU 152 Cb 1.20 -0.09 -0.02 0.00 0.63 0.00 0.00 28.75 30.46 2dno h GLU 152 CO 0.96 0.27 1.23 0.15 -0.73 0.00 0.00 179.01 180.89 2dno s LYS 153 N -6.02 3.55 0.25 1.92 -0.14 -1.26 -4.99 119.74 113.04 2dno s LYS 153 Ca -0.12 1.61 0.07 0.00 -1.36 0.00 0.00 55.97 56.16 2dno s LYS 153 Cb 0.21 -4.14 -0.03 0.00 -1.68 0.00 0.00 37.83 32.18 2dno s LYS 153 CO 0.76 -1.60 0.22 -1.83 -0.76 0.00 0.00 175.35 172.14 2dno s GLU 154 N 5.25 3.01 0.06 1.68 4.04 -1.26 -5.04 118.70 126.43 2dno s GLU 154 Ca 0.78 -1.01 -0.38 0.00 0.04 0.00 0.00 54.97 54.41 2dno s GLU 154 Cb -0.25 -2.62 -0.18 0.00 0.02 0.00 0.00 34.13 31.11 2dno s GLU 154 CO 0.32 0.41 1.22 0.45 -1.84 0.00 0.00 175.26 175.82 2dno n SER 155 N -1.22 0.99 -4.77 0.83 2.88 -1.26 -4.94 113.62 106.14 2dno n SER 155 Ca -0.08 1.14 -0.35 0.00 -1.33 0.00 0.00 58.87 58.25 2dno n SER 155 Cb 0.58 -1.09 -0.08 0.00 -0.75 0.00 0.00 64.21 62.87 2dno n SER 155 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 2dno s GLY 156 N 0.26 1.98 -0.10 0.46 0.00 -1.26 -5.05 107.32 103.61 2dno s GLY 156 Ca 0.86 -0.80 -0.39 0.00 0.00 0.00 0.00 44.72 44.39 2dno s GLY 156 CO 0.51 -0.60 1.48 -1.05 0.00 0.00 0.00 173.10 173.44 2dno n PRO 157 N 1.73 0.93 -4.17 2.90 -0.02 -1.26 -4.97 135.00 130.13 2dno n PRO 157 Ca -0.17 0.34 -0.15 0.00 -2.02 0.00 0.00 63.50 61.50 2dno n PRO 157 Cb 0.54 -1.97 -0.11 0.00 -0.02 0.00 0.00 33.50 31.94 2dno n PRO 157 CO 0.00 0.00 0.00 -1.12 1.98 0.00 0.00 175.50 176.36 2dno s SER 158 N 1.74 1.50 -0.21 2.55 0.01 -1.26 -5.16 113.70 112.88 2dno s SER 158 Ca 0.92 -0.77 -0.15 0.00 1.31 0.00 0.00 55.95 57.27 2dno s SER 158 Cb -1.08 -0.01 0.06 0.00 0.21 0.00 0.00 66.02 65.21 2dno s SER 158 CO 0.58 -0.22 0.52 -0.94 0.41 0.00 0.00 173.24 173.59 2dno s SER 159 N -2.28 -0.63 0.00 2.44 1.04 -1.26 -5.33 113.70 107.68 2dno s SER 159 Ca 0.04 1.11 0.00 0.00 0.48 0.00 0.00 55.95 57.57 2dno s SER 159 Cb -0.05 1.04 0.00 0.00 0.10 0.00 0.00 66.02 67.11 2dno s SER 159 CO 0.01 -0.20 0.00 0.61 0.98 0.00 0.00 173.24 174.64