#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 0.51 0.84 1.61 0.01 -1.26 -5.17 113.70 110.24 2dno s SER 60 Ca 0.00 -0.75 -0.11 0.00 1.31 0.00 0.00 55.95 56.40 2dno s SER 60 Cb 0.00 0.13 0.13 0.00 0.21 0.00 0.00 66.02 66.49 2dno s SER 60 CO 0.00 -0.42 1.17 -0.94 0.41 0.00 0.00 173.24 173.46 2dno s SER 61 N -2.21 3.95 0.00 2.44 1.04 -1.26 -5.09 113.70 112.57 2dno s SER 61 Ca -0.03 0.31 0.00 0.00 0.48 0.00 0.00 55.95 56.70 2dno s SER 61 Cb -0.01 -0.62 0.00 0.00 0.10 0.00 0.00 66.02 65.48 2dno s SER 61 CO -0.05 -2.19 0.00 0.61 0.98 0.00 0.00 173.24 172.60 2dno n GLY 62 N -3.35 2.51 3.34 7.32 0.00 -1.26 -5.18 105.19 108.57 2dno n GLY 62 Ca 0.12 -0.71 -0.13 0.00 0.00 0.00 0.00 46.02 45.30 2dno n GLY 62 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dno s SER 63 N 0.00 -0.33 -0.75 1.61 0.01 -1.26 -5.11 113.70 107.88 2dno s SER 63 Ca 0.00 0.09 -0.08 0.00 1.31 0.00 0.00 55.95 57.26 2dno s SER 63 Cb 0.00 0.43 0.19 0.00 0.21 0.00 0.00 66.02 66.86 2dno s SER 63 CO 0.00 -0.64 0.63 -0.55 0.41 0.00 0.00 173.24 173.08 2dno s SER 64 N -1.86 6.05 0.00 2.44 0.15 -1.26 -4.87 113.70 114.34 2dno s SER 64 Ca -0.07 -2.83 0.00 0.00 0.70 0.00 0.00 55.95 53.76 2dno s SER 64 Cb -0.01 -2.04 0.00 0.00 -1.71 0.00 0.00 66.02 62.26 2dno s SER 64 CO -0.01 -0.46 0.00 0.61 1.20 0.00 0.00 173.24 174.59 2dno n GLY 65 N 3.66 1.34 3.69 9.45 0.00 -1.26 -5.13 105.19 116.94 2dno n GLY 65 Ca 0.12 -1.04 -0.23 0.00 0.00 0.00 0.00 46.02 44.87 2dno n GLY 65 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dno s SER 66 N 0.00 4.67 0.13 1.61 0.01 -1.26 -5.12 113.70 113.74 2dno s SER 66 Ca 0.00 -0.67 -0.16 0.00 1.31 0.00 0.00 55.95 56.43 2dno s SER 66 Cb 0.00 -0.84 -0.07 0.00 0.21 0.00 0.00 66.02 65.32 2dno s SER 66 CO 0.00 -0.13 0.56 -0.13 0.41 0.00 0.00 173.24 173.95 2dno s ARG 67 N -3.76 4.03 0.00 12.44 1.81 -1.26 -4.92 118.95 127.29 2dno s ARG 67 Ca 0.34 0.56 0.00 0.00 -1.72 0.00 0.00 55.73 54.91 2dno s ARG 67 Cb -0.05 -3.00 0.00 0.00 -0.45 0.00 0.00 34.95 31.45 2dno s ARG 67 CO 0.21 0.52 0.00 0.41 -0.68 0.00 0.00 175.30 175.76 2dno n GLY 68 N 1.02 -1.09 0.40 -3.53 0.00 -1.26 -5.04 105.19 95.70 2dno n GLY 68 Ca -0.07 0.44 -0.12 0.00 0.00 0.00 0.00 46.02 46.28 2dno n GLY 68 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2dno h GLU 69 N 0.00 -0.41 -6.76 1.61 5.08 -2.03 -3.42 114.58 108.65 2dno h GLU 69 Ca 0.00 0.03 -0.57 0.00 -1.00 0.00 0.00 59.36 57.82 2dno h GLU 69 Cb 0.00 0.09 0.14 0.00 0.50 0.00 0.00 28.75 29.48 2dno h GLU 69 CO 0.00 -0.27 0.25 -0.40 -1.00 0.00 0.00 179.01 177.59 2dno n ASP 70 N -5.42 1.50 0.03 1.42 5.75 -1.26 -4.87 116.55 113.69 2dno n ASP 70 Ca -0.03 0.98 0.00 0.00 -0.01 0.00 0.00 54.79 55.73 2dno n ASP 70 Cb 0.36 -1.41 0.00 0.00 -1.03 0.00 0.00 41.12 39.04 2dno n ASP 70 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 2dno n ARG 71 N -0.27 0.00 -1.06 0.11 1.74 -1.26 -4.75 116.66 111.17 2dno n ARG 71 Ca 0.10 0.00 -0.38 0.00 -0.77 0.00 0.00 57.85 56.80 2dno n ARG 71 Cb 0.42 -0.31 -0.03 0.00 -1.02 0.00 0.00 32.46 31.51 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 -3.02 0.00 -4.96 5.56 4.81 -1.26 -4.59 118.16 114.70 2dno n LYS 72 Ca 0.00 0.00 -0.29 0.00 -0.87 0.00 0.00 58.31 57.15 2dno n LYS 72 Cb 0.22 -0.84 -0.15 0.00 0.02 0.00 0.00 35.03 34.28 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 1.68 2.13 -0.37 3.14 1.43 0.72 -2.43 118.68 124.98 2dno s LEU 73 Ca 0.53 -0.53 -0.13 0.00 -1.03 0.00 0.00 54.13 52.97 2dno s LEU 73 Cb -0.76 -1.22 0.01 0.00 0.03 0.00 0.00 46.19 44.25 2dno s LEU 73 CO 0.42 0.25 0.25 0.12 0.23 0.00 0.00 176.35 177.62 2dno s PHE 74 N -0.73 3.23 0.06 0.29 2.19 0.90 -1.26 117.98 122.66 2dno s PHE 74 Ca 0.10 -0.57 -0.01 0.00 0.33 0.00 0.00 56.93 56.78 2dno s PHE 74 Cb -0.10 -2.50 -0.04 0.00 -1.31 0.00 0.00 43.02 39.07 2dno s PHE 74 CO 0.01 -0.53 0.23 0.08 1.83 0.00 0.00 175.22 176.85 2dno s VAL 75 N 1.65 5.36 0.33 3.12 1.01 -0.09 -2.05 120.40 129.75 2dno s VAL 75 Ca 0.05 -0.26 0.02 0.00 0.00 0.00 0.00 61.98 61.79 2dno s VAL 75 Cb -0.18 -3.61 -0.01 0.00 0.00 0.00 0.00 36.38 32.57 2dno s VAL 75 CO 0.09 0.17 0.37 -0.83 0.00 0.00 0.00 175.10 174.90 2dno s GLY 76 N -2.36 1.88 -1.18 4.51 0.00 0.10 -1.86 107.32 108.42 2dno s GLY 76 Ca 0.34 -1.79 -0.03 0.00 0.00 0.00 0.00 44.72 43.24 2dno s GLY 76 CO 0.25 -1.24 1.01 1.03 0.00 0.00 0.00 173.10 174.15 2dno n MET 77 N -0.58 -6.72 -3.21 2.90 2.81 0.77 -2.84 117.12 110.26 2dno n MET 77 Ca 0.04 0.79 -0.18 0.00 -1.81 0.00 0.00 57.70 56.54 2dno n MET 77 Cb 0.62 -5.66 0.00 0.00 -0.71 0.00 0.00 33.22 27.48 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 -6.42 3.79 0.22 4.03 1.43 0.85 -4.66 118.68 117.94 2dno s LEU 78 Ca 0.23 -0.30 0.11 0.00 -1.03 0.00 0.00 54.13 53.14 2dno s LEU 78 Cb -0.10 -2.71 -0.05 0.00 0.03 0.00 0.00 46.19 43.36 2dno s LEU 78 CO 0.68 -0.62 -0.21 -0.83 0.23 0.00 0.00 176.35 175.60 2dno s GLY 79 N -4.27 1.73 0.12 -3.19 0.00 -1.26 -4.36 107.32 96.09 2dno s GLY 79 Ca 0.51 -1.72 -0.25 0.00 0.00 0.00 0.00 44.72 43.25 2dno s GLY 79 CO 0.32 -1.78 1.65 1.70 0.00 0.00 0.00 173.10 175.00 2dno h LYS 80 N 2.81 -0.33 -0.39 2.90 1.63 -1.92 -3.04 116.57 118.23 2dno h LYS 80 Ca -0.43 0.02 0.04 0.00 -0.85 0.00 0.00 60.65 59.43 2dno h LYS 80 Cb 1.23 0.07 -0.05 0.00 -0.60 0.00 0.00 32.23 32.89 2dno h LYS 80 CO 0.54 -0.22 -0.23 1.04 -3.45 0.00 0.00 179.45 177.13 2dno n GLN 81 N -5.33 -0.17 -1.21 1.90 3.00 -1.26 -4.46 117.38 109.84 2dno n GLN 81 Ca -0.05 0.99 -0.36 0.00 -0.01 0.00 0.00 57.00 57.57 2dno n GLN 81 Cb 0.25 -1.46 0.07 0.00 0.00 0.00 0.00 30.24 29.10 2dno n GLN 81 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.06 178.10 2dno n GLN 82 N -3.87 0.23 -4.24 -1.09 1.13 -1.15 -5.02 117.38 103.37 2dno n GLN 82 Ca 0.01 0.12 -0.14 0.00 -1.94 0.00 0.00 57.00 55.05 2dno n GLN 82 Cb 0.10 -1.79 -0.10 0.00 0.11 0.00 0.00 30.24 28.56 2dno n GLN 82 CO 0.00 0.00 0.00 -0.08 -1.44 0.00 0.00 177.06 175.54 2dno s THR 83 N -1.96 0.32 0.59 5.09 -1.32 -1.26 -4.91 115.64 112.19 2dno s THR 83 Ca 0.64 -1.98 0.31 0.00 -1.21 0.00 0.00 61.69 59.44 2dno s THR 83 Cb -0.34 -2.43 0.43 0.00 -1.51 0.00 0.00 72.50 68.65 2dno s THR 83 CO 0.60 -0.13 1.68 0.44 -2.21 0.00 0.00 174.62 174.99 2dno h ASP 84 N 2.58 0.00 -0.12 8.08 3.32 -1.97 0.42 116.42 128.73 2dno h ASP 84 Ca -0.37 0.00 -0.12 0.00 0.02 0.00 0.00 57.03 56.56 2dno h ASP 84 Cb 1.24 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.79 2dno h ASP 84 CO 0.58 0.00 -0.38 -0.08 -1.72 0.00 0.00 179.24 177.64 2dno h GLU 85 N 0.00 0.47 0.77 3.56 4.81 -1.99 -2.91 114.58 119.30 2dno h GLU 85 Ca 0.39 -0.35 -0.04 0.00 -0.13 0.00 0.00 59.36 59.24 2dno h GLU 85 Cb 2.02 0.06 0.01 0.00 0.63 0.00 0.00 28.75 31.47 2dno h GLU 85 CO -0.00 0.97 -0.37 -0.44 -0.73 0.00 0.00 179.01 178.43 2dno h ASP 86 N 0.07 -0.88 -0.67 1.04 3.32 -0.56 -2.15 116.42 116.58 2dno h ASP 86 Ca -0.01 0.03 0.11 0.00 0.02 0.00 0.00 57.03 57.18 2dno h ASP 86 Cb 1.01 0.23 -0.12 0.00 0.22 0.00 0.00 39.33 40.66 2dno h ASP 86 CO 0.08 -0.60 -0.37 0.58 -1.72 0.00 0.00 179.24 177.20 2dno h VAL 87 N -1.08 0.11 0.01 -1.35 2.07 -1.59 1.05 116.25 115.47 2dno h VAL 87 Ca -0.11 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.42 2dno h VAL 87 Cb 0.79 0.11 -0.02 0.00 -1.52 0.00 0.00 31.29 30.66 2dno h VAL 87 CO 0.17 0.00 -0.20 -0.09 0.02 0.00 0.00 177.57 177.48 2dno h ARG 88 N -0.14 -0.24 -0.00 1.57 2.43 -1.50 0.68 114.38 117.17 2dno h ARG 88 Ca 0.24 0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.43 2dno h ARG 88 Cb 0.56 0.06 -0.00 0.00 -0.42 0.00 0.00 29.97 30.17 2dno h ARG 88 CO -0.75 -0.16 0.03 0.87 -1.51 0.00 0.00 179.97 178.45 2dno h LYS 89 N -0.25 0.00 0.00 0.20 1.57 -0.83 0.28 116.57 117.54 2dno h LYS 89 Ca 0.00 0.00 -0.08 0.00 -1.87 0.00 0.00 60.65 58.71 2dno h LYS 89 Cb 0.27 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.57 2dno h LYS 89 CO -0.13 0.00 -0.60 1.98 -0.57 0.00 0.00 179.45 180.14 2dno h MET 90 N 0.00 0.00 -0.01 3.15 4.05 0.31 -3.28 114.93 119.14 2dno h MET 90 Ca 0.00 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.42 2dno h MET 90 Cb 0.05 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 30.85 2dno h MET 90 CO -0.00 0.27 -0.35 1.19 0.23 0.00 0.00 176.91 178.26 2dno n PHE 91 N -3.06 0.00 -0.14 1.39 3.01 0.22 -4.46 117.46 114.42 2dno n PHE 91 Ca 0.00 0.00 -0.11 0.00 1.01 0.00 0.00 57.45 58.35 2dno n PHE 91 Cb 0.68 0.00 -0.02 0.00 -0.01 0.00 0.00 39.48 40.13 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 1.85 0.80 0.00 -1.08 5.08 -0.64 -2.92 114.58 117.67 2dno h GLU 92 Ca 0.00 -0.32 0.00 0.00 -1.00 0.00 0.00 59.36 58.04 2dno h GLU 92 Cb 0.56 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.77 2dno h GLU 92 CO 0.00 0.94 0.44 -2.30 -1.00 0.00 0.00 179.01 177.09 2dno n PRO 93 N -4.30 0.06 -0.81 2.33 -0.02 -1.26 0.12 135.00 131.11 2dno n PRO 93 Ca -0.01 0.51 0.00 0.00 -2.02 0.00 0.00 63.50 61.98 2dno n PRO 93 Cb 0.38 -2.13 0.18 0.00 -0.02 0.00 0.00 33.50 31.91 2dno n PRO 93 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 2dno n PHE 94 N -1.89 0.54 0.00 6.00 3.72 -1.10 -5.06 117.46 119.66 2dno n PHE 94 Ca -0.01 -1.62 0.00 0.00 -0.05 0.00 0.00 57.45 55.78 2dno n PHE 94 Cb 0.45 -0.31 0.00 0.00 -0.94 0.00 0.00 39.48 38.68 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 -1.07 2.46 3.79 1.37 0.00 0.32 -4.43 105.19 107.63 2dno n GLY 95 Ca 0.25 -2.07 -0.38 0.00 0.00 0.00 0.00 46.02 43.82 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 -1.85 4.97 -0.13 2.61 2.01 -1.26 -4.03 115.64 117.95 2dno s THR 96 Ca 0.00 1.04 -0.09 0.00 0.31 0.00 0.00 61.69 62.94 2dno s THR 96 Cb 0.00 -3.82 -0.05 0.00 0.01 0.00 0.00 72.50 68.64 2dno s THR 96 CO 0.00 0.48 0.18 -0.63 -0.69 0.00 0.00 174.62 173.97 2dno s ILE 97 N -0.52 5.41 -0.14 1.82 1.01 -1.26 0.12 121.20 127.64 2dno s ILE 97 Ca 0.27 0.31 0.12 0.00 0.00 0.00 0.00 60.65 61.35 2dno s ILE 97 Cb -0.17 -3.48 -0.24 0.00 0.01 0.00 0.00 42.46 38.58 2dno s ILE 97 CO 0.15 0.54 0.31 0.47 0.00 0.00 0.00 174.94 176.40 2dno n ASP 98 N 2.57 0.70 -3.87 3.58 8.00 0.70 -4.89 116.55 123.33 2dno n ASP 98 Ca -0.17 0.17 -0.10 0.00 0.71 0.00 0.00 54.79 55.40 2dno n ASP 98 Cb 0.54 0.30 -0.06 0.00 -0.02 0.00 0.00 41.12 41.87 2dno n ASP 98 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 2dno s GLU 99 N -2.54 1.18 -0.29 -1.24 0.41 -1.18 -5.03 118.70 110.01 2dno s GLU 99 Ca -0.11 -1.04 -0.22 0.00 -0.41 0.00 0.00 54.97 53.18 2dno s GLU 99 Cb 0.07 0.42 0.15 0.00 -1.78 0.00 0.00 34.13 32.99 2dno s GLU 99 CO 0.80 -0.45 1.14 0.00 -0.49 0.00 0.00 175.26 176.27 2dno s THR 101 N 0.49 -0.02 -0.22 0.00 2.01 -0.84 -5.00 115.64 112.06 2dno s THR 101 Ca 0.01 0.07 -0.21 0.00 0.31 0.00 0.00 61.69 61.86 2dno s THR 101 Cb -0.04 -0.71 -0.02 0.00 0.01 0.00 0.00 72.50 71.73 2dno s THR 101 CO -0.11 0.03 0.64 -0.69 -0.69 0.00 0.00 174.62 173.80 2dno s VAL 102 N 1.43 4.99 0.28 3.82 1.01 -1.26 -0.74 120.40 129.93 2dno s VAL 102 Ca -0.09 1.19 -0.29 0.00 0.00 0.00 0.00 61.98 62.78 2dno s VAL 102 Cb -0.07 -3.95 -0.10 0.00 0.00 0.00 0.00 36.38 32.26 2dno s VAL 102 CO -0.14 0.07 1.32 -0.76 0.00 0.00 0.00 175.10 175.58 2dno s LEU 103 N 2.21 4.43 0.22 3.92 1.43 -0.13 -4.96 118.68 125.79 2dno s LEU 103 Ca 0.28 2.60 -0.03 0.00 -1.03 0.00 0.00 54.13 55.95 2dno s LEU 103 Cb -0.16 -3.63 -0.03 0.00 0.03 0.00 0.00 46.19 42.40 2dno s LEU 103 CO 0.09 -0.54 0.20 -0.13 0.23 0.00 0.00 176.35 176.21 2dno s ARG 104 N -1.13 1.29 0.00 1.70 0.52 -1.26 -3.02 118.95 117.05 2dno s ARG 104 Ca 0.52 -1.58 0.00 0.00 -0.52 0.00 0.00 55.73 54.15 2dno s ARG 104 Cb -0.39 0.31 0.00 0.00 0.52 0.00 0.00 34.95 35.39 2dno s ARG 104 CO 0.47 -0.45 0.00 0.41 0.02 0.00 0.00 175.30 175.75 2dno n GLY 105 N -0.31 1.03 0.10 -3.53 0.00 -1.09 -4.92 105.19 96.48 2dno n GLY 105 Ca 0.02 -1.56 -0.16 0.00 0.00 0.00 0.00 46.02 44.31 2dno n GLY 105 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dno h PRO 106 N 0.00 0.20 0.05 1.61 0.13 -2.03 -3.36 132.00 128.60 2dno h PRO 106 Ca 0.00 -0.23 -0.00 0.00 -0.87 0.00 0.00 66.00 64.90 2dno h PRO 106 Cb 0.00 0.07 0.00 0.00 0.13 0.00 0.00 31.00 31.20 2dno h PRO 106 CO 0.00 0.98 -0.02 0.22 -0.23 0.00 0.00 178.00 178.95 2dno h ASP 107 N -0.49 -0.05 0.00 1.44 1.82 -2.07 -3.47 116.42 113.60 2dno h ASP 107 Ca -0.04 -0.24 0.00 0.00 -0.39 0.00 0.00 57.03 56.36 2dno h ASP 107 Cb 1.11 0.01 0.00 0.00 0.68 0.00 0.00 39.33 41.13 2dno h ASP 107 CO 0.06 0.21 0.00 0.61 -1.61 0.00 0.00 179.24 178.51 2dno n GLY 108 N -0.42 0.38 3.69 -0.78 0.00 -1.26 -5.15 105.19 101.64 2dno n GLY 108 Ca -0.08 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.59 2dno n GLY 108 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2dno s THR 109 N -0.63 4.70 -0.59 2.61 -1.32 -1.26 -4.89 115.64 114.27 2dno s THR 109 Ca 0.00 -0.08 -0.26 0.00 -1.21 0.00 0.00 61.69 60.13 2dno s THR 109 Cb 0.00 -3.06 -0.03 0.00 -1.51 0.00 0.00 72.50 67.90 2dno s THR 109 CO 0.00 0.54 2.00 -0.94 -2.21 0.00 0.00 174.62 174.01 2dno s SER 110 N -0.30 5.05 0.61 8.08 1.04 -1.26 -2.67 113.70 124.24 2dno s SER 110 Ca 0.08 0.50 0.29 0.00 0.48 0.00 0.00 55.95 57.30 2dno s SER 110 Cb -0.12 -2.52 1.52 0.00 0.10 0.00 0.00 66.02 65.00 2dno s SER 110 CO 0.02 -2.52 1.92 0.11 0.98 0.00 0.00 173.24 173.74 2dno h LYS 111 N 16.07 0.00 0.00 4.02 1.79 -1.89 -3.43 116.57 133.13 2dno h LYS 111 Ca -0.25 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.22 2dno h LYS 111 Cb 1.19 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.84 2dno h LYS 111 CO 1.20 0.00 0.00 0.41 -1.08 0.00 0.00 179.45 179.98 2dno n GLY 112 N -1.43 1.85 3.17 3.86 0.00 -1.26 -4.84 105.19 106.53 2dno n GLY 112 Ca 0.05 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.98 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 -3.07 -1.70 -0.22 0.00 0.00 -0.78 -0.96 121.76 115.03 2dno s ALA 114 Ca -0.01 0.98 -0.09 0.00 0.00 0.00 0.00 51.96 52.84 2dno s ALA 114 Cb 0.01 0.36 -0.04 0.00 0.00 0.00 0.00 23.12 23.45 2dno s ALA 114 CO -0.07 -0.53 0.11 -0.06 0.00 0.00 0.00 175.76 175.21 2dno s PHE 115 N -2.24 3.28 -0.19 0.00 0.08 0.08 -0.91 117.98 118.08 2dno s PHE 115 Ca -0.06 0.12 -0.01 0.00 0.12 0.00 0.00 56.93 57.10 2dno s PHE 115 Cb -0.00 -2.19 0.01 0.00 -0.57 0.00 0.00 43.02 40.26 2dno s PHE 115 CO 0.01 0.08 -0.13 0.08 -0.10 0.00 0.00 175.22 175.16 2dno s VAL 116 N 0.79 2.68 -0.37 -0.44 1.01 -0.39 -1.98 120.40 121.71 2dno s VAL 116 Ca 0.06 -0.73 -0.12 0.00 0.00 0.00 0.00 61.98 61.18 2dno s VAL 116 Cb -0.13 -2.17 0.01 0.00 0.00 0.00 0.00 36.38 34.09 2dno s VAL 116 CO 0.02 0.49 0.23 -0.75 0.00 0.00 0.00 175.10 175.09 2dno s LYS 117 N 1.31 3.07 0.59 2.72 2.20 -0.54 -0.20 119.74 128.90 2dno s LYS 117 Ca 0.04 -0.92 -0.07 0.00 -0.36 0.00 0.00 55.97 54.66 2dno s LYS 117 Cb -0.14 -3.78 0.00 0.00 -1.51 0.00 0.00 37.83 32.40 2dno s LYS 117 CO -0.07 -0.62 0.92 -0.06 -0.36 0.00 0.00 175.35 175.16 2dno s PHE 118 N 1.63 3.32 0.24 4.03 0.40 -1.26 -0.22 117.98 126.12 2dno s PHE 118 Ca 0.04 0.75 -0.02 0.00 -0.60 0.00 0.00 56.93 57.10 2dno s PHE 118 Cb -0.18 -2.73 0.28 0.00 0.51 0.00 0.00 43.02 40.90 2dno s PHE 118 CO 0.08 -0.80 1.68 0.37 0.70 0.00 0.00 175.22 177.25 2dno h GLN 119 N -0.20 0.67 -3.82 0.44 4.15 -0.67 -3.42 115.11 112.27 2dno h GLN 119 Ca -0.45 -0.25 -0.09 0.00 0.77 0.00 0.00 58.65 58.62 2dno h GLN 119 Cb 1.25 -0.04 -0.13 0.00 0.21 0.00 0.00 27.48 28.77 2dno h GLN 119 CO 0.61 0.83 -0.32 0.95 -1.93 0.00 0.00 178.83 178.97 2dno s THR 120 N -4.61 0.09 0.07 2.39 -4.23 -1.26 -5.06 115.64 103.03 2dno s THR 120 Ca -0.08 -1.26 -0.33 0.00 -1.18 0.00 0.00 61.69 58.83 2dno s THR 120 Cb 0.13 -1.63 -0.19 0.00 1.34 0.00 0.00 72.50 72.16 2dno s THR 120 CO 0.82 -0.42 1.62 -0.74 -0.54 0.00 0.00 174.62 175.36 2dno h HIS 121 N 2.60 -0.86 -0.76 3.99 -0.00 -1.85 -2.59 115.15 115.69 2dno h HIS 121 Ca -0.33 -0.02 0.14 0.00 -0.00 0.00 0.00 60.37 60.16 2dno h HIS 121 Cb 1.22 0.28 -0.13 0.00 -0.00 0.00 0.00 27.41 28.78 2dno h HIS 121 CO 0.40 -0.53 -0.23 0.00 -0.00 0.00 0.00 177.93 177.57 2dno n ALA 122 N -2.49 0.07 0.24 5.26 0.00 -1.26 0.22 120.51 122.55 2dno n ALA 122 Ca -0.14 0.80 -0.15 0.00 0.00 0.00 0.00 53.44 53.95 2dno n ALA 122 Cb 0.37 -0.43 -0.08 0.00 0.00 0.00 0.00 19.45 19.31 2dno n ALA 122 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 2dno h GLU 123 N 0.00 -0.56 -0.85 0.00 4.39 -1.79 -2.65 114.58 113.13 2dno h GLU 123 Ca 0.32 0.04 0.18 0.00 0.34 0.00 0.00 59.36 60.24 2dno h GLU 123 Cb 0.51 0.13 -0.16 0.00 -0.10 0.00 0.00 28.75 29.13 2dno h GLU 123 CO -0.77 -0.31 -0.18 0.00 -1.16 0.00 0.00 179.01 176.59 2dno h ALA 124 N -0.15 0.62 -0.97 3.43 0.00 0.17 0.56 119.26 122.92 2dno h ALA 124 Ca -0.06 0.32 0.02 0.00 0.00 0.00 0.00 54.91 55.20 2dno h ALA 124 Cb 0.50 0.62 -0.05 0.00 0.00 0.00 0.00 17.79 18.86 2dno h ALA 124 CO 0.10 -0.41 0.64 0.37 0.00 0.00 0.00 179.25 179.95 2dno h GLN 125 N 0.01 1.24 -0.15 0.00 -0.00 -1.08 -2.83 115.11 112.31 2dno h GLN 125 Ca 0.42 -0.07 0.05 0.00 -0.00 0.00 0.00 58.65 59.04 2dno h GLN 125 Cb 0.67 -0.28 -0.07 0.00 0.00 0.00 0.00 27.48 27.80 2dno h GLN 125 CO -0.86 0.82 -0.34 0.00 0.00 0.00 0.00 178.83 178.46 2dno h ALA 126 N 1.41 -0.40 0.05 3.38 0.00 0.49 -0.58 119.26 123.61 2dno h ALA 126 Ca 0.37 0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.30 2dno h ALA 126 Cb -0.08 0.64 -0.01 0.00 0.00 0.00 0.00 17.79 18.35 2dno h ALA 126 CO -0.10 -0.81 -0.09 0.00 0.00 0.00 0.00 179.25 178.25 2dno h ALA 127 N 0.39 -0.71 -0.96 0.00 0.00 -1.24 -2.90 119.26 113.84 2dno h ALA 127 Ca 0.10 -0.03 0.14 0.00 0.00 0.00 0.00 54.91 55.12 2dno h ALA 127 Cb 0.56 0.44 -0.15 0.00 0.00 0.00 0.00 17.79 18.64 2dno h ALA 127 CO -0.37 -0.73 -0.42 0.82 0.00 0.00 0.00 179.25 178.55 2dno h ILE 128 N -0.15 0.01 -0.95 0.00 2.04 -1.44 1.43 117.51 118.45 2dno h ILE 128 Ca -0.01 0.00 0.40 0.00 1.00 0.00 0.00 64.86 66.25 2dno h ILE 128 Cb 0.14 0.01 -0.17 0.00 -0.74 0.00 0.00 36.82 36.06 2dno h ILE 128 CO -0.03 0.00 0.52 -3.20 0.00 0.00 0.00 178.15 175.44 2dno n ASN 129 N -5.44 0.33 -0.00 1.72 5.15 -0.24 -0.96 115.26 115.82 2dno n ASN 129 Ca 0.08 1.56 -0.00 0.00 -0.60 0.00 0.00 54.58 55.62 2dno n ASN 129 Cb 0.38 -0.76 -0.00 0.00 -0.53 0.00 0.00 39.78 38.86 2dno n ASN 129 CO 0.00 0.00 0.00 0.41 1.40 0.00 0.00 177.26 179.07 2dno n THR 130 N -5.12 0.08 -0.30 -0.44 -1.04 0.22 -4.71 114.28 102.96 2dno n THR 130 Ca 0.36 0.29 0.03 0.00 -2.04 0.00 0.00 64.05 62.69 2dno n THR 130 Cb 1.23 -1.34 0.08 0.00 -1.82 0.00 0.00 70.33 68.48 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 -2.58 -0.38 -4.53 -4.42 4.77 0.43 -3.98 117.00 106.31 2dno n LEU 131 Ca -0.00 1.40 -0.65 0.00 -0.03 0.00 0.00 56.01 56.73 2dno n LEU 131 Cb 0.02 -0.38 -0.11 0.00 -2.33 0.00 0.00 43.42 40.62 2dno n LEU 131 CO 0.01 -1.31 1.34 1.57 -1.33 0.00 0.00 177.39 177.67 2dno n HIS 132 N -5.27 1.53 -4.03 -1.77 -0.00 -0.13 0.28 115.22 105.84 2dno n HIS 132 Ca 0.11 1.01 -0.29 0.00 0.46 0.00 0.00 57.72 59.00 2dno n HIS 132 Cb 0.37 -2.23 -0.03 0.00 -0.12 0.00 0.00 29.99 27.99 2dno n HIS 132 CO 0.00 0.00 0.00 0.45 0.46 0.00 0.00 176.34 177.25 2dno n SER 133 N 5.17 -0.89 0.00 0.26 2.88 0.68 -4.91 113.62 116.80 2dno n SER 133 Ca 0.39 -1.10 0.00 0.00 -1.33 0.00 0.00 58.87 56.83 2dno n SER 133 Cb -0.05 -2.60 0.00 0.00 -0.75 0.00 0.00 64.21 60.81 2dno n SER 133 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 2dno n SER 134 N -2.85 0.00 -5.02 -3.46 2.88 0.14 -4.84 113.62 100.47 2dno n SER 134 Ca -0.27 0.01 -0.18 0.00 -1.33 0.00 0.00 58.87 57.09 2dno n SER 134 Cb 0.67 -0.28 0.04 0.00 -0.75 0.00 0.00 64.21 63.89 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 -0.55 2.54 -0.42 -1.46 1.70 -1.26 -4.86 118.95 114.64 2dno s ARG 135 Ca 0.00 -1.46 0.02 0.00 -0.47 0.00 0.00 55.73 53.82 2dno s ARG 135 Cb 0.00 -2.70 0.14 0.00 -0.57 0.00 0.00 34.95 31.83 2dno s ARG 135 CO 0.00 -0.59 0.26 0.99 -1.08 0.00 0.00 175.30 174.88 2dno s THR 136 N -2.52 0.90 0.34 4.99 2.01 -1.26 -0.39 115.64 119.70 2dno s THR 136 Ca 0.59 -2.40 -0.25 0.00 0.31 0.00 0.00 61.69 59.94 2dno s THR 136 Cb -0.08 -1.63 -0.14 0.00 0.01 0.00 0.00 72.50 70.66 2dno s THR 136 CO 0.36 -0.99 0.68 0.18 -0.69 0.00 0.00 174.62 174.16 2dno n LEU 137 N 3.49 0.30 -4.62 4.42 4.77 -1.26 -4.72 117.00 119.37 2dno n LEU 137 Ca 0.14 1.03 -0.57 0.00 -0.03 0.00 0.00 56.01 56.58 2dno n LEU 137 Cb 0.38 -1.14 -0.08 0.00 -2.33 0.00 0.00 43.42 40.25 2dno n LEU 137 CO 0.18 -2.45 1.45 -2.65 -1.33 0.00 0.00 177.39 172.59 2dno n PRO 138 N 0.71 0.97 -1.82 3.23 -0.02 -1.26 -2.38 135.00 134.43 2dno n PRO 138 Ca 0.12 0.34 -0.00 0.00 -2.02 0.00 0.00 63.50 61.93 2dno n PRO 138 Cb 0.35 -2.08 0.00 0.00 -0.02 0.00 0.00 33.50 31.75 2dno n PRO 138 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2dno n GLY 139 N 4.94 0.62 2.62 -1.23 0.00 -1.26 -4.86 105.19 106.01 2dno n GLY 139 Ca 0.32 -0.37 -0.26 0.00 0.00 0.00 0.00 46.02 45.72 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 -3.01 0.45 0.00 4.61 0.00 -1.00 -4.86 121.76 117.95 2dno s ALA 140 Ca 0.01 -0.32 0.00 0.00 0.00 0.00 0.00 51.96 51.65 2dno s ALA 140 Cb -0.00 -1.04 0.00 0.00 0.00 0.00 0.00 23.12 22.08 2dno s ALA 140 CO 0.02 -1.17 0.43 0.45 0.00 0.00 0.00 175.76 175.50 2dno n SER 141 N 5.27 0.00 -3.61 0.00 2.88 -1.26 -4.61 113.62 112.29 2dno n SER 141 Ca -0.07 0.43 -0.11 0.00 -1.33 0.00 0.00 58.87 57.79 2dno n SER 141 Cb 0.49 -0.13 0.04 0.00 -0.75 0.00 0.00 64.21 63.86 2dno n SER 141 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 2dno n SER 142 N -1.58 1.14 -3.74 -3.46 7.64 -1.26 -5.12 113.62 107.24 2dno n SER 142 Ca 0.00 -1.83 -0.30 0.00 1.01 0.00 0.00 58.87 57.74 2dno n SER 142 Cb 0.00 -0.24 0.24 0.00 -1.01 0.00 0.00 64.21 63.19 2dno n SER 142 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2dno s SER 143 N -3.01 1.49 -0.74 6.43 0.01 -1.26 -4.80 113.70 111.82 2dno s SER 143 Ca 0.34 0.33 -0.26 0.00 1.31 0.00 0.00 55.95 57.68 2dno s SER 143 Cb -0.03 -0.37 -0.07 0.00 0.21 0.00 0.00 66.02 65.76 2dno s SER 143 CO 0.22 -3.74 2.12 -0.22 0.41 0.00 0.00 173.24 172.02 2dno s LEU 144 N -6.58 3.15 -0.15 2.44 2.96 0.47 -4.69 118.68 116.28 2dno s LEU 144 Ca 0.74 0.02 -0.29 0.00 -0.22 0.00 0.00 54.13 54.38 2dno s LEU 144 Cb -0.05 -2.54 -0.03 0.00 0.50 0.00 0.00 46.19 44.07 2dno s LEU 144 CO 0.55 -2.98 1.53 -0.69 -1.32 0.00 0.00 176.35 173.44 2dno s VAL 145 N 11.42 3.81 -0.10 1.68 1.01 -1.13 -0.23 120.40 136.86 2dno s VAL 145 Ca 0.80 0.96 -0.00 0.00 0.00 0.00 0.00 61.98 63.73 2dno s VAL 145 Cb -0.11 -3.70 0.02 0.00 0.00 0.00 0.00 36.38 32.59 2dno s VAL 145 CO 0.11 -0.17 -0.08 -0.69 0.00 0.00 0.00 175.10 174.27 2dno s VAL 146 N 4.32 0.97 0.33 2.92 1.01 -1.26 0.03 120.40 128.72 2dno s VAL 146 Ca 0.67 -0.28 0.02 0.00 0.00 0.00 0.00 61.98 62.39 2dno s VAL 146 Cb -0.27 -0.99 -0.01 0.00 0.00 0.00 0.00 36.38 35.12 2dno s VAL 146 CO 0.25 0.35 0.40 2.29 0.00 0.00 0.00 175.10 178.40 2dno n LYS 147 N 4.77 0.58 -2.87 2.72 2.85 -0.87 -4.63 118.16 120.71 2dno n LYS 147 Ca -0.14 -2.89 -0.32 0.00 -1.05 0.00 0.00 58.31 53.92 2dno n LYS 147 Cb 0.50 2.62 -0.05 0.00 -0.65 0.00 0.00 35.03 37.45 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 -3.10 3.41 -0.84 5.58 0.40 -1.26 -0.07 117.98 122.11 2dno s PHE 148 Ca 0.32 1.25 -0.12 0.00 -0.60 0.00 0.00 56.93 57.79 2dno s PHE 148 Cb 0.00 -2.59 0.22 0.00 0.51 0.00 0.00 43.02 41.16 2dno s PHE 148 CO 0.23 -0.08 0.77 0.00 0.70 0.00 0.00 175.22 176.83 2dno s ALA 149 N -2.26 4.10 -0.51 5.36 0.00 -1.02 -4.44 121.76 123.00 2dno s ALA 149 Ca 0.55 -3.40 0.04 0.00 0.00 0.00 0.00 51.96 49.15 2dno s ALA 149 Cb -0.10 -3.39 0.16 0.00 0.00 0.00 0.00 23.12 19.79 2dno s ALA 149 CO 0.24 -2.25 0.37 0.34 0.00 0.00 0.00 175.76 174.47 2dno s ASP 150 N 1.79 2.82 0.06 0.00 2.15 -1.26 -4.89 116.67 117.33 2dno s ASP 150 Ca 0.20 -3.25 -0.09 0.00 0.43 0.00 0.00 52.55 49.84 2dno s ASP 150 Cb -0.11 -0.89 -0.06 0.00 -0.30 0.00 0.00 42.92 41.57 2dno s ASP 150 CO -0.08 -0.16 0.37 0.28 -0.17 0.00 0.00 175.17 175.41 2dno s THR 151 N -0.37 5.14 -0.29 1.71 -1.32 -1.26 -5.09 115.64 114.17 2dno s THR 151 Ca 0.28 0.39 -0.17 0.00 -1.21 0.00 0.00 61.69 60.98 2dno s THR 151 Cb -0.03 -3.63 0.13 0.00 -1.51 0.00 0.00 72.50 67.46 2dno s THR 151 CO -0.16 0.31 0.94 -0.70 -2.21 0.00 0.00 174.62 172.80 2dno s GLU 152 N -1.86 0.45 -0.45 7.08 -6.30 -1.26 -5.13 118.70 111.22 2dno s GLU 152 Ca 0.32 0.74 -0.15 0.00 -2.50 0.00 0.00 54.97 53.38 2dno s GLU 152 Cb -0.14 0.11 0.06 0.00 0.00 0.00 0.00 34.13 34.16 2dno s GLU 152 CO 0.18 -0.09 0.36 0.21 0.02 0.00 0.00 175.26 175.94 2dno s LYS 153 N 1.26 2.96 0.42 4.30 2.20 -1.26 -5.06 119.74 124.57 2dno s LYS 153 Ca -0.08 -1.25 -0.26 0.00 -0.36 0.00 0.00 55.97 54.02 2dno s LYS 153 Cb -0.04 -4.07 -0.09 0.00 -1.51 0.00 0.00 37.83 32.12 2dno s LYS 153 CO -0.15 -0.94 1.43 -1.21 -0.36 0.00 0.00 175.35 174.13 2dno s GLU 154 N 1.65 3.85 -0.15 4.03 8.01 -1.26 -4.97 118.70 129.86 2dno s GLU 154 Ca 0.04 2.44 -0.10 0.00 0.01 0.00 0.00 54.97 57.36 2dno s GLU 154 Cb -0.23 -2.76 -0.05 0.00 -4.31 0.00 0.00 34.13 26.78 2dno s GLU 154 CO 0.08 -0.69 -0.09 1.03 0.01 0.00 0.00 175.26 175.59 2dno h SER 155 N 2.57 0.00 -2.09 -0.19 0.87 -2.09 -3.51 113.55 109.12 2dno h SER 155 Ca -0.51 -0.09 0.00 0.00 -1.23 0.00 0.00 61.79 59.96 2dno h SER 155 Cb 1.26 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.22 2dno h SER 155 CO 0.62 0.84 0.00 0.61 -0.53 0.00 0.00 176.83 178.37 2dno n GLY 156 N 1.61 -2.00 3.38 5.77 0.00 -1.26 -5.00 105.19 107.68 2dno n GLY 156 Ca -0.10 -0.47 -0.39 0.00 0.00 0.00 0.00 46.02 45.06 2dno n GLY 156 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2dno n PRO 157 N 0.17 0.31 -2.08 1.61 -0.02 -1.26 -4.75 135.00 128.99 2dno n PRO 157 Ca 0.00 0.12 -0.28 0.00 -2.02 0.00 0.00 63.50 61.32 2dno n PRO 157 Cb 0.00 -1.39 -0.05 0.00 -0.02 0.00 0.00 33.50 32.04 2dno n PRO 157 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 2dno s SER 158 N -1.07 5.16 -0.00 2.55 0.15 -1.26 -4.82 113.70 114.40 2dno s SER 158 Ca 0.63 -1.19 -0.29 0.00 0.70 0.00 0.00 55.95 55.81 2dno s SER 158 Cb -0.50 -2.57 0.10 0.00 -1.71 0.00 0.00 66.02 61.34 2dno s SER 158 CO 0.59 -2.84 0.90 -0.55 1.20 0.00 0.00 173.24 172.55 2dno s SER 159 N 7.17 -0.34 0.00 5.45 0.15 -1.26 -5.36 113.70 119.50 2dno s SER 159 Ca 0.68 -0.03 0.00 0.00 0.70 0.00 0.00 55.95 57.31 2dno s SER 159 Cb -0.04 0.38 0.00 0.00 -1.71 0.00 0.00 66.02 64.66 2dno s SER 159 CO 0.06 -0.63 0.00 0.61 1.20 0.00 0.00 173.24 174.48