#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ism n LEU 66 N 0.00 1.08 -4.40 -3.43 7.94 -1.26 -4.85 117.00 112.08 3ism n LEU 66 Ca 0.00 -0.32 -0.21 0.00 -1.11 0.00 0.00 56.01 54.37 3ism n LEU 66 Cb 0.00 -0.06 -0.09 0.00 0.53 0.00 0.00 43.42 43.80 3ism n LEU 66 CO 0.00 0.19 -0.19 0.42 -1.11 0.00 0.00 177.39 176.69 3ism s THR 67 N -2.21 0.45 0.14 1.96 -4.23 -1.26 -4.89 115.64 105.61 3ism s THR 67 Ca 0.34 -2.00 -0.31 0.00 -1.18 0.00 0.00 61.69 58.54 3ism s THR 67 Cb 0.20 -2.48 -0.11 0.00 1.34 0.00 0.00 72.50 71.46 3ism s THR 67 CO 0.41 0.00 1.82 0.00 -0.54 0.00 0.00 174.62 176.31 3ism s ALA 68 N -3.43 3.80 -0.06 3.99 0.00 -1.26 -4.48 121.76 120.32 3ism s ALA 68 Ca 0.32 1.49 0.05 0.00 0.00 0.00 0.00 51.96 53.83 3ism s ALA 68 Cb 0.04 -3.76 -0.01 0.00 0.00 0.00 0.00 23.12 19.39 3ism s ALA 68 CO 0.17 -1.18 -0.23 0.99 0.00 0.00 0.00 175.76 175.52 3ism s THR 69 N 2.46 2.28 0.23 0.00 2.01 -1.26 -4.98 115.64 116.38 3ism s THR 69 Ca 0.80 -0.99 -0.06 0.00 0.31 0.00 0.00 61.69 61.76 3ism s THR 69 Cb -0.47 -1.85 0.19 0.00 0.01 0.00 0.00 72.50 70.38 3ism s THR 69 CO 0.36 0.57 1.78 -0.65 -0.69 0.00 0.00 174.62 175.99 3ism h PRO 70 N 5.98 0.61 -0.79 4.92 0.11 -2.00 -0.63 132.00 140.20 3ism h PRO 70 Ca -0.34 -0.04 -0.01 0.00 0.11 0.00 0.00 66.00 65.72 3ism h PRO 70 Cb 1.17 -0.14 -0.04 0.00 0.11 0.00 0.00 31.00 32.11 3ism h PRO 70 CO 0.48 0.40 0.45 0.77 -0.21 0.00 0.00 178.00 179.90 3ism h SER 71 N 0.62 0.97 -0.05 -2.05 0.02 -1.99 -2.25 113.55 108.82 3ism h SER 71 Ca 0.37 -0.07 -0.19 0.00 -0.84 0.00 0.00 61.79 61.06 3ism h SER 71 Cb 0.40 -0.24 0.01 0.00 0.14 0.00 0.00 62.40 62.71 3ism h SER 71 CO -0.28 0.76 -0.72 -0.09 -1.14 0.00 0.00 176.83 175.36 3ism h ARG 72 N 1.10 0.57 -0.36 3.45 9.65 -1.73 -1.07 114.38 126.00 3ism h ARG 72 Ca 0.28 -0.55 0.05 0.00 -1.10 0.00 0.00 59.98 58.66 3ism h ARG 72 Cb -0.01 0.14 -0.04 0.00 -1.39 0.00 0.00 29.97 28.67 3ism h ARG 72 CO -0.05 1.18 0.10 0.82 2.80 0.00 0.00 179.97 184.82 3ism h ILE 73 N 0.18 0.86 -0.11 1.20 2.04 -1.10 0.23 117.51 120.81 3ism h ILE 73 Ca -0.08 -0.08 -0.03 0.00 1.00 0.00 0.00 64.86 65.67 3ism h ILE 73 Cb 1.39 0.61 -0.01 0.00 -0.74 0.00 0.00 36.82 38.07 3ism h ILE 73 CO 0.14 0.04 -0.09 1.23 0.00 0.00 0.00 178.15 179.48 3ism h GLY 74 N 0.24 0.17 0.67 5.37 0.00 -1.41 0.21 103.07 108.31 3ism h GLY 74 Ca 0.17 -0.09 -0.01 0.00 0.00 0.00 0.00 47.33 47.40 3ism h GLY 74 CO -0.19 0.09 -0.07 1.46 0.00 0.00 0.00 176.54 177.83 3ism h GLN 75 N 0.15 -0.18 -0.43 4.80 4.20 -0.41 -2.77 115.11 120.47 3ism h GLN 75 Ca 0.03 0.01 0.01 0.00 0.06 0.00 0.00 58.65 58.77 3ism h GLN 75 Cb 0.26 0.04 -0.02 0.00 0.30 0.00 0.00 27.48 28.06 3ism h GLN 75 CO 0.01 0.15 0.28 0.82 -0.67 0.00 0.00 178.83 179.42 3ism h ILE 76 N -0.52 1.09 -0.70 2.54 2.04 -0.21 -2.89 117.51 118.85 3ism h ILE 76 Ca -0.02 -0.19 -0.37 0.00 1.00 0.00 0.00 64.86 65.27 3ism h ILE 76 Cb 0.41 0.48 -0.22 0.00 -0.74 0.00 0.00 36.82 36.75 3ism h ILE 76 CO 0.03 0.10 0.48 0.23 0.00 0.00 0.00 178.15 178.99 3ism n MET 77 N -4.81 1.90 -0.30 2.37 2.81 0.71 -4.61 117.12 115.18 3ism n MET 77 Ca 0.01 -2.13 0.14 0.00 -1.81 0.00 0.00 57.70 53.91 3ism n MET 77 Cb 0.03 -1.84 0.32 0.00 -0.71 0.00 0.00 33.22 31.03 3ism n MET 77 CO 0.00 0.00 0.00 -0.22 1.51 0.00 0.00 175.97 177.26 3ism h LYS 78 N 0.78 0.29 -0.67 0.03 3.64 -1.27 -2.42 116.57 116.95 3ism h LYS 78 Ca 0.45 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.81 3ism h LYS 78 Cb 2.22 -0.07 0.00 0.00 -0.41 0.00 0.00 32.23 33.97 3ism h LYS 78 CO 0.81 0.19 0.00 0.66 -2.27 0.00 0.00 179.45 178.84 3ism n TYR 79 N -5.13 0.99 0.00 1.91 4.02 -1.26 -4.95 117.16 112.74 3ism n TYR 79 Ca 0.23 -0.47 0.00 0.00 -0.01 0.00 0.00 57.90 57.65 3ism n TYR 79 Cb 0.71 -0.04 0.00 0.00 -0.02 0.00 0.00 39.34 39.99 3ism n TYR 79 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3ism n GLY 80 N 1.49 2.12 3.66 2.72 0.00 -0.91 -1.70 105.19 112.57 3ism n GLY 80 Ca 0.23 -2.07 -0.37 0.00 0.00 0.00 0.00 46.02 43.81 3ism n GLY 80 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3ism s PHE 81 N -2.12 3.33 0.43 1.61 0.08 -1.26 -4.78 117.98 115.27 3ism s PHE 81 Ca 0.00 0.36 0.14 0.00 0.12 0.00 0.00 56.93 57.55 3ism s PHE 81 Cb 0.00 -2.37 1.02 0.00 -0.57 0.00 0.00 43.02 41.10 3ism s PHE 81 CO 0.00 0.02 1.97 -1.35 -0.10 0.00 0.00 175.22 175.76 3ism h PRO 82 N 7.54 0.40 -2.50 0.24 0.11 -1.95 -3.46 132.00 132.38 3ism h PRO 82 Ca -0.37 -0.02 0.15 0.00 0.11 0.00 0.00 66.00 65.87 3ism h PRO 82 Cb 1.17 -0.09 -0.05 0.00 0.11 0.00 0.00 31.00 32.14 3ism h PRO 82 CO 0.67 0.27 0.52 0.20 -0.21 0.00 0.00 178.00 179.45 3ism s GLY 83 N -3.79 0.01 -0.12 -0.55 0.00 -1.26 -3.22 107.32 98.38 3ism s GLY 83 Ca -0.08 -0.20 0.15 0.00 0.00 0.00 0.00 44.72 44.60 3ism s GLY 83 CO 0.75 1.23 1.18 1.04 0.00 0.00 0.00 173.10 177.29 3ism n LEU 84 N -0.60 1.96 -4.60 0.66 4.77 -1.26 -4.98 117.00 112.95 3ism n LEU 84 Ca -0.05 -3.01 -0.43 0.00 -0.03 0.00 0.00 56.01 52.49 3ism n LEU 84 Cb 0.60 -0.33 -0.03 0.00 -2.33 0.00 0.00 43.42 41.33 3ism n LEU 84 CO 0.19 0.95 0.82 -0.62 -1.33 0.00 0.00 177.39 177.40 3ism s ASP 85 N -2.65 6.66 -1.21 -1.43 2.15 -1.26 -4.43 116.67 114.50 3ism s ASP 85 Ca 0.33 0.51 -0.13 0.00 0.43 0.00 0.00 52.55 53.69 3ism s ASP 85 Cb 0.33 -2.48 -0.01 0.00 -0.30 0.00 0.00 42.92 40.45 3ism s ASP 85 CO -0.07 -0.96 0.72 1.57 -0.17 0.00 0.00 175.17 176.26 3ism n HIS 86 N 7.03 -1.91 -2.93 -5.34 -0.00 -1.26 -3.38 115.22 107.43 3ism n HIS 86 Ca 0.08 0.60 -0.41 0.00 0.46 0.00 0.00 57.72 58.45 3ism n HIS 86 Cb 0.48 -3.71 -0.04 0.00 -0.12 0.00 0.00 29.99 26.60 3ism n HIS 86 CO 0.00 0.00 0.00 0.08 0.46 0.00 0.00 176.34 176.88 3ism s VAL 87 N -3.58 4.94 -0.00 3.57 1.01 -1.26 -1.83 120.40 123.24 3ism s VAL 87 Ca 0.31 1.59 0.05 0.00 0.00 0.00 0.00 61.98 63.93 3ism s VAL 87 Cb -0.10 -4.11 -0.01 0.00 0.00 0.00 0.00 36.38 32.15 3ism s VAL 87 CO 0.85 0.11 -0.17 -0.13 0.00 0.00 0.00 175.10 175.75 3ism s ARG 88 N 1.66 1.33 -0.10 2.72 1.81 0.33 -4.98 118.95 121.71 3ism s ARG 88 Ca 0.39 -0.65 -0.01 0.00 -1.72 0.00 0.00 55.73 53.74 3ism s ARG 88 Cb -0.17 -1.31 -0.03 0.00 -0.45 0.00 0.00 34.95 32.99 3ism s ARG 88 CO 0.15 0.35 -0.07 0.45 -0.68 0.00 0.00 175.30 175.51 3ism s SER 89 N -0.54 4.61 0.31 0.23 0.15 -1.26 -0.02 113.70 117.18 3ism s SER 89 Ca 0.06 -0.10 0.03 0.00 0.70 0.00 0.00 55.95 56.65 3ism s SER 89 Cb -0.07 -1.41 0.03 0.00 -1.71 0.00 0.00 66.02 62.86 3ism s SER 89 CO -0.00 0.28 0.28 1.41 1.20 0.00 0.00 173.24 176.41 3ism n HIS 90 N 2.80 -1.40 0.24 3.44 8.25 -0.25 -4.77 115.22 123.53 3ism n HIS 90 Ca -0.18 -1.27 0.08 0.00 -0.26 0.00 0.00 57.72 56.10 3ism n HIS 90 Cb 0.53 -0.26 0.61 0.00 1.12 0.00 0.00 29.99 31.98 3ism n HIS 90 CO 0.00 0.00 0.00 0.77 0.64 0.00 0.00 176.34 177.75 3ism h SER 91 N 0.29 0.00 0.00 0.41 0.02 -1.90 -3.36 113.55 109.00 3ism h SER 91 Ca -0.18 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.77 3ism h SER 91 Cb 0.71 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.25 3ism h SER 91 CO 0.28 0.14 -0.06 -0.67 -1.14 0.00 0.00 176.83 175.38 3ism n ASP 92 N -4.10 0.00 -3.90 3.07 2.03 -1.26 -4.77 116.55 107.63 3ism n ASP 92 Ca -0.02 -1.13 -0.09 0.00 0.52 0.00 0.00 54.79 54.06 3ism n ASP 92 Cb 0.22 -0.03 -0.06 0.00 -0.72 0.00 0.00 41.12 40.54 3ism n ASP 92 CO 0.00 0.00 0.00 -0.72 -1.92 0.00 0.00 177.20 174.56 3ism s TYR 93 N 0.00 0.24 -0.00 -0.67 -0.85 -1.26 -4.66 117.35 110.14 3ism s TYR 93 Ca 0.00 -0.59 0.08 0.00 -0.52 0.00 0.00 57.07 56.04 3ism s TYR 93 Cb 0.00 0.12 -0.02 0.00 0.38 0.00 0.00 41.96 42.44 3ism s TYR 93 CO 0.00 -0.82 -0.26 0.08 -1.52 0.00 0.00 175.55 173.03 3ism s VAL 94 N -3.95 2.09 -0.05 -3.49 1.01 -0.74 -1.09 120.40 114.19 3ism s VAL 94 Ca 0.16 -1.19 0.01 0.00 0.00 0.00 0.00 61.98 60.96 3ism s VAL 94 Cb 0.01 -1.75 0.02 0.00 0.00 0.00 0.00 36.38 34.67 3ism s VAL 94 CO 0.01 0.51 -0.07 -0.22 0.00 0.00 0.00 175.10 175.33 3ism s LEU 95 N -0.81 1.44 -0.24 3.92 0.20 0.97 -0.68 118.68 123.49 3ism s LEU 95 Ca 0.11 -0.18 -0.07 0.00 0.69 0.00 0.00 54.13 54.67 3ism s LEU 95 Cb -0.10 -0.57 -0.03 0.00 -0.43 0.00 0.00 46.19 45.06 3ism s LEU 95 CO -0.00 -0.02 0.07 -0.55 -0.29 0.00 0.00 176.35 175.56 3ism s SER 96 N 0.82 5.26 -0.18 3.68 0.15 -0.32 0.12 113.70 123.23 3ism s SER 96 Ca -0.13 -0.15 -0.09 0.00 0.70 0.00 0.00 55.95 56.29 3ism s SER 96 Cb -0.15 -1.94 -0.05 0.00 -1.71 0.00 0.00 66.02 62.18 3ism s SER 96 CO 0.01 0.00 0.13 -0.47 1.20 0.00 0.00 173.24 174.12 3ism s TYR 97 N 1.38 3.44 -0.67 3.44 5.04 -0.76 -0.04 117.35 129.19 3ism s TYR 97 Ca 0.05 0.36 -0.18 0.00 -2.44 0.00 0.00 57.07 54.86 3ism s TYR 97 Cb -0.15 -2.10 0.13 0.00 0.35 0.00 0.00 41.96 40.19 3ism s TYR 97 CO 0.04 0.39 0.75 0.34 -1.34 0.00 0.00 175.55 175.72 3ism s ASP 98 N 0.03 6.33 0.49 4.32 -1.08 0.47 -4.55 116.67 122.68 3ism s ASP 98 Ca 0.09 -1.74 0.16 0.00 -0.52 0.00 0.00 52.55 50.54 3ism s ASP 98 Cb -0.11 -2.29 1.16 0.00 -1.46 0.00 0.00 42.92 40.21 3ism s ASP 98 CO -0.00 -1.00 2.08 0.03 0.52 0.00 0.00 175.17 176.79 3ism h ARG 99 N 8.90 0.00 -0.32 4.34 3.08 -1.90 0.10 114.38 128.59 3ism h ARG 99 Ca -0.18 0.00 -0.17 0.00 0.07 0.00 0.00 59.98 59.70 3ism h ARG 99 Cb 1.07 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 31.12 3ism h ARG 99 CO 1.04 0.08 -0.48 -0.09 -1.07 0.00 0.00 179.97 179.45 3ism h ARG 100 N 0.00 0.87 0.00 0.04 2.43 -1.92 -3.31 114.38 112.48 3ism h ARG 100 Ca -0.00 -0.51 0.00 0.00 -0.81 0.00 0.00 59.98 58.66 3ism h ARG 100 Cb 0.15 0.04 0.00 0.00 -0.42 0.00 0.00 29.97 29.74 3ism h ARG 100 CO 0.01 1.15 -1.09 0.09 -1.51 0.00 0.00 179.97 178.62 3ism n ASN 101 N -4.02 0.86 -2.14 -3.80 3.02 -1.02 -4.90 115.26 103.26 3ism n ASN 101 Ca -0.03 -0.84 -0.17 0.00 -0.03 0.00 0.00 54.58 53.50 3ism n ASN 101 Cb 0.59 1.08 0.01 0.00 -0.61 0.00 0.00 39.78 40.85 3ism n ASN 101 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 3ism n ARG 102 N -1.60 -2.50 -4.12 3.52 3.00 0.32 -1.26 116.66 114.02 3ism n ARG 102 Ca 0.03 0.77 -0.11 0.00 -0.01 0.00 0.00 57.85 58.53 3ism n ARG 102 Cb 0.36 -5.22 -0.08 0.00 0.00 0.00 0.00 32.46 27.52 3ism n ARG 102 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.63 177.77 3ism s VAL 103 N -2.93 0.00 0.64 1.55 -7.23 -1.18 -4.52 120.40 106.73 3ism s VAL 103 Ca 0.11 -1.75 -0.17 0.00 -1.81 0.00 0.00 61.98 58.35 3ism s VAL 103 Cb -0.05 -2.38 -0.01 0.00 0.56 0.00 0.00 36.38 34.50 3ism s VAL 103 CO 0.14 0.00 1.20 -2.84 -0.31 0.00 0.00 175.10 173.29 3ism s PRO 104 N -4.09 2.70 0.03 4.82 0.02 -1.25 -0.39 135.00 136.84 3ism s PRO 104 Ca 0.32 1.79 -0.21 0.00 0.02 0.00 0.00 61.00 62.92 3ism s PRO 104 Cb 0.04 -1.90 -0.15 0.00 0.02 0.00 0.00 34.50 32.50 3ism s PRO 104 CO 0.11 -1.41 1.32 0.45 -0.33 0.00 0.00 177.00 177.15 3ism h HIS 105 N 0.47 0.39 -2.73 6.54 3.86 -0.72 -3.42 115.15 119.54 3ism h HIS 105 Ca -0.49 -0.12 0.00 0.00 -1.16 0.00 0.00 60.37 58.60 3ism h HIS 105 Cb 1.30 -0.08 -0.14 0.00 1.06 0.00 0.00 27.41 29.55 3ism h HIS 105 CO 0.47 0.74 0.27 1.67 0.86 0.00 0.00 177.93 181.94 3ism s TRP 106 N -4.24 -0.52 0.21 2.45 1.48 -1.14 -4.06 118.94 113.12 3ism s TRP 106 Ca -0.14 0.41 0.08 0.00 -1.06 0.00 0.00 56.10 55.39 3ism s TRP 106 Cb 0.05 0.54 -0.05 0.00 -1.16 0.00 0.00 33.47 32.85 3ism s TRP 106 CO 0.75 -0.76 -0.16 0.14 -4.06 0.00 0.00 176.95 172.86 3ism s VAL 107 N -3.28 1.84 -0.01 -0.66 -7.23 0.02 -1.17 120.40 109.90 3ism s VAL 107 Ca 0.00 -2.18 0.03 0.00 -1.81 0.00 0.00 61.98 58.02 3ism s VAL 107 Cb -0.01 -2.04 -0.00 0.00 0.56 0.00 0.00 36.38 34.89 3ism s VAL 107 CO -0.09 -0.52 -0.10 0.12 -0.31 0.00 0.00 175.10 174.19 3ism s PHE 108 N -2.75 0.96 0.02 2.82 5.36 0.15 -1.86 117.98 122.67 3ism s PHE 108 Ca 0.22 -0.20 0.01 0.00 -0.96 0.00 0.00 56.93 56.00 3ism s PHE 108 Cb -0.02 -0.64 -0.01 0.00 -0.34 0.00 0.00 43.02 42.00 3ism s PHE 108 CO 0.08 -0.05 -0.04 -1.21 -1.46 0.00 0.00 175.22 172.54 3ism s GLU 109 N -0.09 0.33 -0.24 10.12 2.02 0.04 -1.79 118.70 129.10 3ism s GLU 109 Ca 0.01 -0.48 0.02 0.00 0.02 0.00 0.00 54.97 54.55 3ism s GLU 109 Cb -0.06 -0.11 0.06 0.00 0.10 0.00 0.00 34.13 34.12 3ism s GLU 109 CO -0.00 0.01 -0.08 -1.58 0.02 0.00 0.00 175.26 173.64 3ism s HIS 110 N -0.96 2.71 -0.09 1.61 5.65 -1.26 -0.99 115.29 121.97 3ism s HIS 110 Ca -0.08 -1.95 -0.03 0.00 0.25 0.00 0.00 55.06 53.24 3ism s HIS 110 Cb -0.07 -1.71 -0.04 0.00 -1.18 0.00 0.00 32.58 29.59 3ism s HIS 110 CO -0.00 -0.81 0.06 -0.51 -0.65 0.00 0.00 174.74 172.83 3ism s LEU 111 N 1.29 3.90 0.35 8.88 1.43 0.12 -4.94 118.68 129.72 3ism s LEU 111 Ca -0.07 0.26 0.06 0.00 -1.03 0.00 0.00 54.13 53.35 3ism s LEU 111 Cb -0.19 -1.97 -0.07 0.00 0.03 0.00 0.00 46.19 43.99 3ism s LEU 111 CO -0.06 0.38 0.01 0.42 0.23 0.00 0.00 176.35 177.32 3ism s THR 112 N -0.98 1.68 0.29 5.49 -4.23 -1.26 -0.73 115.64 115.90 3ism s THR 112 Ca 0.15 -2.04 0.00 0.00 -1.18 0.00 0.00 61.69 58.63 3ism s THR 112 Cb -0.12 -2.81 0.28 0.00 1.34 0.00 0.00 72.50 71.19 3ism s THR 112 CO 0.04 -0.06 1.88 0.00 -0.54 0.00 0.00 174.62 175.95 3ism h ALA 113 N 1.99 1.49 -0.55 3.99 0.00 -1.82 -2.46 119.26 121.90 3ism h ALA 113 Ca -0.42 -0.01 -0.06 0.00 0.00 0.00 0.00 54.91 54.42 3ism h ALA 113 Cb 1.24 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.74 3ism h ALA 113 CO 0.74 0.34 0.13 1.49 0.00 0.00 0.00 179.25 181.95 3ism h GLU 114 N 1.06 0.89 0.00 0.00 4.81 -1.96 -2.53 114.58 116.86 3ism h GLU 114 Ca 0.43 -0.22 0.00 0.00 -0.13 0.00 0.00 59.36 59.44 3ism h GLU 114 Cb 0.27 -0.12 0.00 0.00 0.63 0.00 0.00 28.75 29.53 3ism h GLU 114 CO -0.18 0.84 0.00 -1.13 -0.73 0.00 0.00 179.01 177.81 3ism n SER 115 N -4.39 0.20 -0.35 1.04 3.41 -0.95 -2.97 113.62 109.60 3ism n SER 115 Ca 0.02 0.52 0.05 0.00 -0.26 0.00 0.00 58.87 59.20 3ism n SER 115 Cb 0.24 -0.57 0.03 0.00 -0.26 0.00 0.00 64.21 63.65 3ism n SER 115 CO 0.00 0.00 0.00 1.33 -0.16 0.00 0.00 175.04 176.21 3ism n VAL 116 N -1.69 0.00 -2.39 -3.33 0.24 -1.04 -1.73 118.33 108.38 3ism n VAL 116 Ca 0.07 -0.49 -0.40 0.00 -2.04 0.00 0.00 64.34 61.47 3ism n VAL 116 Cb 0.36 1.18 -0.04 0.00 -1.47 0.00 0.00 33.84 33.88 3ism n VAL 116 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3ism s ALA 117 N -0.85 3.43 0.13 2.33 0.00 -0.96 -4.92 121.76 120.92 3ism s ALA 117 Ca 0.11 0.97 -0.31 0.00 0.00 0.00 0.00 51.96 52.73 3ism s ALA 117 Cb 0.08 -3.37 -0.11 0.00 0.00 0.00 0.00 23.12 19.72 3ism s ALA 117 CO 0.13 -0.28 1.83 0.15 0.00 0.00 0.00 175.76 177.59 3ism s LYS 118 N -1.33 4.13 -0.16 0.00 1.02 -1.26 -4.78 119.74 117.37 3ism s LYS 118 Ca 0.46 2.61 0.01 0.00 0.02 0.00 0.00 55.97 59.07 3ism s LYS 118 Cb -0.33 -3.55 0.02 0.00 -0.52 0.00 0.00 37.83 33.44 3ism s LYS 118 CO 0.43 -0.84 -0.19 1.21 -0.92 0.00 0.00 175.35 175.04 3ism s ASN 119 N 2.60 2.97 0.62 2.83 2.47 -1.26 -4.99 114.94 120.18 3ism s ASN 119 Ca 0.81 -0.59 0.38 0.00 0.42 0.00 0.00 52.86 53.88 3ism s ASN 119 Cb -0.47 -1.37 2.10 0.00 -1.45 0.00 0.00 41.25 40.06 3ism s ASN 119 CO 0.36 0.00 2.28 -0.78 -3.72 0.00 0.00 177.10 175.25 3ism h ASP 120 N 7.81 0.00 0.02 -4.21 3.58 -1.94 -0.74 116.42 120.94 3ism h ASP 120 Ca -0.40 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.05 3ism h ASP 120 Cb 1.15 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.20 3ism h ASP 120 CO 0.59 0.01 -0.00 0.00 -2.88 0.00 0.00 179.24 176.96 3ism n ALA 121 N -2.16 2.66 -3.65 -0.78 0.00 -1.26 -4.62 120.51 110.70 3ism n ALA 121 Ca -0.03 -0.26 -0.35 0.00 0.00 0.00 0.00 53.44 52.80 3ism n ALA 121 Cb 0.11 -1.42 -0.14 0.00 0.00 0.00 0.00 19.45 18.01 3ism n ALA 121 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 3ism s VAL 122 N -2.03 3.01 -0.42 0.00 1.01 -0.29 -4.28 120.40 117.40 3ism s VAL 122 Ca 0.44 -1.44 -0.09 0.00 0.00 0.00 0.00 61.98 60.90 3ism s VAL 122 Cb 0.22 -2.76 0.08 0.00 0.00 0.00 0.00 36.38 33.92 3ism s VAL 122 CO 0.37 -0.15 0.27 -0.62 0.00 0.00 0.00 175.10 174.96 3ism s ASP 123 N 1.29 5.63 0.40 3.32 -1.08 -1.26 -4.82 116.67 120.15 3ism s ASP 123 Ca -0.04 -1.57 0.29 0.00 -0.52 0.00 0.00 52.55 50.71 3ism s ASP 123 Cb -0.20 -1.99 1.33 0.00 -1.46 0.00 0.00 42.92 40.61 3ism s ASP 123 CO -0.01 -0.56 1.86 -0.09 0.52 0.00 0.00 175.17 176.89 3ism h ARG 124 N 8.40 0.00 0.00 4.34 2.43 -1.97 -2.45 114.38 125.14 3ism h ARG 124 Ca -0.22 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.95 3ism h ARG 124 Cb 1.08 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.63 3ism h ARG 124 CO 0.77 0.00 0.00 0.66 -1.51 0.00 0.00 179.97 179.89 3ism h SER 125 N 0.00 0.00 0.12 -3.80 4.64 -2.04 -2.31 113.55 110.15 3ism h SER 125 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3ism h SER 125 Cb 0.27 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.36 3ism h SER 125 CO 0.00 0.00 -0.04 0.29 -0.87 0.00 0.00 176.83 176.21 3ism n LYS 126 N -2.36 1.09 -3.84 4.77 5.02 -0.92 -4.88 118.16 117.05 3ism n LYS 126 Ca 0.03 -0.37 -0.35 0.00 -2.02 0.00 0.00 58.31 55.60 3ism n LYS 126 Cb 0.30 -1.49 -0.08 0.00 -0.02 0.00 0.00 35.03 33.74 3ism n LYS 126 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3ism s ASP 128 N 0.14 2.19 -0.00 0.00 1.01 -1.26 -5.08 116.67 113.67 3ism s ASP 128 Ca 0.08 -0.72 -0.30 0.00 0.71 0.00 0.00 52.55 52.32 3ism s ASP 128 Cb -0.11 -0.10 -0.05 0.00 1.01 0.00 0.00 42.92 43.66 3ism s ASP 128 CO -0.01 -0.04 1.35 -0.36 0.21 0.00 0.00 175.17 176.32 3ism s PHE 129 N -1.54 2.97 0.00 4.23 0.08 -1.26 -4.74 117.98 117.71 3ism s PHE 129 Ca 0.06 0.93 -0.04 0.00 0.12 0.00 0.00 56.93 58.00 3ism s PHE 129 Cb -0.08 -3.60 -0.00 0.00 -0.57 0.00 0.00 43.02 38.76 3ism s PHE 129 CO 0.04 -2.15 0.07 -1.59 -0.10 0.00 0.00 175.22 171.49 3ism s LYS 130 N 2.25 0.34 0.51 0.44 -2.85 -0.92 -4.96 119.74 114.55 3ism s LYS 130 Ca 0.62 -0.36 -0.23 0.00 -1.00 0.00 0.00 55.97 55.00 3ism s LYS 130 Cb -0.30 0.14 -0.06 0.00 -2.06 0.00 0.00 37.83 35.54 3ism s LYS 130 CO 0.26 -0.07 1.38 1.14 0.10 0.00 0.00 175.35 178.16 3ism s GLN 131 N -1.10 3.35 -0.45 1.78 -2.07 -1.26 -0.30 119.66 119.61 3ism s GLN 131 Ca -0.12 2.30 -0.19 0.00 -1.82 0.00 0.00 55.36 55.53 3ism s GLN 131 Cb -0.07 -2.41 0.03 0.00 -1.09 0.00 0.00 33.01 29.48 3ism s GLN 131 CO 0.00 -1.04 0.57 0.34 -1.32 0.00 0.00 175.29 173.84 3ism s ASP 132 N -0.79 6.25 0.00 12.60 -1.08 -1.26 -4.78 116.67 127.61 3ism s ASP 132 Ca 0.68 -0.60 0.29 0.00 -0.52 0.00 0.00 52.55 52.39 3ism s ASP 132 Cb -0.41 -2.28 1.30 0.00 -1.46 0.00 0.00 42.92 40.06 3ism s ASP 132 CO 0.51 -0.74 1.94 1.21 0.52 0.00 0.00 175.17 178.61 3ism n GLU 133 N 6.01 0.17 0.00 4.34 2.13 -1.26 -2.09 120.64 129.94 3ism n GLU 133 Ca -0.05 -0.01 0.15 0.00 0.66 0.00 0.00 57.16 57.91 3ism n GLU 133 Cb 0.47 -1.50 0.72 0.00 0.27 0.00 0.00 31.44 31.40 3ism n GLU 133 CO 0.00 0.00 0.00 -1.13 -0.41 0.00 0.00 177.13 175.59 3ism n SER 134 N -1.40 0.11 -4.81 4.31 3.41 -1.26 -4.76 113.62 109.21 3ism n SER 134 Ca 0.10 -0.22 -0.37 0.00 -0.26 0.00 0.00 58.87 58.12 3ism n SER 134 Cb 0.30 -0.24 -0.06 0.00 -0.26 0.00 0.00 64.21 63.96 3ism n SER 134 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 3ism s ILE 135 N -2.57 5.24 0.26 -1.33 -1.09 -0.89 -5.06 121.20 115.77 3ism s ILE 135 Ca 0.28 0.59 -0.30 0.00 -2.23 0.00 0.00 60.65 58.98 3ism s ILE 135 Cb 0.20 -3.61 -0.13 0.00 -1.58 0.00 0.00 42.46 37.34 3ism s ILE 135 CO 0.47 0.52 1.32 1.57 -1.23 0.00 0.00 174.94 177.59 3ism n HIS 136 N 2.45 2.03 -0.14 3.97 -0.00 -1.26 -4.79 115.22 117.48 3ism n HIS 136 Ca -0.15 0.51 0.28 0.00 -0.00 0.00 0.00 57.72 58.36 3ism n HIS 136 Cb 0.53 -2.41 0.71 0.00 -0.00 0.00 0.00 29.99 28.82 3ism n HIS 136 CO 0.00 0.00 0.00 -1.35 -0.00 0.00 0.00 176.34 174.99 3ism h PRO 137 N 3.51 0.00 0.00 1.57 0.11 -1.94 -0.48 132.00 134.77 3ism h PRO 137 Ca -0.45 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 65.62 3ism h PRO 137 Cb 1.29 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.39 3ism h PRO 137 CO 0.70 0.00 -0.22 0.74 -0.21 0.00 0.00 178.00 179.02 3ism h PHE 138 N 0.00 0.00 -0.14 0.65 -1.00 -2.01 -3.22 116.94 111.22 3ism h PHE 138 Ca 0.40 0.00 0.00 0.00 2.81 0.00 0.00 57.97 61.18 3ism h PHE 138 Cb 1.77 0.00 0.00 0.00 3.61 0.00 0.00 35.95 41.33 3ism h PHE 138 CO 0.00 0.22 0.00 1.19 -1.61 0.00 0.00 178.31 178.11 3ism n PHE 139 N -3.86 0.20 -2.92 -0.55 3.72 -0.20 -5.00 117.46 108.86 3ism n PHE 139 Ca -0.02 -0.53 -0.41 0.00 -0.05 0.00 0.00 57.45 56.45 3ism n PHE 139 Cb 0.31 -0.05 -0.04 0.00 -0.94 0.00 0.00 39.48 38.76 3ism n PHE 139 CO 0.00 0.00 0.00 1.03 -0.05 0.00 0.00 176.76 177.74 3ism s ARG 140 N -1.11 4.49 0.47 -1.08 0.52 -1.19 -4.65 118.95 116.40 3ism s ARG 140 Ca 0.11 1.10 -0.21 0.00 -0.52 0.00 0.00 55.73 56.21 3ism s ARG 140 Cb 0.06 -3.44 -0.09 0.00 0.52 0.00 0.00 34.95 32.01 3ism s ARG 140 CO 0.06 0.06 1.03 -1.54 0.02 0.00 0.00 175.30 174.93 3ism s SER 141 N 0.73 6.49 0.15 0.23 1.04 -1.26 -4.93 113.70 116.14 3ism s SER 141 Ca 0.43 1.91 0.07 0.00 0.48 0.00 0.00 55.95 58.83 3ism s SER 141 Cb -0.19 -2.56 -0.04 0.00 0.10 0.00 0.00 66.02 63.33 3ism s SER 141 CO 0.22 -0.68 -0.16 -1.10 0.98 0.00 0.00 173.24 172.51 3ism s GLN 142 N -3.13 1.15 0.36 4.02 -1.52 -1.26 -4.68 119.66 114.61 3ism s GLN 142 Ca 0.65 -1.35 0.12 0.00 -1.95 0.00 0.00 55.36 52.84 3ism s GLN 142 Cb -0.16 -1.09 0.92 0.00 -0.22 0.00 0.00 33.01 32.46 3ism s GLN 142 CO 0.20 0.21 1.81 -0.91 -0.25 0.00 0.00 175.29 176.35 3ism h ASN 143 N 3.30 0.59 -0.74 5.90 2.35 -1.96 -0.63 115.58 124.39 3ism h ASN 143 Ca -0.41 0.07 0.17 0.00 -0.55 0.00 0.00 56.30 55.58 3ism h ASN 143 Cb 1.20 -0.04 -0.05 0.00 0.05 0.00 0.00 38.32 39.49 3ism h ASN 143 CO 0.52 0.21 0.50 0.71 -1.65 0.00 0.00 177.43 177.73 3ism h THR 144 N 0.58 0.75 -0.20 2.81 1.35 -1.96 -1.75 112.91 114.48 3ism h THR 144 Ca 0.53 -0.10 -0.09 0.00 -0.55 0.00 0.00 66.41 66.20 3ism h THR 144 Cb 1.08 0.42 -0.01 0.00 -1.73 0.00 0.00 68.15 67.90 3ism h THR 144 CO -0.28 0.05 -0.28 0.44 -0.25 0.00 0.00 175.52 175.21 3ism h ASP 145 N 0.30 0.39 0.53 5.36 3.32 -1.45 -3.26 116.42 121.62 3ism h ASP 145 Ca 0.37 -0.13 -0.17 0.00 0.02 0.00 0.00 57.03 57.11 3ism h ASP 145 Cb 1.00 -0.11 -0.03 0.00 0.22 0.00 0.00 39.33 40.41 3ism h ASP 145 CO -0.10 0.67 -1.60 -1.22 -1.72 0.00 0.00 179.24 175.27 3ism n TYR 146 N -4.12 0.74 -1.67 4.55 4.02 -0.81 -3.84 117.16 116.04 3ism n TYR 146 Ca -0.01 0.25 -0.42 0.00 -0.01 0.00 0.00 57.90 57.71 3ism n TYR 146 Cb 0.41 -1.01 -0.03 0.00 -0.02 0.00 0.00 39.34 38.69 3ism n TYR 146 CO 0.00 0.00 0.00 -2.13 -1.01 0.00 0.00 176.86 173.72 3ism n ARG 147 N -2.80 2.85 -2.66 -0.72 0.63 -0.72 -2.00 116.66 111.24 3ism n ARG 147 Ca -0.12 1.04 -0.19 0.00 -0.92 0.00 0.00 57.85 57.66 3ism n ARG 147 Cb 0.85 -2.98 0.00 0.00 0.45 0.00 0.00 32.46 30.78 3ism n ARG 147 CO 0.00 0.00 0.00 0.54 -2.51 0.00 0.00 177.63 175.66 3ism n ARG 148 N 6.94 -2.81 0.14 -0.14 1.74 -1.26 -4.87 116.66 116.41 3ism n ARG 148 Ca 0.19 0.83 0.12 0.00 -0.77 0.00 0.00 57.85 58.22 3ism n ARG 148 Cb 0.40 -5.53 0.11 0.00 -1.02 0.00 0.00 32.46 26.42 3ism n ARG 148 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 3ism h SER 149 N -0.45 0.00 0.00 0.55 4.64 -1.69 -3.47 113.55 113.13 3ism h SER 149 Ca -0.45 -0.03 0.00 0.00 -0.47 0.00 0.00 61.79 60.84 3ism h SER 149 Cb 1.32 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.41 3ism h SER 149 CO 0.52 0.01 0.00 0.61 -0.87 0.00 0.00 176.83 177.10 3ism n GLY 150 N 1.18 0.75 3.11 -0.77 0.00 -1.26 -5.07 105.19 103.13 3ism n GLY 150 Ca 0.02 -0.09 -0.16 0.00 0.00 0.00 0.00 46.02 45.80 3ism n GLY 150 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3ism s TYR 151 N -2.00 0.96 0.38 1.61 2.02 -1.26 -4.70 117.35 114.36 3ism s TYR 151 Ca 0.00 -0.45 -0.12 0.00 -0.37 0.00 0.00 57.07 56.13 3ism s TYR 151 Cb 0.00 -0.55 -0.07 0.00 -0.40 0.00 0.00 41.96 40.93 3ism s TYR 151 CO 0.00 -0.01 0.76 -0.51 -1.57 0.00 0.00 175.55 174.23 3ism s ASP 152 N -1.54 6.59 -0.66 2.29 1.11 0.20 -4.85 116.67 119.81 3ism s ASP 152 Ca -0.05 1.18 -0.27 0.00 0.18 0.00 0.00 52.55 53.59 3ism s ASP 152 Cb -0.09 -2.34 0.01 0.00 1.07 0.00 0.00 42.92 41.57 3ism s ASP 152 CO 0.01 -0.35 1.44 -0.13 1.18 0.00 0.00 175.17 177.33 3ism s ARG 153 N -3.61 3.10 -0.30 8.23 0.52 -1.26 -1.94 118.95 123.69 3ism s ARG 153 Ca 0.52 0.14 -0.12 0.00 -0.52 0.00 0.00 55.73 55.75 3ism s ARG 153 Cb -0.10 -4.21 -0.03 0.00 0.52 0.00 0.00 34.95 31.13 3ism s ARG 153 CO 0.27 -2.21 0.24 0.20 0.02 0.00 0.00 175.30 173.83 3ism s GLY 154 N 4.86 1.93 0.21 -3.53 0.00 -0.33 -4.90 107.32 105.56 3ism s GLY 154 Ca 0.47 -1.16 -0.32 0.00 0.00 0.00 0.00 44.72 43.70 3ism s GLY 154 CO 0.19 0.76 1.58 1.42 0.00 0.00 0.00 173.10 177.05 3ism n HIS 155 N 5.13 2.48 -0.05 1.90 8.25 -1.26 -1.49 115.22 130.19 3ism n HIS 155 Ca -0.13 0.24 -0.02 0.00 -0.26 0.00 0.00 57.72 57.55 3ism n HIS 155 Cb 0.51 -2.57 -0.02 0.00 1.12 0.00 0.00 29.99 29.03 3ism n HIS 155 CO 0.00 0.00 0.00 0.52 0.64 0.00 0.00 176.34 177.50 3ism h MET 156 N 5.57 -0.02 -6.06 -0.41 2.86 -1.40 -3.42 114.93 112.05 3ism h MET 156 Ca -0.45 0.00 -0.60 0.00 -2.06 0.00 0.00 59.70 56.59 3ism h MET 156 Cb 1.24 0.00 -0.11 0.00 0.06 0.00 0.00 31.60 32.79 3ism h MET 156 CO 0.86 0.13 0.58 0.00 1.06 0.00 0.00 176.91 179.54 3ism s ALA 157 N -2.55 3.21 0.42 6.32 0.00 -1.26 -4.90 121.76 122.99 3ism s ALA 157 Ca -0.03 -0.94 -0.25 0.00 0.00 0.00 0.00 51.96 50.74 3ism s ALA 157 Cb -0.00 -3.67 -0.08 0.00 0.00 0.00 0.00 23.12 19.36 3ism s ALA 157 CO 0.11 -2.17 1.25 0.00 0.00 0.00 0.00 175.76 174.94 3ism s ALA 158 N 3.83 3.17 0.46 0.00 0.00 -1.26 -4.85 121.76 123.11 3ism s ALA 158 Ca 0.35 1.12 0.12 0.00 0.00 0.00 0.00 51.96 53.54 3ism s ALA 158 Cb -0.11 -3.44 1.03 0.00 0.00 0.00 0.00 23.12 20.60 3ism s ALA 158 CO 0.24 -0.74 2.08 0.00 0.00 0.00 0.00 175.76 177.34 3ism h ALA 159 N 2.54 1.80 0.00 0.00 0.00 -1.91 -2.18 119.26 119.52 3ism h ALA 159 Ca -0.49 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.37 3ism h ALA 159 Cb 1.25 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.96 3ism h ALA 159 CO 0.62 0.16 0.00 0.41 0.00 0.00 0.00 179.25 180.44 3ism n GLY 160 N -1.40 -1.19 0.31 0.00 0.00 -1.26 -2.66 105.19 98.99 3ism n GLY 160 Ca -0.00 -0.07 0.14 0.00 0.00 0.00 0.00 46.02 46.09 3ism n GLY 160 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3ism n ASN 161 N -1.49 1.02 -3.35 1.61 3.02 -0.82 -4.64 115.26 110.62 3ism n ASN 161 Ca 0.05 -1.22 -0.26 0.00 -0.03 0.00 0.00 54.58 53.12 3ism n ASN 161 Cb 0.24 0.01 -0.09 0.00 -0.61 0.00 0.00 39.78 39.32 3ism n ASN 161 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 3ism n HIS 162 N -0.29 -0.50 -0.39 3.10 8.25 -1.09 -4.51 115.22 119.79 3ism n HIS 162 Ca 0.19 -3.44 0.04 0.00 -0.26 0.00 0.00 57.72 54.25 3ism n HIS 162 Cb 0.30 0.03 0.06 0.00 1.12 0.00 0.00 29.99 31.50 3ism n HIS 162 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 3ism n ARG 163 N 2.34 2.42 -0.02 -0.41 1.74 -0.70 -3.14 116.66 118.89 3ism n ARG 163 Ca 0.27 -1.92 -0.02 0.00 -0.77 0.00 0.00 57.85 55.41 3ism n ARG 163 Cb 0.49 -1.20 0.24 0.00 -1.02 0.00 0.00 32.46 30.97 3ism n ARG 163 CO 0.00 0.00 0.00 -0.07 -1.52 0.00 0.00 177.63 176.04 3ism h LEU 164 N 0.13 0.54 -7.26 0.55 3.38 -1.85 -3.43 115.31 107.37 3ism h LEU 164 Ca 0.00 -0.13 -0.08 0.00 0.09 0.00 0.00 57.88 57.75 3ism h LEU 164 Cb 0.70 -0.14 -0.19 0.00 0.09 0.00 0.00 40.66 41.12 3ism h LEU 164 CO 0.01 0.67 -0.04 -2.28 0.09 0.00 0.00 178.44 176.88 3ism s HIS 165 N -4.82 -0.40 0.21 1.13 5.04 -1.26 -5.02 115.29 110.17 3ism s HIS 165 Ca -0.08 0.61 -0.14 0.00 -1.54 0.00 0.00 55.06 53.92 3ism s HIS 165 Cb 0.15 0.26 0.25 0.00 0.04 0.00 0.00 32.58 33.27 3ism s HIS 165 CO 0.78 -0.53 1.62 0.37 -2.34 0.00 0.00 174.74 174.64 3ism h GLN 166 N 3.30 -0.01 -0.15 2.88 5.75 -1.89 -1.99 115.11 123.00 3ism h GLN 166 Ca -0.29 0.00 -0.04 0.00 -0.15 0.00 0.00 58.65 58.17 3ism h GLN 166 Cb 1.17 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 29.71 3ism h GLN 166 CO 0.40 -0.01 -0.10 -0.22 -2.65 0.00 0.00 178.83 176.26 3ism h LYS 167 N -0.01 0.23 -0.77 1.69 3.64 -1.95 0.85 116.57 120.25 3ism h LYS 167 Ca 0.31 -0.05 0.01 0.00 -1.27 0.00 0.00 60.65 59.65 3ism h LYS 167 Cb 0.49 -0.04 -0.04 0.00 -0.41 0.00 0.00 32.23 32.24 3ism h LYS 167 CO -0.68 0.34 0.51 0.45 -2.27 0.00 0.00 179.45 177.80 3ism h HIS 168 N 0.22 0.97 -0.06 1.91 3.86 -1.65 -0.87 115.15 119.54 3ism h HIS 168 Ca 0.05 0.02 -0.06 0.00 -1.16 0.00 0.00 60.37 59.22 3ism h HIS 168 Cb 0.32 -0.33 0.00 0.00 1.06 0.00 0.00 27.41 28.46 3ism h HIS 168 CO 0.00 0.62 -0.21 0.00 0.86 0.00 0.00 177.93 179.21 3ism h ASP 170 N -0.28 0.65 0.44 0.00 3.58 -0.65 -1.18 116.42 118.97 3ism h ASP 170 Ca -0.01 0.08 0.00 0.00 0.42 0.00 0.00 57.03 57.52 3ism h ASP 170 Cb 0.84 -0.03 0.00 0.00 1.72 0.00 0.00 39.33 41.86 3ism h ASP 170 CO 0.04 0.28 0.00 -0.33 -2.88 0.00 0.00 179.24 176.36 3ism h GLU 171 N 0.72 0.00 0.00 0.28 5.08 -1.21 -1.30 114.58 118.14 3ism h GLU 171 Ca 0.48 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.84 3ism h GLU 171 Cb 0.65 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.90 3ism h GLU 171 CO -0.34 0.00 0.00 0.25 -1.00 0.00 0.00 179.01 177.92 3ism n THR 172 N -2.93 0.44 1.16 1.13 -2.24 -0.45 -3.42 114.28 107.98 3ism n THR 172 Ca -0.01 0.08 0.11 0.00 -2.27 0.00 0.00 64.05 61.96 3ism n THR 172 Cb 0.17 -0.72 0.37 0.00 -2.10 0.00 0.00 70.33 68.05 3ism n THR 172 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 3ism n PHE 173 N -1.60 0.21 -2.01 4.78 3.72 -0.49 -4.78 117.46 117.29 3ism n PHE 173 Ca 0.05 -0.11 -0.41 0.00 -0.05 0.00 0.00 57.45 56.93 3ism n PHE 173 Cb 0.28 0.00 -0.02 0.00 -0.94 0.00 0.00 39.48 38.80 3ism n PHE 173 CO 0.00 0.00 0.00 0.71 -0.05 0.00 0.00 176.76 177.42 3ism s TYR 174 N -1.79 3.02 0.21 1.38 2.02 -1.22 -2.15 117.35 118.81 3ism s TYR 174 Ca 0.33 1.04 0.33 0.00 -0.37 0.00 0.00 57.07 58.39 3ism s TYR 174 Cb 0.18 -3.82 1.77 0.00 -0.40 0.00 0.00 41.96 39.70 3ism s TYR 174 CO 0.27 -2.65 2.00 -0.07 -1.57 0.00 0.00 175.55 173.53 3ism h LEU 175 N 4.98 0.00 -0.69 -1.29 3.38 -0.96 0.30 115.31 121.03 3ism h LEU 175 Ca -0.46 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.51 3ism h LEU 175 Cb 1.22 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.97 3ism h LEU 175 CO 0.77 0.00 0.00 -1.54 0.09 0.00 0.00 178.44 177.76 3ism n SER 176 N -2.64 0.73 -0.77 -0.43 3.41 -1.26 -2.06 113.62 110.59 3ism n SER 176 Ca -0.02 0.67 0.11 0.00 -0.26 0.00 0.00 58.87 59.37 3ism n SER 176 Cb 0.05 -0.83 0.31 0.00 -0.26 0.00 0.00 64.21 63.49 3ism n SER 176 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 3ism n ASN 177 N -2.29 2.31 -4.72 4.04 5.15 0.10 -3.89 115.26 115.95 3ism n ASN 177 Ca 0.02 -1.81 -0.31 0.00 -0.60 0.00 0.00 54.58 51.88 3ism n ASN 177 Cb 0.25 -0.14 -0.08 0.00 -0.53 0.00 0.00 39.78 39.28 3ism n ASN 177 CO 0.00 0.00 0.00 -0.04 1.40 0.00 0.00 177.26 178.62 3ism s MET 178 N -1.72 2.71 0.03 1.20 -1.94 -0.88 -0.95 119.30 117.75 3ism s MET 178 Ca 0.34 -0.74 0.01 0.00 -1.71 0.00 0.00 55.69 53.59 3ism s MET 178 Cb 0.19 -2.63 -0.02 0.00 2.01 0.00 0.00 34.83 34.38 3ism s MET 178 CO 0.28 0.57 -0.05 0.00 -0.01 0.00 0.00 175.02 175.81 3ism s ALA 179 N -1.30 0.31 0.05 3.03 0.00 -0.55 -4.34 121.76 118.95 3ism s ALA 179 Ca 0.26 -0.59 -0.30 0.00 0.00 0.00 0.00 51.96 51.33 3ism s ALA 179 Cb -0.12 0.08 -0.09 0.00 0.00 0.00 0.00 23.12 22.99 3ism s ALA 179 CO 0.18 -0.07 1.90 -2.14 0.00 0.00 0.00 175.76 175.62 3ism s PRO 180 N -1.31 4.15 0.00 0.00 0.02 -1.26 -1.19 135.00 135.41 3ism s PRO 180 Ca -0.11 2.56 0.05 0.00 0.02 0.00 0.00 61.00 63.52 3ism s PRO 180 Cb -0.09 -4.01 -0.02 0.00 0.02 0.00 0.00 34.50 30.40 3ism s PRO 180 CO -0.00 -0.91 -0.16 -0.65 -0.33 0.00 0.00 177.00 174.94 3ism s GLN 181 N 4.02 1.25 0.20 5.54 -0.21 -0.82 -4.43 119.66 125.21 3ism s GLN 181 Ca 0.85 -0.65 -0.32 0.00 0.02 0.00 0.00 55.36 55.26 3ism s GLN 181 Cb -0.42 -1.24 -0.15 0.00 1.00 0.00 0.00 33.01 32.20 3ism s GLN 181 CO 0.39 0.33 1.25 0.28 -2.12 0.00 0.00 175.29 175.42 3ism n VAL 182 N 2.44 0.94 0.00 1.09 0.31 -1.26 0.62 118.33 122.47 3ism n VAL 182 Ca -0.15 -0.24 0.00 0.00 -0.01 0.00 0.00 64.34 63.94 3ism n VAL 182 Cb 0.54 -1.08 0.00 0.00 -0.91 0.00 0.00 33.84 32.40 3ism n VAL 182 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3ism n GLY 183 N 2.04 1.88 3.68 2.92 0.00 -1.26 -0.75 105.19 113.70 3ism n GLY 183 Ca 0.14 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.71 3ism n GLY 183 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3ism n GLN 184 N 0.00 2.37 -0.70 1.61 6.02 -1.26 -1.55 117.38 123.87 3ism n GLN 184 Ca 0.00 0.86 0.00 0.00 -0.01 0.00 0.00 57.00 57.85 3ism n GLN 184 Cb 0.00 -2.67 0.00 0.00 1.02 0.00 0.00 30.24 28.59 3ism n GLN 184 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3ism n GLY 185 N 3.76 0.74 0.00 1.08 0.00 -1.26 -4.71 105.19 104.80 3ism n GLY 185 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.20 3ism n GLY 185 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 3ism n PHE 186 N -2.39 0.00 -0.29 1.61 7.35 -0.81 0.11 117.46 123.04 3ism n PHE 186 Ca 0.00 0.00 0.06 0.00 -0.76 0.00 0.00 57.45 56.75 3ism n PHE 186 Cb 0.00 0.00 0.16 0.00 0.35 0.00 0.00 39.48 39.99 3ism n PHE 186 CO 0.00 0.00 0.00 -0.97 -0.76 0.00 0.00 176.76 175.03 3ism h ASN 187 N 0.00 -0.55 0.70 -2.13 -1.24 -0.59 0.14 115.58 111.92 3ism h ASN 187 Ca 0.00 0.23 0.00 0.00 0.71 0.00 0.00 56.30 57.24 3ism h ASN 187 Cb 0.00 0.44 0.00 0.00 0.73 0.00 0.00 38.32 39.49 3ism h ASN 187 CO 0.00 -0.25 -0.33 0.54 -1.29 0.00 0.00 177.43 176.10 3ism n ARG 188 N -5.45 0.02 0.00 6.67 1.74 -0.59 -3.33 116.66 115.72 3ism n ARG 188 Ca 0.15 0.01 0.00 0.00 -0.77 0.00 0.00 57.85 57.23 3ism n ARG 188 Cb 0.50 -1.52 0.00 0.00 -1.02 0.00 0.00 32.46 30.42 3ism n ARG 188 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 3ism n ASP 189 N -1.55 0.00 -0.30 0.55 8.00 -0.20 -4.78 116.55 118.27 3ism n ASP 189 Ca 0.06 0.00 0.07 0.00 0.71 0.00 0.00 54.79 55.63 3ism n ASP 189 Cb 0.34 0.00 0.18 0.00 -0.02 0.00 0.00 41.12 41.62 3ism n ASP 189 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3ism h ALA 190 N 1.00 0.82 -0.58 2.24 0.00 -1.73 0.58 119.26 121.58 3ism h ALA 190 Ca 0.00 0.30 -0.10 0.00 0.00 0.00 0.00 54.91 55.12 3ism h ALA 190 Cb 0.00 0.55 -0.02 0.00 0.00 0.00 0.00 17.79 18.32 3ism h ALA 190 CO 0.00 -0.45 -0.01 2.35 0.00 0.00 0.00 179.25 181.14 3ism h TRP 191 N 0.04 1.13 -0.90 0.00 2.91 -1.05 -2.31 115.95 115.77 3ism h TRP 191 Ca 0.47 -0.20 0.03 0.00 1.13 0.00 0.00 58.89 60.32 3ism h TRP 191 Cb 0.84 -0.29 -0.05 0.00 -0.51 0.00 0.00 29.16 29.14 3ism h TRP 191 CO -0.53 1.01 0.59 -0.97 -1.03 0.00 0.00 178.44 177.51 3ism h ASN 192 N 0.93 0.98 -0.83 2.65 -0.00 -1.00 -1.57 115.58 116.74 3ism h ASN 192 Ca 0.16 -0.01 0.04 0.00 -0.00 0.00 0.00 56.30 56.50 3ism h ASN 192 Cb 0.56 -0.23 -0.05 0.00 -0.00 0.00 0.00 38.32 38.60 3ism h ASN 192 CO 0.03 0.67 0.52 0.74 -0.00 0.00 0.00 177.43 179.40 3ism h THR 193 N 1.14 1.09 -0.15 -3.57 2.02 -0.45 0.35 112.91 113.34 3ism h THR 193 Ca 0.36 -0.34 -0.02 0.00 0.77 0.00 0.00 66.41 67.18 3ism h THR 193 Cb 0.01 0.01 -0.01 0.00 -1.74 0.00 0.00 68.15 66.43 3ism h THR 193 CO -0.11 0.18 0.02 0.25 0.37 0.00 0.00 175.52 176.24 3ism h LEU 194 N 0.99 0.25 -0.42 2.58 5.85 -1.05 -1.00 115.31 122.51 3ism h LEU 194 Ca 0.34 -0.27 0.08 0.00 0.84 0.00 0.00 57.88 58.88 3ism h LEU 194 Cb 0.07 -0.07 -0.07 0.00 0.37 0.00 0.00 40.66 40.96 3ism h LEU 194 CO -0.14 0.45 -0.02 -0.33 -0.34 0.00 0.00 178.44 178.06 3ism h GLU 195 N 0.03 0.08 -0.58 1.25 5.08 -0.70 -1.28 114.58 118.47 3ism h GLU 195 Ca 0.05 -0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.40 3ism h GLU 195 Cb 0.31 -0.02 -0.03 0.00 0.50 0.00 0.00 28.75 29.51 3ism h GLU 195 CO 0.00 0.05 0.36 0.00 -1.00 0.00 0.00 179.01 178.43 3ism h ALA 196 N 1.38 1.54 -0.36 3.43 0.00 -0.17 -2.15 119.26 122.92 3ism h ALA 196 Ca 0.21 -0.06 -0.05 0.00 0.00 0.00 0.00 54.91 55.01 3ism h ALA 196 Cb 0.30 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 3ism h ALA 196 CO -0.36 0.41 0.05 1.25 0.00 0.00 0.00 179.25 180.59 3ism h HIS 197 N 0.80 0.64 -0.89 0.00 -0.00 -0.49 -1.51 115.15 113.70 3ism h HIS 197 Ca 0.21 -0.09 -0.02 0.00 -0.00 0.00 0.00 60.37 60.47 3ism h HIS 197 Cb -0.05 -0.17 -0.04 0.00 -0.00 0.00 0.00 27.41 27.15 3ism h HIS 197 CO 0.00 0.66 0.49 0.28 -0.00 0.00 0.00 177.93 179.36 3ism h VAL 198 N 0.43 1.26 -0.69 5.26 2.07 -0.96 -0.75 116.25 122.86 3ism h VAL 198 Ca 0.11 -0.63 -0.07 0.00 0.82 0.00 0.00 66.70 66.92 3ism h VAL 198 Cb 0.38 0.05 -0.03 0.00 -1.52 0.00 0.00 31.29 30.17 3ism h VAL 198 CO 0.01 0.29 0.15 0.03 0.02 0.00 0.00 177.57 178.07 3ism h ARG 199 N 1.25 1.11 0.00 1.57 3.08 -1.29 -2.91 114.38 117.18 3ism h ARG 199 Ca 0.31 -0.27 -0.04 0.00 0.07 0.00 0.00 59.98 60.06 3ism h ARG 199 Cb 0.02 -0.14 -0.01 0.00 0.08 0.00 0.00 29.97 29.93 3ism h ARG 199 CO -0.05 0.98 -0.18 -0.09 -1.07 0.00 0.00 179.97 179.56 3ism h ARG 200 N 1.05 0.00 -0.06 0.04 2.43 -0.77 -2.67 114.38 114.40 3ism h ARG 200 Ca 0.22 0.00 0.02 0.00 -0.81 0.00 0.00 59.98 59.40 3ism h ARG 200 Cb 0.38 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 29.93 3ism h ARG 200 CO 0.00 0.18 0.09 -0.07 -1.51 0.00 0.00 179.97 178.66 3ism h LEU 201 N 0.00 0.00 -2.47 3.80 3.38 -0.94 -1.36 115.31 117.72 3ism h LEU 201 Ca -0.00 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.97 3ism h LEU 201 Cb 0.65 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.40 3ism h LEU 201 CO 0.02 0.00 -0.00 0.71 0.09 0.00 0.00 178.44 179.26 3ism h THR 202 N 0.00 0.00 0.00 0.22 1.35 -1.59 0.18 112.91 113.08 3ism h THR 202 Ca 0.03 -0.18 0.00 0.00 -0.55 0.00 0.00 66.41 65.71 3ism h THR 202 Cb 0.20 1.18 0.00 0.00 -1.73 0.00 0.00 68.15 67.80 3ism h THR 202 CO -0.00 0.00 0.00 0.29 -0.25 0.00 0.00 175.52 175.56 3ism n LYS 203 N -3.08 0.02 -0.08 4.72 5.02 -0.51 -3.86 118.16 120.39 3ism n LYS 203 Ca -0.02 0.06 -0.12 0.00 -2.02 0.00 0.00 58.31 56.21 3ism n LYS 203 Cb 0.15 -1.53 -0.07 0.00 -0.02 0.00 0.00 35.03 33.56 3ism n LYS 203 CO 0.00 0.00 0.00 2.41 -0.52 0.00 0.00 177.40 179.29 3ism n THR 204 N -1.57 0.88 -4.89 -0.18 -1.04 -0.11 -4.99 114.28 102.39 3ism n THR 204 Ca 0.06 -0.31 -0.33 0.00 -2.04 0.00 0.00 64.05 61.43 3ism n THR 204 Cb 0.32 -1.17 -0.16 0.00 -1.82 0.00 0.00 70.33 67.50 3ism n THR 204 CO 0.00 0.00 0.00 -0.31 -0.64 0.00 0.00 175.07 174.12 3ism s TYR 205 N -2.30 2.68 0.51 -1.42 2.02 0.45 -4.78 117.35 114.52 3ism s TYR 205 Ca -0.21 -1.00 0.20 0.00 -0.37 0.00 0.00 57.07 55.69 3ism s TYR 205 Cb 0.06 -1.79 1.37 0.00 -0.40 0.00 0.00 41.96 41.19 3ism s TYR 205 CO 0.34 -0.42 2.14 0.66 -1.57 0.00 0.00 175.55 176.70 3ism h SER 206 N 6.93 0.00 -3.43 2.29 4.64 -1.72 -3.36 113.55 118.90 3ism h SER 206 Ca -0.26 0.00 -0.40 0.00 -0.47 0.00 0.00 61.79 60.66 3ism h SER 206 Cb 1.22 0.00 -0.35 0.00 -0.31 0.00 0.00 62.40 62.96 3ism h SER 206 CO 0.52 0.05 -0.77 0.20 -0.87 0.00 0.00 176.83 175.96 3ism s ASN 207 N -6.76 0.99 -0.16 4.97 0.01 -1.26 -4.41 114.94 108.33 3ism s ASN 207 Ca -0.05 -0.11 0.01 0.00 -0.71 0.00 0.00 52.86 52.00 3ism s ASN 207 Cb 0.16 -0.42 0.02 0.00 0.41 0.00 0.00 41.25 41.43 3ism s ASN 207 CO 0.64 -0.09 -0.17 -0.69 -1.51 0.00 0.00 177.10 175.28 3ism s VAL 208 N 1.13 1.79 -0.13 1.60 1.01 0.09 -1.86 120.40 124.04 3ism s VAL 208 Ca -0.08 -0.78 -0.04 0.00 0.00 0.00 0.00 61.98 61.08 3ism s VAL 208 Cb -0.14 -1.65 -0.03 0.00 0.00 0.00 0.00 36.38 34.55 3ism s VAL 208 CO -0.01 0.49 0.01 -0.31 0.00 0.00 0.00 175.10 175.27 3ism s TYR 209 N 1.40 3.15 -0.05 5.22 2.02 -0.01 0.16 117.35 129.23 3ism s TYR 209 Ca 0.05 0.02 -0.02 0.00 -0.37 0.00 0.00 57.07 56.74 3ism s TYR 209 Cb -0.13 -1.91 0.03 0.00 -0.40 0.00 0.00 41.96 39.55 3ism s TYR 209 CO -0.12 0.24 0.12 0.54 -1.57 0.00 0.00 175.55 174.77 3ism s VAL 210 N -0.20 -0.04 -0.16 0.71 0.11 -0.16 -0.76 120.40 119.90 3ism s VAL 210 Ca 0.05 0.16 -0.02 0.00 -2.93 0.00 0.00 61.98 59.24 3ism s VAL 210 Cb -0.12 -0.20 -0.02 0.00 -1.53 0.00 0.00 36.38 34.51 3ism s VAL 210 CO 0.02 0.07 -0.07 0.00 -3.33 0.00 0.00 175.10 171.78 3ism s THR 212 N 0.58 1.56 0.08 0.00 2.01 -0.78 -0.69 115.64 118.40 3ism s THR 212 Ca -0.05 -0.83 -0.27 0.00 0.31 0.00 0.00 61.69 60.85 3ism s THR 212 Cb -0.15 -1.31 0.09 0.00 0.01 0.00 0.00 72.50 71.14 3ism s THR 212 CO 0.03 0.44 1.10 -0.83 -0.69 0.00 0.00 174.62 174.67 3ism s GLY 213 N -0.32 -0.30 0.44 4.40 0.00 -1.02 -0.80 107.32 109.72 3ism s GLY 213 Ca 0.04 0.35 -0.10 0.00 0.00 0.00 0.00 44.72 45.00 3ism s GLY 213 CO 0.00 0.15 0.81 2.56 0.00 0.00 0.00 173.10 176.62 3ism s PRO 214 N -2.89 3.75 0.12 2.90 0.04 -1.26 -1.15 135.00 136.51 3ism s PRO 214 Ca 0.13 0.49 0.04 0.00 0.04 0.00 0.00 61.00 61.71 3ism s PRO 214 Cb 0.01 -2.35 -0.04 0.00 0.04 0.00 0.00 34.50 32.17 3ism s PRO 214 CO -0.00 -0.12 -0.10 -0.51 0.04 0.00 0.00 177.00 176.31 3ism s LEU 215 N -4.08 2.45 -0.41 -3.56 1.43 -0.15 -4.88 118.68 109.48 3ism s LEU 215 Ca 0.52 -0.89 0.02 0.00 -1.03 0.00 0.00 54.13 52.74 3ism s LEU 215 Cb -0.10 -0.34 0.15 0.00 0.03 0.00 0.00 46.19 45.93 3ism s LEU 215 CO 0.35 -0.28 0.27 -0.31 0.23 0.00 0.00 176.35 176.60 3ism s TYR 216 N -2.77 1.31 0.00 0.29 2.02 -1.26 -1.46 117.35 115.48 3ism s TYR 216 Ca 0.10 -2.12 -0.12 0.00 -0.37 0.00 0.00 57.07 54.56 3ism s TYR 216 Cb -0.01 -1.27 -0.05 0.00 -0.40 0.00 0.00 41.96 40.23 3ism s TYR 216 CO 0.00 -0.80 0.36 -0.51 -1.57 0.00 0.00 175.55 173.03 3ism s LEU 217 N 0.46 4.43 0.76 -1.29 1.43 -1.26 -4.94 118.68 118.26 3ism s LEU 217 Ca 0.22 0.83 -0.11 0.00 -1.03 0.00 0.00 54.13 54.04 3ism s LEU 217 Cb -0.15 -2.60 0.05 0.00 0.03 0.00 0.00 46.19 43.52 3ism s LEU 217 CO -0.06 0.30 1.09 -2.16 0.23 0.00 0.00 176.35 175.75 3ism s PRO 218 N -1.30 2.31 0.10 1.29 0.04 -1.26 -4.59 135.00 131.58 3ism s PRO 218 Ca 0.25 1.20 0.00 0.00 0.04 0.00 0.00 61.00 62.49 3ism s PRO 218 Cb -0.15 -1.90 -0.04 0.00 0.04 0.00 0.00 34.50 32.45 3ism s PRO 218 CO 0.13 -1.61 -0.03 -3.38 0.04 0.00 0.00 177.00 172.16 3ism s HIS 219 N -2.83 0.81 0.24 0.56 -3.43 -0.01 -4.92 115.29 105.71 3ism s HIS 219 Ca 0.62 -1.03 -0.16 0.00 -0.80 0.00 0.00 55.06 53.69 3ism s HIS 219 Cb -0.18 -0.50 -0.08 0.00 -1.43 0.00 0.00 32.58 30.40 3ism s HIS 219 CO 0.54 -0.29 0.68 0.15 -2.00 0.00 0.00 174.74 173.83 3ism s LYS 220 N -3.91 4.09 0.47 -0.38 1.02 -1.26 -1.01 119.74 118.76 3ism s LYS 220 Ca 0.14 0.69 0.04 0.00 0.02 0.00 0.00 55.97 56.86 3ism s LYS 220 Cb 0.07 -2.73 -0.04 0.00 -0.52 0.00 0.00 37.83 34.61 3ism s LYS 220 CO -0.04 0.33 0.06 -1.21 -0.92 0.00 0.00 175.35 173.56 3ism s GLU 221 N -2.36 2.12 0.59 1.68 2.02 -0.24 -4.96 118.70 117.56 3ism s GLU 221 Ca 0.46 -2.20 0.29 0.00 0.02 0.00 0.00 54.97 53.54 3ism s GLU 221 Cb -0.14 -1.67 1.71 0.00 0.10 0.00 0.00 34.13 34.14 3ism s GLU 221 CO 0.20 -0.25 2.14 -0.44 0.02 0.00 0.00 175.26 176.93 3ism h ASP 222 N 1.45 0.00 0.18 -0.19 5.19 -1.99 0.50 116.42 121.57 3ism h ASP 222 Ca -0.43 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 55.98 3ism h ASP 222 Cb 1.28 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.79 3ism h ASP 222 CO 0.75 0.00 0.00 -0.90 -3.12 0.00 0.00 179.24 175.97 3ism n ASP 223 N -3.79 0.00 0.00 6.45 5.68 -1.26 -4.89 116.55 118.74 3ism n ASP 223 Ca 0.00 -0.58 0.00 0.00 -0.50 0.00 0.00 54.79 53.71 3ism n ASP 223 Cb 0.26 -0.11 0.00 0.00 -1.14 0.00 0.00 41.12 40.13 3ism n ASP 223 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3ism n GLY 224 N 0.81 1.49 3.92 6.12 0.00 0.17 -5.03 105.19 112.67 3ism n GLY 224 Ca 0.18 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.94 3ism n GLY 224 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3ism s LYS 225 N -0.04 3.38 -0.02 1.61 1.02 -1.26 -4.82 119.74 119.62 3ism s LYS 225 Ca 0.00 0.00 -0.00 0.00 0.02 0.00 0.00 55.97 55.99 3ism s LYS 225 Cb 0.00 -2.43 -0.04 0.00 -0.52 0.00 0.00 37.83 34.85 3ism s LYS 225 CO 0.00 -0.23 0.03 -1.12 -0.92 0.00 0.00 175.35 173.11 3ism s SER 226 N -4.14 5.38 -0.02 2.83 0.01 -1.26 -1.07 113.70 115.43 3ism s SER 226 Ca 0.47 0.09 -0.02 0.00 1.31 0.00 0.00 55.95 57.80 3ism s SER 226 Cb -0.10 -1.49 0.00 0.00 0.21 0.00 0.00 66.02 64.64 3ism s SER 226 CO 0.43 0.30 0.06 -0.31 0.41 0.00 0.00 173.24 174.13 3ism s TYR 227 N -1.09 -0.02 -0.18 2.43 1.51 -0.18 -4.94 117.35 114.88 3ism s TYR 227 Ca 0.19 0.06 -0.15 0.00 -1.01 0.00 0.00 57.07 56.17 3ism s TYR 227 Cb -0.12 -0.01 -0.04 0.00 -0.11 0.00 0.00 41.96 41.68 3ism s TYR 227 CO 0.10 -0.08 0.36 0.08 -1.11 0.00 0.00 175.55 174.90 3ism s VAL 228 N -0.27 5.24 -0.02 0.71 1.01 -1.26 -0.83 120.40 124.98 3ism s VAL 228 Ca -0.03 0.66 0.01 0.00 0.00 0.00 0.00 61.98 62.62 3ism s VAL 228 Cb -0.02 -3.69 0.01 0.00 0.00 0.00 0.00 36.38 32.67 3ism s VAL 228 CO 0.00 0.32 -0.04 -0.75 0.00 0.00 0.00 175.10 174.62 3ism s LYS 229 N 0.90 0.57 -0.04 2.72 2.20 -1.26 -5.05 119.74 119.78 3ism s LYS 229 Ca 0.18 -0.13 -0.16 0.00 -0.36 0.00 0.00 55.97 55.50 3ism s LYS 229 Cb -0.14 -0.59 0.03 0.00 -1.51 0.00 0.00 37.83 35.62 3ism s LYS 229 CO 0.07 0.01 0.36 1.52 -0.36 0.00 0.00 175.35 176.95 3ism s TYR 230 N 0.40 -0.28 0.42 4.03 1.13 -1.26 -4.92 117.35 116.88 3ism s TYR 230 Ca -0.05 0.51 -0.24 0.00 -1.41 0.00 0.00 57.07 55.88 3ism s TYR 230 Cb -0.08 0.14 -0.08 0.00 -1.10 0.00 0.00 41.96 40.83 3ism s TYR 230 CO -0.00 -0.38 1.13 -2.00 -2.51 0.00 0.00 175.55 171.79 3ism s GLU 231 N -1.02 3.96 -0.07 -3.49 2.12 -1.26 -4.86 118.70 114.09 3ism s GLU 231 Ca -0.11 1.72 0.05 0.00 0.36 0.00 0.00 54.97 57.00 3ism s GLU 231 Cb -0.04 -2.53 -0.01 0.00 0.26 0.00 0.00 34.13 31.81 3ism s GLU 231 CO 0.04 -0.36 -0.24 0.14 -0.54 0.00 0.00 175.26 174.30 3ism s VAL 232 N -1.54 1.98 0.02 3.70 -7.23 -1.26 -0.35 120.40 115.73 3ism s VAL 232 Ca 0.60 -1.01 0.04 0.00 -1.81 0.00 0.00 61.98 59.80 3ism s VAL 232 Cb -0.27 -1.69 -0.03 0.00 0.56 0.00 0.00 36.38 34.95 3ism s VAL 232 CO 0.34 0.55 -0.07 0.27 -0.31 0.00 0.00 175.10 175.88 3ism s ILE 233 N 0.00 3.61 0.08 -0.62 -4.36 0.86 -4.77 121.20 116.01 3ism s ILE 233 Ca -0.08 -0.85 0.00 0.00 -0.26 0.00 0.00 60.65 59.47 3ism s ILE 233 Cb -0.15 -2.59 0.00 0.00 1.25 0.00 0.00 42.46 40.97 3ism s ILE 233 CO 0.05 0.35 0.00 0.61 0.24 0.00 0.00 174.94 176.19 3ism n GLY 234 N 1.42 -2.00 0.33 6.27 0.00 -1.25 -0.60 105.19 109.37 3ism n GLY 234 Ca -0.15 -1.43 0.15 0.00 0.00 0.00 0.00 46.02 44.59 3ism n GLY 234 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ism h ALA 235 N -0.25 2.21 -0.20 4.61 0.00 -1.90 -0.43 119.26 123.30 3ism h ALA 235 Ca -0.01 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.89 3ism h ALA 235 Cb 0.24 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.05 3ism h ALA 235 CO 0.01 -0.36 0.00 0.09 0.00 0.00 0.00 179.25 178.99 3ism n ASN 236 N -4.35 1.37 -3.90 0.00 3.02 -1.26 -4.95 115.26 105.19 3ism n ASN 236 Ca 0.04 -1.83 -0.40 0.00 -0.03 0.00 0.00 54.58 52.36 3ism n ASN 236 Cb 0.37 -0.13 0.03 0.00 -0.61 0.00 0.00 39.78 39.44 3ism n ASN 236 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 3ism n THR 237 N 0.18 -4.13 -2.45 3.41 -2.24 -0.17 -4.89 114.28 104.00 3ism n THR 237 Ca 0.12 -0.75 -0.42 0.00 -2.27 0.00 0.00 64.05 60.73 3ism n THR 237 Cb 0.25 -3.21 -0.03 0.00 -2.10 0.00 0.00 70.33 65.24 3ism n THR 237 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 3ism s VAL 238 N -3.49 4.24 0.31 2.28 1.01 0.24 -4.62 120.40 120.37 3ism s VAL 238 Ca 0.48 1.56 -0.29 0.00 0.00 0.00 0.00 61.98 63.73 3ism s VAL 238 Cb -0.22 -4.00 -0.10 0.00 0.00 0.00 0.00 36.38 32.05 3ism s VAL 238 CO 0.92 -0.03 1.26 0.00 0.00 0.00 0.00 175.10 177.26 3ism s ALA 239 N 2.45 3.48 -0.48 5.51 0.00 -0.39 -0.10 121.76 132.23 3ism s ALA 239 Ca 0.56 1.17 -0.14 0.00 0.00 0.00 0.00 51.96 53.54 3ism s ALA 239 Cb -0.24 -3.45 0.09 0.00 0.00 0.00 0.00 23.12 19.53 3ism s ALA 239 CO 0.21 -0.52 0.40 0.08 0.00 0.00 0.00 175.76 175.93 3ism s VAL 240 N -1.01 4.99 0.62 0.00 1.01 0.53 -4.34 120.40 122.20 3ism s VAL 240 Ca 0.49 -1.30 -0.19 0.00 0.00 0.00 0.00 61.98 60.98 3ism s VAL 240 Cb -0.38 -4.08 -0.02 0.00 0.00 0.00 0.00 36.38 31.90 3ism s VAL 240 CO 0.49 -0.67 1.29 -2.84 0.00 0.00 0.00 175.10 173.37 3ism s PRO 241 N 1.57 2.73 0.16 2.72 0.02 -1.26 -4.30 135.00 136.64 3ism s PRO 241 Ca 0.04 2.07 0.08 0.00 0.02 0.00 0.00 61.00 63.20 3ism s PRO 241 Cb -0.26 -1.94 -0.05 0.00 0.02 0.00 0.00 34.50 32.27 3ism s PRO 241 CO 0.04 -1.46 1.37 1.79 -0.33 0.00 0.00 177.00 178.42 3ism h THR 242 N 0.77 1.64 -3.52 0.99 1.35 -1.61 -3.42 112.91 109.12 3ism h THR 242 Ca -0.51 -3.06 -0.05 0.00 -0.55 0.00 0.00 66.41 62.24 3ism h THR 242 Cb 1.32 2.65 -0.11 0.00 -1.73 0.00 0.00 68.15 70.28 3ism h THR 242 CO 0.54 0.87 -0.10 -1.00 -0.25 0.00 0.00 175.52 175.58 3ism s HIS 243 N -2.97 0.06 0.10 4.73 3.76 -1.12 -0.60 115.29 119.25 3ism s HIS 243 Ca 0.00 -0.42 0.04 0.00 -0.15 0.00 0.00 55.06 54.54 3ism s HIS 243 Cb 0.11 0.22 -0.04 0.00 1.11 0.00 0.00 32.58 33.99 3ism s HIS 243 CO 0.80 -0.84 -0.10 -0.06 -0.85 0.00 0.00 174.74 173.70 3ism s PHE 244 N -3.90 1.09 0.21 1.40 0.08 -0.33 -0.98 117.98 115.55 3ism s PHE 244 Ca 0.12 -0.65 0.08 0.00 0.12 0.00 0.00 56.93 56.60 3ism s PHE 244 Cb 0.01 -0.59 -0.05 0.00 -0.57 0.00 0.00 43.02 41.82 3ism s PHE 244 CO -0.02 0.01 -0.15 1.52 -0.10 0.00 0.00 175.22 176.48 3ism s TYR 245 N -2.44 1.76 -0.06 0.36 -0.85 -0.30 -1.07 117.35 114.76 3ism s TYR 245 Ca 0.06 -0.56 0.01 0.00 -0.52 0.00 0.00 57.07 56.06 3ism s TYR 245 Cb -0.03 -0.82 0.02 0.00 0.38 0.00 0.00 41.96 41.51 3ism s TYR 245 CO 0.00 0.38 -0.06 0.15 -1.52 0.00 0.00 175.55 174.50 3ism s LYS 246 N -3.64 1.07 -0.14 -3.49 1.02 -0.78 -2.43 119.74 111.35 3ism s LYS 246 Ca 0.23 -0.17 0.02 0.00 0.02 0.00 0.00 55.97 56.07 3ism s LYS 246 Cb -0.01 -1.03 0.01 0.00 -0.52 0.00 0.00 37.83 36.28 3ism s LYS 246 CO 0.08 -0.08 -0.20 0.08 -0.92 0.00 0.00 175.35 174.30 3ism s VAL 247 N 0.98 2.24 -0.03 3.17 1.01 0.13 -1.24 120.40 126.65 3ism s VAL 247 Ca -0.10 -0.92 0.03 0.00 0.00 0.00 0.00 61.98 60.99 3ism s VAL 247 Cb -0.14 -1.91 0.00 0.00 0.00 0.00 0.00 36.38 34.33 3ism s VAL 247 CO 0.00 0.54 -0.10 -0.63 0.00 0.00 0.00 175.10 174.91 3ism s ILE 248 N 0.80 0.89 -0.11 2.22 1.01 0.94 -1.17 121.20 125.77 3ism s ILE 248 Ca -0.07 -0.42 0.01 0.00 0.00 0.00 0.00 60.65 60.17 3ism s ILE 248 Cb -0.16 -0.78 0.02 0.00 0.01 0.00 0.00 42.46 41.55 3ism s ILE 248 CO -0.01 0.27 -0.12 -0.69 0.00 0.00 0.00 174.94 174.39 3ism s VAL 249 N 0.15 1.30 -0.09 2.92 1.01 0.06 -0.62 120.40 125.14 3ism s VAL 249 Ca -0.03 -0.51 -0.04 0.00 0.00 0.00 0.00 61.98 61.41 3ism s VAL 249 Cb -0.09 -1.23 -0.04 0.00 0.00 0.00 0.00 36.38 35.03 3ism s VAL 249 CO 0.01 0.41 0.07 -0.83 0.00 0.00 0.00 175.10 174.75 3ism s GLY 250 N 1.21 2.00 -0.29 4.51 0.00 0.59 -0.83 107.32 114.52 3ism s GLY 250 Ca -0.03 -0.75 -0.10 0.00 0.00 0.00 0.00 44.72 43.85 3ism s GLY 250 CO -0.04 -0.52 0.14 -0.54 0.00 0.00 0.00 173.10 172.14 3ism s GLU 251 N -1.07 3.60 0.89 2.90 2.02 -0.77 -1.15 118.70 125.11 3ism s GLU 251 Ca 0.15 -0.54 -0.15 0.00 0.02 0.00 0.00 54.97 54.45 3ism s GLU 251 Cb -0.12 -3.54 0.21 0.00 0.10 0.00 0.00 34.13 30.78 3ism s GLU 251 CO 0.05 -0.29 1.19 -1.13 0.02 0.00 0.00 175.26 175.09 3ism n SER 252 N 4.99 -0.03 0.15 -0.19 3.41 -0.76 -2.98 113.62 118.22 3ism n SER 252 Ca -0.14 -1.41 -0.14 0.00 -0.26 0.00 0.00 58.87 56.91 3ism n SER 252 Cb 0.51 -0.92 -0.08 0.00 -0.26 0.00 0.00 64.21 63.46 3ism n SER 252 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3ism h ALA 253 N -1.86 -0.34 -1.94 7.33 0.00 -1.89 -3.42 119.26 117.15 3ism h ALA 253 Ca -0.39 -0.11 -0.39 0.00 0.00 0.00 0.00 54.91 54.02 3ism h ALA 253 Cb 1.07 0.13 0.21 0.00 0.00 0.00 0.00 17.79 19.20 3ism h ALA 253 CO 0.27 -0.64 0.02 0.16 0.00 0.00 0.00 179.25 179.06 3ism s ASP 254 N -4.98 -0.22 -0.04 0.00 1.47 -1.26 -4.89 116.67 106.74 3ism s ASP 254 Ca -0.15 0.61 0.03 0.00 1.18 0.00 0.00 52.55 54.22 3ism s ASP 254 Cb 0.04 -0.81 0.17 0.00 -0.34 0.00 0.00 42.92 41.98 3ism s ASP 254 CO 0.63 -4.82 0.79 1.41 0.68 0.00 0.00 175.17 173.86 3ism n HIS 255 N -5.23 0.41 -2.54 2.11 8.25 -1.26 -4.90 115.22 112.05 3ism n HIS 255 Ca 0.15 -0.14 -0.37 0.00 -0.26 0.00 0.00 57.72 57.09 3ism n HIS 255 Cb 0.60 -0.17 -0.04 0.00 1.12 0.00 0.00 29.99 31.50 3ism n HIS 255 CO 0.00 0.00 0.00 0.15 0.64 0.00 0.00 176.34 177.13 3ism s LYS 256 N -1.40 4.27 -0.08 -0.41 1.02 -1.26 -4.89 119.74 116.98 3ism s LYS 256 Ca 0.11 1.56 0.03 0.00 0.02 0.00 0.00 55.97 57.69 3ism s LYS 256 Cb 0.08 -2.67 -0.02 0.00 -0.52 0.00 0.00 37.83 34.71 3ism s LYS 256 CO 0.04 -0.06 -0.17 -0.51 -0.92 0.00 0.00 175.35 173.72 3ism s LEU 257 N -2.40 2.51 -0.09 3.17 1.43 -1.26 -1.83 118.68 120.21 3ism s LEU 257 Ca 0.55 -0.34 0.02 0.00 -1.03 0.00 0.00 54.13 53.32 3ism s LEU 257 Cb -0.24 -1.51 0.01 0.00 0.03 0.00 0.00 46.19 44.49 3ism s LEU 257 CO 0.30 0.25 -0.13 -1.00 0.23 0.00 0.00 176.35 176.00 3ism s HIS 258 N -0.19 1.68 -0.07 0.29 3.76 -0.30 -0.09 115.29 120.37 3ism s HIS 258 Ca -0.01 -0.72 -0.00 0.00 -0.15 0.00 0.00 55.06 54.18 3ism s HIS 258 Cb -0.13 -1.24 -0.03 0.00 1.11 0.00 0.00 32.58 32.29 3ism s HIS 258 CO 0.03 -0.38 -0.02 1.41 -0.85 0.00 0.00 174.74 174.93 3ism s MET 259 N 0.90 2.88 0.05 1.40 1.75 -0.18 -0.30 119.30 125.80 3ism s MET 259 Ca -0.09 -0.48 0.06 0.00 -1.25 0.00 0.00 55.69 53.92 3ism s MET 259 Cb -0.15 -2.71 -0.02 0.00 2.84 0.00 0.00 34.83 34.78 3ism s MET 259 CO 0.01 0.68 -0.17 -1.21 -0.65 0.00 0.00 175.02 173.68 3ism s GLU 260 N -0.97 1.08 -0.10 4.11 2.02 0.21 -0.31 118.70 124.75 3ism s GLU 260 Ca 0.14 -0.85 -0.08 0.00 0.02 0.00 0.00 54.97 54.20 3ism s GLU 260 Cb -0.11 -1.14 0.03 0.00 0.10 0.00 0.00 34.13 33.01 3ism s GLU 260 CO 0.03 0.28 0.26 -1.54 0.02 0.00 0.00 175.26 174.32 3ism s SER 261 N -1.22 -0.28 0.04 -0.19 1.04 -1.26 -0.04 113.70 111.79 3ism s SER 261 Ca 0.04 0.53 0.04 0.00 0.48 0.00 0.00 55.95 57.04 3ism s SER 261 Cb -0.08 0.51 -0.02 0.00 0.10 0.00 0.00 66.02 66.53 3ism s SER 261 CO 0.02 -0.11 -0.13 -0.31 0.98 0.00 0.00 173.24 173.69 3ism s TYR 262 N 0.39 1.09 -0.10 5.02 2.02 -0.37 -1.77 117.35 123.63 3ism s TYR 262 Ca -0.02 -0.35 -0.00 0.00 -0.37 0.00 0.00 57.07 56.33 3ism s TYR 262 Cb -0.04 -0.65 0.02 0.00 -0.40 0.00 0.00 41.96 40.90 3ism s TYR 262 CO -0.02 0.02 -0.07 0.08 -1.57 0.00 0.00 175.55 173.98 3ism s VAL 263 N -0.85 0.98 -0.03 0.71 1.01 -0.32 -1.86 120.40 120.02 3ism s VAL 263 Ca 0.00 -0.27 0.07 0.00 0.00 0.00 0.00 61.98 61.78 3ism s VAL 263 Cb -0.08 -0.99 -0.02 0.00 0.00 0.00 0.00 36.38 35.30 3ism s VAL 263 CO 0.01 0.35 -0.24 -0.04 0.00 0.00 0.00 175.10 175.18 3ism s MET 264 N 1.60 2.15 0.38 2.72 -1.94 -0.23 -4.76 119.30 119.22 3ism s MET 264 Ca 0.03 -0.87 -0.25 0.00 -1.71 0.00 0.00 55.69 52.88 3ism s MET 264 Cb -0.13 -1.98 -0.09 0.00 2.01 0.00 0.00 34.83 34.64 3ism s MET 264 CO -0.07 0.47 1.07 -1.25 -0.01 0.00 0.00 175.02 175.23 3ism s PRO 265 N -0.42 4.23 -1.37 2.03 0.04 -1.26 -1.19 135.00 137.06 3ism s PRO 265 Ca 0.05 1.58 -0.15 0.00 0.04 0.00 0.00 61.00 62.52 3ism s PRO 265 Cb -0.11 -2.66 0.02 0.00 0.04 0.00 0.00 34.50 31.80 3ism s PRO 265 CO 0.01 -0.10 2.13 -1.71 0.04 0.00 0.00 177.00 177.36 3ism n ASN 266 N 0.14 3.89 -3.81 6.66 5.15 0.23 -4.83 115.26 122.68 3ism n ASN 266 Ca 0.04 -2.83 -0.09 0.00 -0.60 0.00 0.00 54.58 51.09 3ism n ASN 266 Cb 0.49 -1.62 -0.04 0.00 -0.53 0.00 0.00 39.78 38.07 3ism n ASN 266 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3ism s GLN 267 N 3.56 1.67 -0.02 1.20 -2.07 -1.26 -4.70 119.66 118.05 3ism s GLN 267 Ca 0.49 -1.29 -0.30 0.00 -1.82 0.00 0.00 55.36 52.45 3ism s GLN 267 Cb 0.12 0.50 -0.08 0.00 -1.09 0.00 0.00 33.01 32.46 3ism s GLN 267 CO -0.04 -0.72 2.00 0.08 -1.32 0.00 0.00 175.29 175.29 3ism s VAL 268 N -3.76 3.04 -0.09 3.63 1.01 -1.26 -4.50 120.40 118.47 3ism s VAL 268 Ca 0.21 0.05 -0.00 0.00 0.00 0.00 0.00 61.98 62.24 3ism s VAL 268 Cb -0.02 -3.04 -0.03 0.00 0.00 0.00 0.00 36.38 33.30 3ism s VAL 268 CO 0.10 -0.01 -0.06 -0.63 0.00 0.00 0.00 175.10 174.50 3ism s ILE 269 N 5.21 3.72 0.32 2.22 1.01 0.12 -5.02 121.20 128.77 3ism s ILE 269 Ca 0.90 -0.46 -0.28 0.00 0.00 0.00 0.00 60.65 60.81 3ism s ILE 269 Cb -0.40 -2.54 -0.13 0.00 0.01 0.00 0.00 42.46 39.39 3ism s ILE 269 CO 0.40 0.57 1.19 -0.24 0.00 0.00 0.00 174.94 176.87 3ism n SER 270 N 2.54 2.22 0.21 3.58 2.88 -1.26 -4.70 113.62 119.10 3ism n SER 270 Ca -0.18 1.19 0.15 0.00 -1.33 0.00 0.00 58.87 58.70 3ism n SER 270 Cb 0.53 -1.41 0.63 0.00 -0.75 0.00 0.00 64.21 63.21 3ism n SER 270 CO 0.00 0.00 0.00 0.78 -1.23 0.00 0.00 175.04 174.59 3ism h ASN 271 N 2.43 0.00 0.04 -3.46 2.35 -1.99 -2.73 115.58 112.23 3ism h ASN 271 Ca -0.44 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.31 3ism h ASN 271 Cb 1.30 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.67 3ism h ASN 271 CO 0.62 0.00 -0.09 -0.90 -1.65 0.00 0.00 177.43 175.41 3ism n ASP 272 N -2.65 1.65 -4.64 5.81 5.75 -1.26 -4.89 116.55 116.32 3ism n ASP 272 Ca 0.01 -1.43 -0.43 0.00 -0.01 0.00 0.00 54.79 52.93 3ism n ASP 272 Cb 0.24 0.06 -0.02 0.00 -1.03 0.00 0.00 41.12 40.37 3ism n ASP 272 CO 0.00 0.00 0.00 -0.89 -0.11 0.00 0.00 177.20 176.20 3ism s THR 273 N -2.15 4.25 0.45 2.12 2.01 -1.03 -5.01 115.64 116.28 3ism s THR 273 Ca 0.32 1.46 -0.23 0.00 0.31 0.00 0.00 61.69 63.55 3ism s THR 273 Cb 0.20 -4.12 -0.08 0.00 0.01 0.00 0.00 72.50 68.51 3ism s THR 273 CO 0.39 -0.33 1.10 -2.84 -0.69 0.00 0.00 174.62 172.25 3ism s PRO 274 N 3.82 3.88 0.56 4.92 0.02 -1.26 -4.91 135.00 142.03 3ism s PRO 274 Ca 0.54 1.59 0.33 0.00 0.02 0.00 0.00 61.00 63.49 3ism s PRO 274 Cb -0.18 -2.36 1.59 0.00 0.02 0.00 0.00 34.50 33.56 3ism s PRO 274 CO 0.18 -0.41 2.08 -0.84 -0.33 0.00 0.00 177.00 177.69 3ism h ILE 275 N 1.87 0.22 -0.51 2.83 3.07 -1.95 -2.76 117.51 120.27 3ism h ILE 275 Ca -0.49 -0.46 0.12 0.00 1.55 0.00 0.00 64.86 65.57 3ism h ILE 275 Cb 1.23 1.37 -0.03 0.00 -0.27 0.00 0.00 36.82 39.13 3ism h ILE 275 CO 0.60 0.06 0.36 0.77 -1.05 0.00 0.00 178.15 178.89 3ism h SER 276 N 0.00 0.16 0.08 2.16 4.64 -2.00 -0.61 113.55 117.96 3ism h SER 276 Ca -0.00 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3ism h SER 276 Cb 0.37 -0.03 -0.00 0.00 -0.31 0.00 0.00 62.40 62.43 3ism h SER 276 CO 0.01 0.09 -0.02 0.58 -0.87 0.00 0.00 176.83 176.62 3ism h VAL 277 N 0.17 0.39 -0.39 0.95 2.07 -1.88 -2.64 116.25 114.91 3ism h VAL 277 Ca 0.24 -0.09 0.00 0.00 0.82 0.00 0.00 66.70 67.67 3ism h VAL 277 Cb 0.73 1.06 0.00 0.00 -1.52 0.00 0.00 31.29 31.56 3ism h VAL 277 CO -0.04 0.02 0.00 0.49 0.02 0.00 0.00 177.57 178.06 3ism n PHE 278 N -3.61 0.51 -2.19 1.57 3.72 -0.24 -4.93 117.46 112.30 3ism n PHE 278 Ca -0.03 -0.26 -0.42 0.00 -0.05 0.00 0.00 57.45 56.70 3ism n PHE 278 Cb 0.11 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 38.62 3ism n PHE 278 CO 0.00 0.00 0.00 -0.65 -0.05 0.00 0.00 176.76 176.06 3ism s GLN 279 N -1.49 4.36 0.03 -1.08 -0.21 -1.00 -1.18 119.66 119.09 3ism s GLN 279 Ca 0.37 2.07 0.01 0.00 0.02 0.00 0.00 55.36 57.83 3ism s GLN 279 Cb 0.20 -3.21 -0.02 0.00 1.00 0.00 0.00 33.01 30.98 3ism s GLN 279 CO 0.28 -0.32 -0.05 0.14 -2.12 0.00 0.00 175.29 173.22 3ism s VAL 280 N 0.45 0.26 0.23 1.09 -7.23 -0.73 -4.91 120.40 109.56 3ism s VAL 280 Ca 0.59 -0.99 -0.32 0.00 -1.81 0.00 0.00 61.98 59.46 3ism s VAL 280 Cb -0.37 -0.41 -0.13 0.00 0.56 0.00 0.00 36.38 36.04 3ism s VAL 280 CO 0.36 -0.47 1.51 -2.65 -0.31 0.00 0.00 175.10 173.53 3ism n PRO 281 N 1.52 2.26 -0.08 4.82 -0.02 -1.26 -4.49 135.00 137.74 3ism n PRO 281 Ca -0.23 0.81 0.14 0.00 -2.02 0.00 0.00 63.50 62.19 3ism n PRO 281 Cb 0.55 -2.53 0.53 0.00 -0.02 0.00 0.00 33.50 32.04 3ism n PRO 281 CO 0.00 0.00 0.00 -1.00 1.98 0.00 0.00 175.50 176.48 3ism h PRO 282 N 4.86 0.33 0.00 0.52 0.13 -1.97 -1.10 132.00 134.77 3ism h PRO 282 Ca -0.45 -0.02 -0.07 0.00 -0.87 0.00 0.00 66.00 64.59 3ism h PRO 282 Cb 1.25 -0.07 -0.01 0.00 0.13 0.00 0.00 31.00 32.30 3ism h PRO 282 CO 0.80 0.22 -0.33 0.93 -0.23 0.00 0.00 178.00 179.39 3ism h GLU 283 N 0.34 0.00 -0.05 0.86 5.08 -1.99 -0.54 114.58 118.29 3ism h GLU 283 Ca 0.29 0.00 -0.16 0.00 -1.00 0.00 0.00 59.36 58.49 3ism h GLU 283 Cb 0.67 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.91 3ism h GLU 283 CO -0.07 0.33 -0.68 0.66 -1.00 0.00 0.00 179.01 178.25 3ism h SER 284 N 0.00 0.25 -0.37 1.42 4.64 -1.57 -0.39 113.55 117.53 3ism h SER 284 Ca -0.00 -0.16 -0.04 0.00 -0.47 0.00 0.00 61.79 61.12 3ism h SER 284 Cb 0.64 -0.07 -0.02 0.00 -0.31 0.00 0.00 62.40 62.64 3ism h SER 284 CO 0.04 0.85 0.09 0.58 -0.87 0.00 0.00 176.83 177.53 3ism h VAL 285 N 0.15 1.23 -0.34 0.95 2.07 -1.27 -2.13 116.25 116.90 3ism h VAL 285 Ca -0.02 -0.77 0.02 0.00 0.82 0.00 0.00 66.70 66.76 3ism h VAL 285 Cb 1.22 1.02 -0.03 0.00 -1.52 0.00 0.00 31.29 31.98 3ism h VAL 285 CO 0.10 0.26 0.18 -0.33 0.02 0.00 0.00 177.57 177.81 3ism h GLU 286 N 0.45 0.36 -0.58 1.57 5.08 -0.97 0.16 114.58 120.66 3ism h GLU 286 Ca 0.12 -0.02 -0.03 0.00 -1.00 0.00 0.00 59.36 58.43 3ism h GLU 286 Cb 0.30 -0.08 -0.03 0.00 0.50 0.00 0.00 28.75 29.45 3ism h GLU 286 CO 0.00 0.24 0.25 -0.09 -1.00 0.00 0.00 179.01 178.41 3ism h ARG 287 N 0.37 0.85 -0.17 2.33 2.43 -1.05 -1.71 114.38 117.43 3ism h ARG 287 Ca 0.14 -0.14 -0.14 0.00 -0.81 0.00 0.00 59.98 59.02 3ism h ARG 287 Cb 0.03 -0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 29.43 3ism h ARG 287 CO -0.08 0.72 -0.49 0.77 -1.51 0.00 0.00 179.97 179.38 3ism h SER 288 N 0.79 0.48 1.39 -3.80 0.02 -1.13 -3.30 113.55 108.00 3ism h SER 288 Ca 0.19 -0.24 -0.02 0.00 -0.84 0.00 0.00 61.79 60.88 3ism h SER 288 Cb 0.17 -0.14 -0.00 0.00 0.14 0.00 0.00 62.40 62.57 3ism h SER 288 CO -0.02 0.90 -0.61 0.00 -1.14 0.00 0.00 176.83 175.95 3ism h ALA 289 N 1.12 0.72 -2.16 3.77 0.00 -0.46 -3.45 119.26 118.79 3ism h ALA 289 Ca 0.02 -0.11 -0.18 0.00 0.00 0.00 0.00 54.91 54.64 3ism h ALA 289 Cb 0.99 0.02 0.02 0.00 0.00 0.00 0.00 17.79 18.82 3ism h ALA 289 CO 0.09 0.13 -0.26 0.41 0.00 0.00 0.00 179.25 179.61 3ism n GLY 290 N 1.17 0.15 3.04 0.00 0.00 -0.66 -5.04 105.19 103.85 3ism n GLY 290 Ca 0.01 -0.39 -0.08 0.00 0.00 0.00 0.00 46.02 45.55 3ism n GLY 290 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3ism s LEU 291 N -3.14 2.37 -0.17 0.99 1.43 -1.17 -4.99 118.68 113.99 3ism s LEU 291 Ca 0.12 -0.75 -0.01 0.00 -1.03 0.00 0.00 54.13 52.47 3ism s LEU 291 Cb -0.05 0.14 -0.00 0.00 0.03 0.00 0.00 46.19 46.30 3ism s LEU 291 CO 0.15 -0.45 -0.13 -0.76 0.23 0.00 0.00 176.35 175.39 3ism s LEU 292 N -2.19 2.56 -0.07 1.79 1.43 -1.20 -4.44 118.68 116.56 3ism s LEU 292 Ca -0.04 -0.45 -0.08 0.00 -1.03 0.00 0.00 54.13 52.52 3ism s LEU 292 Cb -0.01 -1.60 -0.04 0.00 0.03 0.00 0.00 46.19 44.57 3ism s LEU 292 CO -0.05 0.07 0.22 -0.36 0.23 0.00 0.00 176.35 176.45 3ism s PHE 293 N 0.93 3.62 -1.47 0.29 0.08 -1.26 -3.92 117.98 116.25 3ism s PHE 293 Ca -0.03 0.63 -0.07 0.00 0.12 0.00 0.00 56.93 57.58 3ism s PHE 293 Cb -0.15 -2.02 0.05 0.00 -0.57 0.00 0.00 43.02 40.34 3ism s PHE 293 CO -0.01 0.69 0.72 1.19 -0.10 0.00 0.00 175.22 177.71 3ism n PHE 294 N 1.75 -1.93 0.29 0.36 3.72 -1.26 -4.83 117.46 115.56 3ism n PHE 294 Ca -0.17 0.83 0.18 0.00 -0.05 0.00 0.00 57.45 58.24 3ism n PHE 294 Cb 0.54 -3.84 0.97 0.00 -0.94 0.00 0.00 39.48 36.22 3ism n PHE 294 CO 0.00 0.00 0.00 0.38 -0.05 0.00 0.00 176.76 177.09 3ism h ASP 295 N -1.86 0.00 1.22 4.37 3.04 -1.70 -0.28 116.42 121.20 3ism h ASP 295 Ca -0.60 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.19 3ism h ASP 295 Cb 1.37 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 39.66 3ism h ASP 295 CO 0.65 0.00 0.00 1.56 -2.04 0.00 0.00 179.24 179.41 3ism h GLN 296 N 0.00 0.00 -5.13 4.15 1.08 -1.65 -3.43 115.11 110.14 3ism h GLN 296 Ca 0.03 0.00 -0.63 0.00 -1.45 0.00 0.00 58.65 56.60 3ism h GLN 296 Cb 0.24 0.00 -0.15 0.00 -0.05 0.00 0.00 27.48 27.53 3ism h GLN 296 CO -0.00 0.00 -0.32 0.42 -0.95 0.00 0.00 178.83 177.98 3ism s ILE 297 N -3.24 5.23 0.04 2.54 1.01 -0.12 -5.06 121.20 121.59 3ism s ILE 297 Ca 0.07 0.46 -0.30 0.00 0.00 0.00 0.00 60.65 60.88 3ism s ILE 297 Cb 0.10 -3.65 -0.06 0.00 0.01 0.00 0.00 42.46 38.86 3ism s ILE 297 CO 0.53 0.21 1.42 0.21 0.00 0.00 0.00 174.94 177.31 3ism s ASN 298 N 1.53 6.82 0.54 3.58 2.47 -1.26 -4.91 114.94 123.70 3ism s ASN 298 Ca 0.13 2.21 0.36 0.00 0.42 0.00 0.00 52.86 55.98 3ism s ASN 298 Cb -0.15 -2.57 1.78 0.00 -1.45 0.00 0.00 41.25 38.86 3ism s ASN 298 CO 0.09 -0.72 2.08 0.03 -3.72 0.00 0.00 177.10 174.87 3ism h ARG 299 N 7.62 0.00 0.00 0.43 2.47 -1.97 0.48 114.38 123.41 3ism h ARG 299 Ca -0.40 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.32 3ism h ARG 299 Cb 1.19 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.51 3ism h ARG 299 CO 0.89 0.00 0.00 1.63 0.56 0.00 0.00 179.97 183.05 3ism n LYS 300 N -2.87 0.00 -0.13 0.04 5.02 -1.26 -2.96 118.16 116.01 3ism n LYS 300 Ca -0.01 0.12 0.08 0.00 -2.02 0.00 0.00 58.31 56.48 3ism n LYS 300 Cb 0.15 -1.50 0.14 0.00 -0.02 0.00 0.00 35.03 33.80 3ism n LYS 300 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 3ism n GLN 301 N -1.51 2.02 -1.87 1.97 6.02 0.16 -4.91 117.38 119.26 3ism n GLN 301 Ca 0.05 -1.88 -0.33 0.00 -0.01 0.00 0.00 57.00 54.84 3ism n GLN 301 Cb 0.26 -1.35 0.03 0.00 1.02 0.00 0.00 30.24 30.20 3ism n GLN 301 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 3ism s LEU 302 N -1.18 3.41 -0.21 1.08 1.43 -1.15 -4.63 118.68 117.42 3ism s LEU 302 Ca 0.26 1.86 -0.12 0.00 -1.03 0.00 0.00 54.13 55.10 3ism s LEU 302 Cb 0.16 -4.53 -0.19 0.00 0.03 0.00 0.00 46.19 41.65 3ism s LEU 302 CO 0.22 -1.38 0.05 0.41 0.23 0.00 0.00 176.35 175.88 3ism n THR 303 N -2.32 1.60 -4.09 5.49 -1.04 0.87 -4.59 114.28 110.20 3ism n THR 303 Ca 0.09 -0.37 -0.12 0.00 -2.04 0.00 0.00 64.05 61.61 3ism n THR 303 Cb 0.53 -1.82 -0.11 0.00 -1.82 0.00 0.00 70.33 67.11 3ism n THR 303 CO 0.00 0.00 0.00 0.42 -0.64 0.00 0.00 175.07 174.85 3ism s THR 304 N -2.48 0.52 -0.10 12.58 -4.23 -1.24 -0.82 115.64 119.88 3ism s THR 304 Ca -0.30 -1.35 -0.00 0.00 -1.18 0.00 0.00 61.69 58.86 3ism s THR 304 Cb 0.09 -0.93 0.02 0.00 1.34 0.00 0.00 72.50 73.02 3ism s THR 304 CO 0.62 -0.57 -0.07 -0.63 -0.54 0.00 0.00 174.62 173.44 3ism s ILE 305 N -2.17 0.89 -1.51 2.99 1.01 -0.21 -1.01 121.20 121.19 3ism s ILE 305 Ca -0.03 -0.22 -0.05 0.00 0.00 0.00 0.00 60.65 60.34 3ism s ILE 305 Cb -0.05 -0.93 0.04 0.00 0.01 0.00 0.00 42.46 41.54 3ism s ILE 305 CO -0.02 0.34 0.44 0.59 0.00 0.00 0.00 174.94 176.29 3ism n ASN 306 N 4.82 -0.85 -0.11 3.58 3.02 0.58 -1.40 115.26 124.90 3ism n ASN 306 Ca -0.13 -1.06 -0.01 0.00 -0.03 0.00 0.00 54.58 53.35 3ism n ASN 306 Cb 0.50 -2.71 -0.01 0.00 -0.61 0.00 0.00 39.78 36.96 3ism n ASN 306 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3ism n GLY 307 N -1.93 0.48 3.22 7.41 0.00 -1.26 -5.01 105.19 108.10 3ism n GLY 307 Ca -0.21 -0.19 -0.32 0.00 0.00 0.00 0.00 46.02 45.29 3ism n GLY 307 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3ism s LYS 308 N -1.04 3.10 0.23 1.61 2.20 -0.50 -5.06 119.74 120.28 3ism s LYS 308 Ca 0.00 -0.83 -0.31 0.00 -0.36 0.00 0.00 55.97 54.47 3ism s LYS 308 Cb 0.00 -2.43 -0.11 0.00 -1.51 0.00 0.00 37.83 33.78 3ism s LYS 308 CO 0.00 0.10 1.61 0.15 -0.36 0.00 0.00 175.35 176.84 3ism s LYS 309 N 0.57 4.16 0.17 4.03 1.02 -1.26 -1.04 119.74 127.39 3ism s LYS 309 Ca -0.12 2.50 -0.17 0.00 0.02 0.00 0.00 55.97 58.20 3ism s LYS 309 Cb -0.17 -3.08 -0.08 0.00 -0.52 0.00 0.00 37.83 33.99 3ism s LYS 309 CO 0.04 -0.64 0.63 0.08 -0.92 0.00 0.00 175.35 174.55 3ism s VAL 310 N 0.62 4.71 -1.84 3.17 1.01 -0.00 -4.91 120.40 123.16 3ism s VAL 310 Ca 0.68 1.08 0.00 0.00 0.00 0.00 0.00 61.98 63.74 3ism s VAL 310 Cb -0.47 -3.81 0.00 0.00 0.00 0.00 0.00 36.38 32.10 3ism s VAL 310 CO 0.39 0.26 0.46 0.00 0.00 0.00 0.00 175.10 176.20