#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2nxy s VAL 84 N 0.00 1.04 0.23 2.62 -7.23 -0.81 -5.00 120.40 111.25 2nxy s VAL 84 Ca 0.00 -0.31 -0.30 0.00 -1.81 0.00 0.00 61.98 59.57 2nxy s VAL 84 Cb 0.00 -1.05 -0.09 0.00 0.56 0.00 0.00 36.38 35.80 2nxy s VAL 84 CO 0.00 0.37 1.23 0.54 -0.31 0.00 0.00 175.10 176.93 2nxy s VAL 85 N 1.64 3.32 -0.39 1.32 0.11 -1.26 -1.42 120.40 123.72 2nxy s VAL 85 Ca 0.04 1.17 -0.17 0.00 -2.93 0.00 0.00 61.98 60.09 2nxy s VAL 85 Cb -0.13 -3.75 0.01 0.00 -1.53 0.00 0.00 36.38 30.99 2nxy s VAL 85 CO -0.08 0.21 0.44 -0.76 -3.33 0.00 0.00 175.10 171.59 2nxy s LEU 86 N -0.65 4.66 0.16 2.54 1.02 0.28 -4.94 118.68 121.75 2nxy s LEU 86 Ca 0.52 -0.45 -0.30 0.00 0.02 0.00 0.00 54.13 53.92 2nxy s LEU 86 Cb -0.35 -2.42 -0.08 0.00 0.02 0.00 0.00 46.19 43.37 2nxy s LEU 86 CO 0.40 -0.51 1.20 0.68 0.02 0.00 0.00 176.35 178.14 2nxy s VAL 87 N 2.18 3.67 -1.78 -1.59 -7.23 -1.26 -3.41 120.40 110.98 2nxy s VAL 87 Ca 0.13 1.35 0.00 0.00 -1.81 0.00 0.00 61.98 61.65 2nxy s VAL 87 Cb -0.17 -3.86 0.00 0.00 0.56 0.00 0.00 36.38 32.91 2nxy s VAL 87 CO 0.13 0.19 0.00 0.59 -0.31 0.00 0.00 175.10 175.70 2nxy n ASN 88 N 2.86 -5.31 -4.69 4.85 4.13 -1.26 -4.97 115.26 110.86 2nxy n ASN 88 Ca 0.06 0.41 -0.36 0.00 1.68 0.00 0.00 54.58 56.37 2nxy n ASN 88 Cb 0.45 -4.28 -0.09 0.00 -1.54 0.00 0.00 39.78 34.32 2nxy n ASN 88 CO 0.00 0.00 0.00 -0.69 0.28 0.00 0.00 177.26 176.85 2nxy s VAL 89 N -2.53 5.37 -0.21 2.41 1.01 -1.22 -5.08 120.40 120.15 2nxy s VAL 89 Ca 0.00 0.18 -0.02 0.00 0.00 0.00 0.00 61.98 62.13 2nxy s VAL 89 Cb 0.00 -3.47 0.00 0.00 0.00 0.00 0.00 36.38 32.91 2nxy s VAL 89 CO 0.00 0.40 -0.08 0.28 0.00 0.00 0.00 175.10 175.69 2nxy s THR 90 N 0.68 2.99 -0.02 3.92 -1.32 -1.26 -4.33 115.64 116.30 2nxy s THR 90 Ca 0.08 -0.67 0.07 0.00 -1.21 0.00 0.00 61.69 59.96 2nxy s THR 90 Cb -0.12 -2.36 -0.02 0.00 -1.51 0.00 0.00 72.50 68.49 2nxy s THR 90 CO 0.01 0.42 -0.24 -1.61 -2.21 0.00 0.00 174.62 170.99 2nxy s GLU 91 N 1.42 2.16 0.08 7.08 0.41 -0.89 -4.92 118.70 124.03 2nxy s GLU 91 Ca 0.05 -0.90 -0.26 0.00 -0.41 0.00 0.00 54.97 53.45 2nxy s GLU 91 Cb -0.14 -2.09 -0.06 0.00 -1.78 0.00 0.00 34.13 30.06 2nxy s GLU 91 CO -0.06 0.57 0.80 -0.80 -0.49 0.00 0.00 175.26 175.28 2nxy s ASN 92 N -0.63 7.29 0.11 -0.19 0.01 -1.26 -0.46 114.94 119.81 2nxy s ASN 92 Ca 0.10 1.54 0.09 0.00 -0.71 0.00 0.00 52.86 53.88 2nxy s ASN 92 Cb -0.10 -2.50 -0.04 0.00 0.41 0.00 0.00 41.25 39.03 2nxy s ASN 92 CO -0.01 0.03 -0.19 -0.36 -1.51 0.00 0.00 177.10 175.06 2nxy s PHE 93 N -0.21 2.50 -0.34 2.20 0.40 -0.01 -4.96 117.98 117.55 2nxy s PHE 93 Ca 0.40 -0.28 0.00 0.00 -0.60 0.00 0.00 56.93 56.44 2nxy s PHE 93 Cb -0.21 -1.35 0.14 0.00 0.51 0.00 0.00 43.02 42.10 2nxy s PHE 93 CO 0.25 0.35 0.24 1.21 0.70 0.00 0.00 175.22 177.98 2nxy s ASN 94 N -2.01 2.50 0.60 1.36 2.47 -1.24 -1.26 114.94 117.36 2nxy s ASN 94 Ca 0.17 -1.75 0.40 0.00 0.42 0.00 0.00 52.86 52.10 2nxy s ASN 94 Cb -0.10 -0.07 2.11 0.00 -1.45 0.00 0.00 41.25 41.74 2nxy s ASN 94 CO 0.09 -0.33 2.21 0.00 -3.72 0.00 0.00 177.10 175.35 2nxy h MET 95 N 7.39 0.00 0.00 0.43 -0.00 -1.34 -1.25 114.93 120.16 2nxy h MET 95 Ca -0.01 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.69 2nxy h MET 95 Cb 1.01 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 32.61 2nxy h MET 95 CO 0.28 0.00 -0.51 0.91 -0.00 0.00 0.00 176.91 177.59 2nxy n TRP 96 N -2.94 0.34 -3.59 -0.10 7.02 -1.26 -4.19 117.44 112.72 2nxy n TRP 96 Ca -0.02 0.10 -0.27 0.00 -1.02 0.00 0.00 57.50 56.28 2nxy n TRP 96 Cb 0.09 -0.52 -0.11 0.00 -2.42 0.00 0.00 31.31 28.36 2nxy n TRP 96 CO 0.00 0.00 0.00 1.63 -2.02 0.00 0.00 177.69 177.30 2nxy n LYS 97 N -1.87 1.08 -3.77 -0.99 5.02 -0.47 -5.08 118.16 112.09 2nxy n LYS 97 Ca 0.04 -3.83 -0.27 0.00 -2.02 0.00 0.00 58.31 52.23 2nxy n LYS 97 Cb 0.40 -1.94 -0.17 0.00 -0.02 0.00 0.00 35.03 33.30 2nxy n LYS 97 CO 0.00 0.00 0.00 1.21 -0.52 0.00 0.00 177.40 178.09 2nxy s ASN 98 N -0.85 2.82 0.65 4.39 3.84 -1.24 -4.75 114.94 119.80 2nxy s ASN 98 Ca 0.30 -0.75 0.41 0.00 0.21 0.00 0.00 52.86 53.03 2nxy s ASN 98 Cb 0.02 -0.65 2.27 0.00 -0.55 0.00 0.00 41.25 42.35 2nxy s ASN 98 CO -0.17 -0.28 2.34 0.44 -2.79 0.00 0.00 177.10 176.64 2nxy h ASP 99 N 8.22 0.00 -0.11 -4.21 3.32 -1.96 -0.83 116.42 120.86 2nxy h ASP 99 Ca -0.17 0.00 -0.04 0.00 0.02 0.00 0.00 57.03 56.84 2nxy h ASP 99 Cb 1.12 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.65 2nxy h ASP 99 CO 0.34 0.00 -0.03 0.24 -1.72 0.00 0.00 179.24 178.07 2nxy h MET 100 N 0.00 0.35 -0.05 3.56 2.86 -1.95 -1.11 114.93 118.59 2nxy h MET 100 Ca -0.00 -0.07 -0.01 0.00 -2.06 0.00 0.00 59.70 57.57 2nxy h MET 100 Cb 0.02 -0.05 -0.00 0.00 0.06 0.00 0.00 31.60 31.62 2nxy h MET 100 CO 0.00 0.40 -0.00 0.28 1.06 0.00 0.00 176.91 178.65 2nxy h VAL 101 N 0.33 1.27 -0.75 -2.22 2.07 -1.53 -1.57 116.25 113.85 2nxy h VAL 101 Ca 0.07 -0.83 0.03 0.00 0.82 0.00 0.00 66.70 66.80 2nxy h VAL 101 Cb 0.28 1.73 -0.05 0.00 -1.52 0.00 0.00 31.29 31.74 2nxy h VAL 101 CO 0.01 0.22 0.47 -0.33 0.02 0.00 0.00 177.57 177.97 2nxy h GLU 102 N -0.23 0.89 0.09 1.57 3.07 -1.56 -0.48 114.58 117.93 2nxy h GLU 102 Ca 0.01 -0.05 -0.00 0.00 -0.50 0.00 0.00 59.36 58.82 2nxy h GLU 102 Cb 0.36 -0.20 0.00 0.00 -0.84 0.00 0.00 28.75 28.07 2nxy h GLU 102 CO 0.00 0.59 -0.04 0.37 -1.40 0.00 0.00 179.01 178.53 2nxy h GLN 103 N 0.92 -0.11 -0.83 2.33 5.75 -1.18 -2.32 115.11 119.67 2nxy h GLN 103 Ca 0.31 0.01 0.02 0.00 -0.15 0.00 0.00 58.65 58.84 2nxy h GLN 103 Cb 0.04 0.03 -0.04 0.00 1.07 0.00 0.00 27.48 28.57 2nxy h GLN 103 CO -0.12 0.05 0.55 1.98 -2.65 0.00 0.00 178.83 178.64 2nxy h MET 104 N -0.26 1.04 -0.26 1.69 4.05 -1.08 -1.66 114.93 118.46 2nxy h MET 104 Ca -0.01 -0.06 0.00 0.00 -0.28 0.00 0.00 59.70 59.35 2nxy h MET 104 Cb 0.22 -0.24 -0.01 0.00 -0.80 0.00 0.00 31.60 30.77 2nxy h MET 104 CO 0.02 0.69 0.17 1.25 0.23 0.00 0.00 176.91 179.27 2nxy h HIS 105 N 1.08 0.32 -0.24 1.39 -0.00 -0.89 -0.56 115.15 116.25 2nxy h HIS 105 Ca 0.32 0.01 -0.07 0.00 -0.00 0.00 0.00 60.37 60.63 2nxy h HIS 105 Cb -0.04 -0.11 -0.01 0.00 -0.00 0.00 0.00 27.41 27.25 2nxy h HIS 105 CO -0.00 0.20 -0.14 0.93 -0.00 0.00 0.00 177.93 178.92 2nxy h GLU 106 N 0.35 0.40 -0.54 5.26 4.39 -1.01 -1.88 114.58 121.55 2nxy h GLU 106 Ca 0.10 -0.11 -0.07 0.00 0.34 0.00 0.00 59.36 59.62 2nxy h GLU 106 Cb -0.03 -0.04 -0.02 0.00 -0.10 0.00 0.00 28.75 28.55 2nxy h GLU 106 CO -0.03 0.54 0.06 -0.44 -1.16 0.00 0.00 179.01 177.99 2nxy h ASP 107 N 0.37 0.88 -0.07 1.42 3.32 -0.71 -2.14 116.42 119.49 2nxy h ASP 107 Ca 0.07 -0.28 -0.19 0.00 0.02 0.00 0.00 57.03 56.66 2nxy h ASP 107 Cb 0.48 -0.23 -0.00 0.00 0.22 0.00 0.00 39.33 39.79 2nxy h ASP 107 CO 0.03 0.94 -0.62 0.40 -1.72 0.00 0.00 179.24 178.26 2nxy h ILE 108 N 0.79 1.31 -0.66 0.35 1.08 -0.87 -1.47 117.51 118.03 2nxy h ILE 108 Ca 0.16 -1.86 0.03 0.00 -0.39 0.00 0.00 64.86 62.80 2nxy h ILE 108 Cb 0.45 1.82 -0.04 0.00 -3.07 0.00 0.00 36.82 35.98 2nxy h ILE 108 CO 0.02 0.59 0.41 0.40 -0.69 0.00 0.00 178.15 178.87 2nxy h ILE 109 N 0.50 1.08 -0.61 -0.67 2.04 -1.30 -1.28 117.51 117.27 2nxy h ILE 109 Ca -0.01 -0.27 -0.08 0.00 1.00 0.00 0.00 64.86 65.50 2nxy h ILE 109 Cb 1.21 0.21 -0.02 0.00 -0.74 0.00 0.00 36.82 37.48 2nxy h ILE 109 CO 0.12 0.15 0.08 0.28 0.00 0.00 0.00 178.15 178.77 2nxy h SER 110 N 0.80 0.99 -0.19 1.72 0.02 -1.23 -2.18 113.55 113.47 2nxy h SER 110 Ca 0.27 -0.27 0.02 0.00 -0.84 0.00 0.00 61.79 60.97 2nxy h SER 110 Cb 0.03 -0.26 -0.02 0.00 0.14 0.00 0.00 62.40 62.28 2nxy h SER 110 CO -0.11 1.01 0.05 0.25 -1.14 0.00 0.00 176.83 176.90 2nxy h LEU 111 N 0.93 0.05 -0.47 5.07 5.85 -0.84 -2.30 115.31 123.59 2nxy h LEU 111 Ca 0.18 0.02 -0.01 0.00 0.84 0.00 0.00 57.88 58.92 2nxy h LEU 111 Cb 0.46 0.02 -0.02 0.00 0.37 0.00 0.00 40.66 41.49 2nxy h LEU 111 CO 0.02 0.05 0.27 -0.50 -0.34 0.00 0.00 178.44 177.94 2nxy h TRP 112 N 0.14 0.64 -0.82 1.25 4.06 -1.14 -0.91 115.95 119.18 2nxy h TRP 112 Ca 0.09 -0.01 0.06 0.00 2.06 0.00 0.00 58.89 61.09 2nxy h TRP 112 Cb 0.07 -0.21 -0.06 0.00 -1.00 0.00 0.00 29.16 27.96 2nxy h TRP 112 CO -0.13 0.47 0.50 -0.44 -3.56 0.00 0.00 178.44 175.29 2nxy h ASP 113 N 0.63 0.78 0.44 -3.49 3.32 -1.18 0.22 116.42 117.14 2nxy h ASP 113 Ca 0.17 0.02 -0.23 0.00 0.02 0.00 0.00 57.03 57.01 2nxy h ASP 113 Cb 0.04 -0.14 0.00 0.00 0.22 0.00 0.00 39.33 39.45 2nxy h ASP 113 CO -0.03 0.50 -0.99 1.56 -1.72 0.00 0.00 179.24 178.56 2nxy h GLN 114 N 0.91 0.34 0.02 3.56 4.20 -1.26 -3.40 115.11 119.48 2nxy h GLN 114 Ca 0.36 -0.40 -0.31 0.00 0.06 0.00 0.00 58.65 58.35 2nxy h GLN 114 Cb 0.18 0.12 -0.04 0.00 0.30 0.00 0.00 27.48 28.04 2nxy h GLN 114 CO -0.18 1.10 -1.72 0.45 -0.67 0.00 0.00 178.83 177.81 2nxy n SER 115 N -3.69 1.92 -4.14 1.46 2.88 -0.36 -4.79 113.62 106.91 2nxy n SER 115 Ca -0.06 0.35 -0.38 0.00 -1.33 0.00 0.00 58.87 57.44 2nxy n SER 115 Cb 0.87 -0.89 -0.08 0.00 -0.75 0.00 0.00 64.21 63.35 2nxy n SER 115 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 2nxy s LEU 116 N -7.62 5.55 -0.24 2.46 1.43 0.75 -4.97 118.68 116.04 2nxy s LEU 116 Ca -0.31 -2.91 -0.17 0.00 -1.03 0.00 0.00 54.13 49.71 2nxy s LEU 116 Cb 0.08 -1.93 -0.03 0.00 0.03 0.00 0.00 46.19 44.34 2nxy s LEU 116 CO 0.59 -0.39 0.48 -0.54 0.23 0.00 0.00 176.35 176.73 2nxy s LYS 117 N -0.15 4.11 0.61 1.70 1.02 -1.26 -4.68 119.74 121.09 2nxy s LYS 117 Ca 0.18 0.30 -0.14 0.00 0.02 0.00 0.00 55.97 56.34 2nxy s LYS 117 Cb -0.17 -3.61 -0.03 0.00 -0.52 0.00 0.00 37.83 33.49 2nxy s LYS 117 CO -0.05 -0.24 1.04 -1.25 -0.92 0.00 0.00 175.35 173.93 2nxy s PRO 118 N 1.94 3.40 0.20 -1.68 0.04 -1.26 -4.54 135.00 133.09 2nxy s PRO 118 Ca 0.21 1.01 -0.06 0.00 0.04 0.00 0.00 61.00 62.20 2nxy s PRO 118 Cb -0.15 -2.05 0.13 0.00 0.04 0.00 0.00 34.50 32.46 2nxy s PRO 118 CO 0.09 -0.73 1.59 0.00 0.04 0.00 0.00 177.00 177.98 2nxy s VAL 120 N -4.51 0.28 -0.06 0.00 1.01 -1.15 -2.05 120.40 113.92 2nxy s VAL 120 Ca -0.09 -0.14 0.01 0.00 0.00 0.00 0.00 61.98 61.76 2nxy s VAL 120 Cb 0.12 -0.25 0.02 0.00 0.00 0.00 0.00 36.38 36.27 2nxy s VAL 120 CO 0.85 0.09 -0.09 -0.75 0.00 0.00 0.00 175.10 175.19 2nxy s LYS 121 N -0.00 1.37 -0.11 2.72 2.20 0.65 -0.49 119.74 126.07 2nxy s LYS 121 Ca 0.01 -0.28 0.03 0.00 -0.36 0.00 0.00 55.97 55.36 2nxy s LYS 121 Cb -0.02 -1.23 0.01 0.00 -1.51 0.00 0.00 37.83 35.08 2nxy s LYS 121 CO -0.00 -0.05 -0.19 -0.51 -0.36 0.00 0.00 175.35 174.24 2nxy s LEU 122 N 0.89 1.93 -0.01 5.43 1.43 0.57 -0.86 118.68 128.06 2nxy s LEU 122 Ca -0.11 -0.50 0.02 0.00 -1.03 0.00 0.00 54.13 52.51 2nxy s LEU 122 Cb -0.15 -1.25 0.00 0.00 0.03 0.00 0.00 46.19 44.82 2nxy s LEU 122 CO 0.01 0.08 -0.06 0.42 0.23 0.00 0.00 176.35 177.03 2nxy s THR 123 N 0.72 0.47 0.84 5.49 -4.23 -0.60 -0.59 115.64 117.76 2nxy s THR 123 Ca -0.11 -0.22 -0.11 0.00 -1.18 0.00 0.00 61.69 60.07 2nxy s THR 123 Cb -0.16 -0.42 0.10 0.00 1.34 0.00 0.00 72.50 73.36 2nxy s THR 123 CO 0.02 0.15 1.10 -2.16 -0.54 0.00 0.00 174.62 173.18 2nxy s PRO 124 N 0.07 1.66 -0.45 3.99 0.04 -1.26 -0.37 135.00 138.68 2nxy s PRO 124 Ca -0.00 1.09 0.07 0.00 0.04 0.00 0.00 61.00 62.19 2nxy s PRO 124 Cb -0.05 -1.83 0.19 0.00 0.04 0.00 0.00 34.50 32.84 2nxy s PRO 124 CO -0.00 -2.04 0.70 -1.17 0.04 0.00 0.00 177.00 174.53 2nxy s LEU 125 N -6.15 -1.43 -0.47 -3.56 2.96 -1.25 -4.71 118.68 104.07 2nxy s LEU 125 Ca 0.63 -1.16 0.03 0.00 -0.22 0.00 0.00 54.13 53.40 2nxy s LEU 125 Cb -0.18 1.85 0.45 0.00 0.50 0.00 0.00 46.19 48.81 2nxy s LEU 125 CO 0.57 -0.11 1.59 0.00 -1.32 0.00 0.00 176.35 177.08 2nxy h VAL 127 N 1.64 0.80 -3.75 0.00 3.04 -1.96 -3.45 116.25 112.57 2nxy h VAL 127 Ca 0.48 -0.99 -0.43 0.00 -1.01 0.00 0.00 66.70 64.75 2nxy h VAL 127 Cb 1.18 1.60 0.17 0.00 -2.01 0.00 0.00 31.29 32.24 2nxy h VAL 127 CO 1.16 0.24 0.22 -0.83 -1.01 0.00 0.00 177.57 177.34 2nxy s GLY 128 N -4.27 1.62 -0.62 3.17 0.00 -1.26 -4.98 107.32 100.98 2nxy s GLY 128 Ca -0.02 -0.87 -0.19 0.00 0.00 0.00 0.00 44.72 43.64 2nxy s GLY 128 CO 0.65 -0.08 0.75 0.00 0.00 0.00 0.00 173.10 174.41 2nxy s ALA 129 N -3.21 3.40 -1.09 3.20 0.00 -1.26 -4.34 121.76 118.46 2nxy s ALA 129 Ca 0.70 -2.24 -0.03 0.00 0.00 0.00 0.00 51.96 50.39 2nxy s ALA 129 Cb -0.10 -3.58 0.00 0.00 0.00 0.00 0.00 23.12 19.44 2nxy s ALA 129 CO 0.55 -2.42 0.44 0.41 0.00 0.00 0.00 175.76 174.74 2nxy n GLY 194 N 5.26 -0.16 3.05 0.00 0.00 -1.26 -5.00 105.19 107.08 2nxy n GLY 194 Ca -0.07 -0.14 -0.02 0.00 0.00 0.00 0.00 46.02 45.79 2nxy n GLY 194 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2nxy s SER 195 N -2.80 -0.68 0.15 1.61 0.15 -1.26 -5.16 113.70 105.70 2nxy s SER 195 Ca 0.22 0.53 -0.06 0.00 0.70 0.00 0.00 55.95 57.33 2nxy s SER 195 Cb -0.10 1.70 -0.06 0.00 -1.71 0.00 0.00 66.02 65.86 2nxy s SER 195 CO 0.27 -0.28 0.40 0.00 1.20 0.00 0.00 173.24 174.82 2nxy n ASN 197 N 0.15 0.27 -4.68 0.00 2.85 -0.44 -5.00 115.26 108.42 2nxy n ASN 197 Ca -0.03 -2.57 -0.48 0.00 -0.11 0.00 0.00 54.58 51.39 2nxy n ASN 197 Cb 0.52 -0.60 -0.05 0.00 1.24 0.00 0.00 39.78 40.89 2nxy n ASN 197 CO 0.00 0.00 0.00 0.41 -2.11 0.00 0.00 177.26 175.56 2nxy n THR 198 N 2.51 0.38 -2.79 -0.44 -1.04 -1.26 -3.86 114.28 107.79 2nxy n THR 198 Ca 0.27 -0.07 -0.42 0.00 -2.04 0.00 0.00 64.05 61.80 2nxy n THR 198 Cb 0.46 -1.72 -0.03 0.00 -1.82 0.00 0.00 70.33 67.22 2nxy n THR 198 CO 0.00 0.00 0.00 -0.55 -0.64 0.00 0.00 175.07 173.88 2nxy s SER 199 N 3.02 7.10 -0.18 8.00 0.15 0.50 -4.93 113.70 127.37 2nxy s SER 199 Ca 0.89 1.35 0.01 0.00 0.70 0.00 0.00 55.95 58.89 2nxy s SER 199 Cb -0.71 -2.50 0.01 0.00 -1.71 0.00 0.00 66.02 61.11 2nxy s SER 199 CO 0.48 -0.43 -0.18 -0.69 1.20 0.00 0.00 173.24 173.62 2nxy s VAL 200 N 2.11 2.25 -0.14 4.45 1.01 -1.26 -1.56 120.40 127.26 2nxy s VAL 200 Ca 0.43 -0.88 0.01 0.00 0.00 0.00 0.00 61.98 61.53 2nxy s VAL 200 Cb -0.17 -1.95 -0.00 0.00 0.00 0.00 0.00 36.38 34.26 2nxy s VAL 200 CO 0.15 0.53 -0.16 -0.63 0.00 0.00 0.00 175.10 174.98 2nxy s ILE 201 N 1.19 2.63 -0.14 2.22 1.01 -0.04 -4.97 121.20 123.10 2nxy s ILE 201 Ca 0.02 -0.79 0.01 0.00 0.00 0.00 0.00 60.65 59.89 2nxy s ILE 201 Cb -0.14 -2.10 -0.01 0.00 0.01 0.00 0.00 42.46 40.23 2nxy s ILE 201 CO -0.09 0.52 -0.16 -0.89 0.00 0.00 0.00 174.94 174.33 2nxy s THR 202 N 0.68 2.70 0.20 2.92 2.01 -1.26 -0.26 115.64 122.63 2nxy s THR 202 Ca -0.08 -0.77 -0.10 0.00 0.31 0.00 0.00 61.69 61.05 2nxy s THR 202 Cb -0.16 -2.13 -0.01 0.00 0.01 0.00 0.00 72.50 70.22 2nxy s THR 202 CO 0.02 0.52 0.34 0.00 -0.69 0.00 0.00 174.62 174.81 2nxy s GLN 203 N 0.64 1.31 0.33 4.92 -2.07 -0.87 -5.02 119.66 118.90 2nxy s GLN 203 Ca -0.08 -1.25 -0.29 0.00 -1.82 0.00 0.00 55.36 51.92 2nxy s GLN 203 Cb -0.16 0.40 -0.11 0.00 -1.09 0.00 0.00 33.01 32.05 2nxy s GLN 203 CO 0.03 -0.50 1.52 0.00 -1.32 0.00 0.00 175.29 175.01 2nxy s ALA 204 N -4.01 3.65 -0.51 2.60 0.00 -1.26 -4.44 121.76 117.79 2nxy s ALA 204 Ca 0.22 1.54 0.07 0.00 0.00 0.00 0.00 51.96 53.78 2nxy s ALA 204 Cb 0.02 -3.61 0.24 0.00 0.00 0.00 0.00 23.12 19.77 2nxy s ALA 204 CO 0.05 -0.98 0.60 0.00 0.00 0.00 0.00 175.76 175.43 2nxy s PRO 206 N -1.64 3.94 -0.01 0.00 0.04 -1.26 -4.75 135.00 131.31 2nxy s PRO 206 Ca 0.36 2.03 -0.30 0.00 0.04 0.00 0.00 61.00 63.13 2nxy s PRO 206 Cb 0.14 -2.68 -0.05 0.00 0.04 0.00 0.00 34.50 31.95 2nxy s PRO 206 CO -0.08 -0.47 1.38 0.15 0.04 0.00 0.00 177.00 178.01 2nxy s LYS 207 N -2.32 4.29 -0.05 4.56 -0.14 -1.26 -4.85 119.74 119.97 2nxy s LYS 207 Ca 0.58 1.92 0.01 0.00 -1.36 0.00 0.00 55.97 57.12 2nxy s LYS 207 Cb -0.35 -3.58 0.02 0.00 -1.68 0.00 0.00 37.83 32.24 2nxy s LYS 207 CO 0.44 -0.57 -0.05 0.54 -0.76 0.00 0.00 175.35 174.95 2nxy s VAL 208 N 2.43 0.63 -0.43 3.17 0.11 -1.26 -5.10 120.40 119.95 2nxy s VAL 208 Ca 0.63 -0.16 -0.28 0.00 -2.93 0.00 0.00 61.98 59.23 2nxy s VAL 208 Cb -0.30 -0.65 -0.01 0.00 -1.53 0.00 0.00 36.38 33.89 2nxy s VAL 208 CO 0.26 0.25 1.64 -0.44 -3.33 0.00 0.00 175.10 173.48 2nxy s SER 209 N 0.99 5.95 0.02 3.54 0.01 -1.26 -4.13 113.70 118.82 2nxy s SER 209 Ca -0.10 0.86 -0.27 0.00 1.31 0.00 0.00 55.95 57.76 2nxy s SER 209 Cb -0.14 -2.53 -0.04 0.00 0.21 0.00 0.00 66.02 63.51 2nxy s SER 209 CO -0.00 -1.74 0.84 0.12 0.41 0.00 0.00 173.24 172.86 2nxy s PHE 210 N 6.72 3.69 -0.33 2.43 5.36 -1.26 -4.86 117.98 129.73 2nxy s PHE 210 Ca 0.69 1.53 0.02 0.00 -0.96 0.00 0.00 56.93 58.21 2nxy s PHE 210 Cb -0.17 -2.93 0.15 0.00 -0.34 0.00 0.00 43.02 39.74 2nxy s PHE 210 CO 0.30 0.14 0.38 -2.00 -1.46 0.00 0.00 175.22 172.59 2nxy s GLU 211 N 0.44 0.50 0.23 10.12 2.56 -1.26 -4.29 118.70 127.00 2nxy s GLU 211 Ca 0.43 -0.33 -0.31 0.00 0.00 0.00 0.00 54.97 54.77 2nxy s GLU 211 Cb -0.20 -0.51 -0.14 0.00 2.00 0.00 0.00 34.13 35.27 2nxy s GLU 211 CO 0.24 -1.10 1.18 -2.30 -0.56 0.00 0.00 175.26 172.72 2nxy n PRO 212 N 4.88 1.48 -4.78 4.30 -0.02 -1.26 -4.99 135.00 134.60 2nxy n PRO 212 Ca 0.05 0.52 -0.33 0.00 -2.02 0.00 0.00 63.50 61.72 2nxy n PRO 212 Cb 0.48 -2.03 -0.13 0.00 -0.02 0.00 0.00 33.50 31.80 2nxy n PRO 212 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 2nxy s ILE 213 N -0.46 3.25 0.31 4.25 -1.09 -1.26 -4.95 121.20 121.24 2nxy s ILE 213 Ca 0.67 -0.64 -0.29 0.00 -2.23 0.00 0.00 60.65 58.16 2nxy s ILE 213 Cb -0.74 -2.31 -0.12 0.00 -1.58 0.00 0.00 42.46 37.70 2nxy s ILE 213 CO 0.54 0.57 1.44 -2.65 -1.23 0.00 0.00 174.94 173.61 2nxy n PRO 214 N 2.62 2.35 -4.67 2.79 -0.02 -1.26 -4.48 135.00 132.34 2nxy n PRO 214 Ca -0.18 0.83 -0.33 0.00 -2.02 0.00 0.00 63.50 61.80 2nxy n PRO 214 Cb 0.52 -2.51 -0.13 0.00 -0.02 0.00 0.00 33.50 31.36 2nxy n PRO 214 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 2nxy s ILE 215 N -0.53 3.40 -0.20 4.25 1.01 0.14 -4.77 121.20 124.50 2nxy s ILE 215 Ca 0.61 -0.56 -0.05 0.00 0.00 0.00 0.00 60.65 60.65 2nxy s ILE 215 Cb -0.55 -2.42 -0.02 0.00 0.01 0.00 0.00 42.46 39.47 2nxy s ILE 215 CO 0.55 0.54 -0.01 -1.00 0.00 0.00 0.00 174.94 175.03 2nxy s HIS 216 N -0.03 3.03 -0.28 3.97 3.76 -1.26 -0.43 115.29 124.04 2nxy s HIS 216 Ca -0.02 -0.52 -0.15 0.00 -0.15 0.00 0.00 55.06 54.22 2nxy s HIS 216 Cb -0.14 -2.09 -0.03 0.00 1.11 0.00 0.00 32.58 31.43 2nxy s HIS 216 CO 0.03 -0.28 0.39 0.71 -0.85 0.00 0.00 174.74 174.74 2nxy s TYR 217 N 1.07 3.24 0.44 1.40 1.51 -1.26 -4.90 117.35 118.85 2nxy s TYR 217 Ca 0.02 0.36 0.08 0.00 -1.01 0.00 0.00 57.07 56.52 2nxy s TYR 217 Cb -0.14 -2.61 -0.00 0.00 -0.11 0.00 0.00 41.96 39.10 2nxy s TYR 217 CO 0.01 -0.27 0.44 0.00 -1.11 0.00 0.00 175.55 174.63 2nxy s ALA 219 N -2.50 3.89 0.52 0.00 0.00 -1.17 -4.98 121.76 117.52 2nxy s ALA 219 Ca 0.49 1.56 -0.20 0.00 0.00 0.00 0.00 51.96 53.81 2nxy s ALA 219 Cb -0.04 -3.72 -0.07 0.00 0.00 0.00 0.00 23.12 19.29 2nxy s ALA 219 CO 0.29 -1.03 1.08 -2.14 0.00 0.00 0.00 175.76 173.96 2nxy s PRO 220 N 1.70 3.56 -0.28 0.00 0.02 -1.26 -4.91 135.00 133.84 2nxy s PRO 220 Ca 0.77 1.46 -0.41 0.00 0.02 0.00 0.00 61.00 62.84 2nxy s PRO 220 Cb -0.49 -2.05 -0.17 0.00 0.02 0.00 0.00 34.50 31.81 2nxy s PRO 220 CO 0.34 -0.65 1.64 0.00 -0.33 0.00 0.00 177.00 177.99 2nxy n ALA 221 N -1.20 -0.71 -0.42 -1.55 0.00 -1.26 -1.02 120.51 114.34 2nxy n ALA 221 Ca 0.10 0.44 0.00 0.00 0.00 0.00 0.00 53.44 53.98 2nxy n ALA 221 Cb 0.52 -2.12 0.00 0.00 0.00 0.00 0.00 19.45 17.85 2nxy n ALA 221 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2nxy n GLY 222 N 3.84 0.74 3.45 0.00 0.00 -1.26 -5.05 105.19 106.91 2nxy n GLY 222 Ca 0.26 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 46.07 2nxy n GLY 222 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2nxy s PHE 223 N -2.54 1.97 0.07 1.61 0.40 -0.19 -1.98 117.98 117.30 2nxy s PHE 223 Ca 0.00 -0.94 0.03 0.00 -0.60 0.00 0.00 56.93 55.42 2nxy s PHE 223 Cb 0.00 -1.28 -0.03 0.00 0.51 0.00 0.00 43.02 42.22 2nxy s PHE 223 CO 0.00 0.03 -0.09 0.00 0.70 0.00 0.00 175.22 175.86 2nxy s ALA 224 N -3.28 0.80 -0.22 5.36 0.00 0.12 -4.58 121.76 119.96 2nxy s ALA 224 Ca 0.36 -0.97 -0.10 0.00 0.00 0.00 0.00 51.96 51.25 2nxy s ALA 224 Cb 0.08 0.05 -0.05 0.00 0.00 0.00 0.00 23.12 23.21 2nxy s ALA 224 CO 0.15 -0.05 0.13 0.42 0.00 0.00 0.00 175.76 176.42 2nxy s ILE 225 N -1.99 5.18 0.02 0.00 1.01 -1.26 -0.93 121.20 123.23 2nxy s ILE 225 Ca -0.02 0.11 0.01 0.00 0.00 0.00 0.00 60.65 60.75 2nxy s ILE 225 Cb -0.06 -3.39 -0.04 0.00 0.01 0.00 0.00 42.46 38.98 2nxy s ILE 225 CO -0.00 0.38 0.04 -0.76 0.00 0.00 0.00 174.94 174.60 2nxy s LEU 226 N 0.85 3.70 -0.07 2.97 1.43 0.28 -1.87 118.68 125.98 2nxy s LEU 226 Ca 0.07 0.04 0.01 0.00 -1.03 0.00 0.00 54.13 53.21 2nxy s LEU 226 Cb -0.13 -2.20 0.02 0.00 0.03 0.00 0.00 46.19 43.90 2nxy s LEU 226 CO 0.03 0.25 -0.08 -0.75 0.23 0.00 0.00 176.35 176.03 2nxy s LYS 227 N -1.82 1.27 -0.16 1.70 2.20 0.69 -1.44 119.74 122.17 2nxy s LYS 227 Ca 0.23 -0.23 -0.29 0.00 -0.36 0.00 0.00 55.97 55.31 2nxy s LYS 227 Cb -0.12 -1.20 -0.00 0.00 -1.51 0.00 0.00 37.83 35.00 2nxy s LYS 227 CO 0.14 -0.09 1.03 0.00 -0.36 0.00 0.00 175.35 176.07 2nxy n ASN 229 N 5.62 0.72 -4.62 0.00 3.02 0.77 -4.87 115.26 115.89 2nxy n ASN 229 Ca 0.10 -0.51 -0.43 0.00 -0.03 0.00 0.00 54.58 53.71 2nxy n ASN 229 Cb 0.47 0.29 -0.03 0.00 -0.61 0.00 0.00 39.78 39.91 2nxy n ASN 229 CO 0.00 0.00 0.00 0.21 -2.62 0.00 0.00 177.26 174.85 2nxy s ASN 230 N -2.86 5.88 0.46 6.41 3.84 -1.26 -4.87 114.94 122.55 2nxy s ASN 230 Ca 0.14 2.12 0.32 0.00 0.21 0.00 0.00 52.86 55.65 2nxy s ASN 230 Cb 0.18 -2.52 1.59 0.00 -0.55 0.00 0.00 41.25 39.95 2nxy s ASN 230 CO 0.66 -1.59 1.96 0.11 -2.79 0.00 0.00 177.10 175.46 2nxy h LYS 231 N 13.13 0.00 0.00 0.43 1.57 -1.98 -2.75 116.57 126.97 2nxy h LYS 231 Ca -0.43 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.35 2nxy h LYS 231 Cb 1.23 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.54 2nxy h LYS 231 CO 0.96 0.00 -0.00 2.41 -0.57 0.00 0.00 179.45 182.25 2nxy n THR 232 N -2.67 1.26 -1.58 -0.16 -1.04 -1.26 -4.46 114.28 104.37 2nxy n THR 232 Ca -0.01 -1.37 -0.50 0.00 -2.04 0.00 0.00 64.05 60.12 2nxy n THR 232 Cb 0.13 0.28 -0.05 0.00 -1.82 0.00 0.00 70.33 68.87 2nxy n THR 232 CO 0.00 0.00 0.00 0.33 -0.64 0.00 0.00 175.07 174.76 2nxy n PHE 233 N -0.78 1.38 1.53 -1.42 7.35 -1.04 -4.88 117.46 119.60 2nxy n PHE 233 Ca 0.05 0.67 0.15 0.00 -0.76 0.00 0.00 57.45 57.55 2nxy n PHE 233 Cb 0.37 -2.30 0.70 0.00 0.35 0.00 0.00 39.48 38.60 2nxy n PHE 233 CO 0.00 0.00 0.00 0.27 -0.76 0.00 0.00 176.76 176.27 2nxy n ASN 234 N 2.24 0.37 0.00 -2.13 0.23 -1.26 -4.92 115.26 109.78 2nxy n ASN 234 Ca 0.17 -0.64 0.00 0.00 -0.53 0.00 0.00 54.58 53.58 2nxy n ASN 234 Cb 0.22 -0.10 0.00 0.00 -2.08 0.00 0.00 39.78 37.82 2nxy n ASN 234 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2nxy n GLY 235 N 1.22 1.06 2.54 4.83 0.00 -1.26 -4.83 105.19 108.76 2nxy n GLY 235 Ca 0.17 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.90 2nxy n GLY 235 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2nxy s THR 236 N -2.43 -0.07 -5.00 2.61 2.01 -1.26 -1.03 115.64 110.47 2nxy s THR 236 Ca 0.00 -0.75 0.00 0.00 0.31 0.00 0.00 61.69 61.25 2nxy s THR 236 Cb 0.00 -0.98 0.00 0.00 0.01 0.00 0.00 72.50 71.53 2nxy s THR 236 CO 0.00 -0.72 0.00 0.61 -0.69 0.00 0.00 174.62 173.82 2nxy n GLY 237 N 5.25 0.21 3.74 4.40 0.00 -0.39 -4.99 105.19 113.42 2nxy n GLY 237 Ca -0.06 -1.67 -0.41 0.00 0.00 0.00 0.00 46.02 43.88 2nxy n GLY 237 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2nxy s PRO 238 N -2.00 4.53 -0.21 1.61 0.04 -1.26 -0.83 135.00 136.88 2nxy s PRO 238 Ca 0.00 1.82 -0.02 0.00 0.04 0.00 0.00 61.00 62.84 2nxy s PRO 238 Cb 0.00 -3.25 0.00 0.00 0.04 0.00 0.00 34.50 31.29 2nxy s PRO 238 CO 0.00 -0.01 -0.09 0.00 0.04 0.00 0.00 177.00 176.93 2nxy n THR 240 N 4.72 0.28 -3.88 0.00 -2.24 -1.26 -2.10 114.28 109.81 2nxy n THR 240 Ca -0.19 -0.23 -0.33 0.00 -2.27 0.00 0.00 64.05 61.04 2nxy n THR 240 Cb 0.51 -0.06 -0.13 0.00 -2.10 0.00 0.00 70.33 68.55 2nxy n THR 240 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 2nxy s ASN 241 N -4.00 4.76 -0.04 3.42 3.84 -1.26 -4.57 114.94 117.10 2nxy s ASN 241 Ca 0.07 -2.70 0.05 0.00 0.21 0.00 0.00 52.86 50.49 2nxy s ASN 241 Cb 0.14 -1.72 -0.02 0.00 -0.55 0.00 0.00 41.25 39.10 2nxy s ASN 241 CO 0.72 -0.33 -0.18 -0.69 -2.79 0.00 0.00 177.10 173.83 2nxy s VAL 242 N 0.16 2.77 0.27 -5.21 1.01 -1.26 -0.16 120.40 117.98 2nxy s VAL 242 Ca 0.15 -0.85 0.12 0.00 0.00 0.00 0.00 61.98 61.40 2nxy s VAL 242 Cb -0.23 -2.06 -0.05 0.00 0.00 0.00 0.00 36.38 34.04 2nxy s VAL 242 CO -0.03 0.58 -0.20 -0.44 0.00 0.00 0.00 175.10 175.00 2nxy s SER 243 N -0.73 3.58 -0.18 3.32 0.01 0.24 -0.55 113.70 119.38 2nxy s SER 243 Ca 0.11 -1.01 -0.07 0.00 1.31 0.00 0.00 55.95 56.29 2nxy s SER 243 Cb -0.10 -0.30 -0.04 0.00 0.21 0.00 0.00 66.02 65.79 2nxy s SER 243 CO 0.00 0.05 0.06 -0.89 0.41 0.00 0.00 173.24 172.87 2nxy s THR 244 N -2.43 4.76 0.14 1.44 2.01 -0.51 -0.23 115.64 120.83 2nxy s THR 244 Ca 0.29 -0.04 0.10 0.00 0.31 0.00 0.00 61.69 62.34 2nxy s THR 244 Cb -0.05 -3.14 -0.04 0.00 0.01 0.00 0.00 72.50 69.27 2nxy s THR 244 CO 0.15 0.46 -0.23 0.68 -0.69 0.00 0.00 174.62 174.99 2nxy s VAL 245 N 0.35 1.99 0.06 3.82 -7.23 -0.78 -1.93 120.40 116.69 2nxy s VAL 245 Ca 0.03 -1.75 -0.18 0.00 -1.81 0.00 0.00 61.98 58.27 2nxy s VAL 245 Cb -0.12 -1.82 -0.13 0.00 0.56 0.00 0.00 36.38 34.86 2nxy s VAL 245 CO 0.00 -0.07 1.34 1.56 -0.31 0.00 0.00 175.10 177.62 2nxy h GLN 246 N 3.74 0.53 -4.18 4.82 4.20 -1.96 -3.36 115.11 118.89 2nxy h GLN 246 Ca -0.47 -0.32 -0.14 0.00 0.06 0.00 0.00 58.65 57.78 2nxy h GLN 246 Cb 1.19 0.03 -0.14 0.00 0.30 0.00 0.00 27.48 28.85 2nxy h GLN 246 CO 0.43 0.92 -0.55 0.00 -0.67 0.00 0.00 178.83 178.96 2nxy s THR 248 N -3.98 2.23 1.03 0.00 -4.23 0.09 -4.96 115.64 105.82 2nxy s THR 248 Ca 0.16 0.07 -0.12 0.00 -1.18 0.00 0.00 61.69 60.63 2nxy s THR 248 Cb 0.06 -2.73 0.21 0.00 1.34 0.00 0.00 72.50 71.38 2nxy s THR 248 CO -0.03 -0.10 1.07 -1.38 -0.54 0.00 0.00 174.62 173.65 2nxy s HIS 249 N -3.14 1.83 -0.24 3.99 -3.43 -1.26 -4.52 115.29 108.51 2nxy s HIS 249 Ca 0.64 1.20 -0.29 0.00 -0.80 0.00 0.00 55.06 55.80 2nxy s HIS 249 Cb -0.16 -3.18 -0.01 0.00 -1.43 0.00 0.00 32.58 27.79 2nxy s HIS 249 CO 0.55 -3.14 1.44 0.20 -2.00 0.00 0.00 174.74 171.79 2nxy s GLY 250 N -3.03 1.35 -0.23 -1.38 0.00 -1.26 -4.55 107.32 98.23 2nxy s GLY 250 Ca 0.66 0.32 -0.07 0.00 0.00 0.00 0.00 44.72 45.63 2nxy s GLY 250 CO 0.60 2.76 0.07 -0.42 0.00 0.00 0.00 173.10 176.11 2nxy s ILE 251 N 4.59 4.46 -0.27 0.90 1.01 0.43 -4.73 121.20 127.59 2nxy s ILE 251 Ca 0.63 -0.13 -0.23 0.00 0.00 0.00 0.00 60.65 60.92 2nxy s ILE 251 Cb -0.21 -3.06 -0.01 0.00 0.01 0.00 0.00 42.46 39.19 2nxy s ILE 251 CO 0.25 0.38 0.76 -0.13 0.00 0.00 0.00 174.94 176.20 2nxy s ARG 252 N 1.20 4.09 -1.48 2.79 0.52 -1.26 0.27 118.95 125.08 2nxy s ARG 252 Ca 0.05 0.73 -0.13 0.00 -0.52 0.00 0.00 55.73 55.85 2nxy s ARG 252 Cb -0.14 -3.67 0.01 0.00 0.52 0.00 0.00 34.95 31.66 2nxy s ARG 252 CO 0.03 -0.54 2.39 -0.35 0.02 0.00 0.00 175.30 176.85 2nxy n PRO 253 N 5.99 3.01 -2.43 3.54 -0.04 -1.26 -4.94 135.00 138.86 2nxy n PRO 253 Ca 0.03 -2.48 -0.43 0.00 -0.04 0.00 0.00 63.50 60.58 2nxy n PRO 253 Cb 0.48 -3.16 -0.02 0.00 -0.04 0.00 0.00 33.50 30.75 2nxy n PRO 253 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 2nxy s VAL 254 N 3.01 4.24 -0.35 0.52 1.01 -1.26 -4.98 120.40 122.58 2nxy s VAL 254 Ca 0.52 1.53 -0.20 0.00 0.00 0.00 0.00 61.98 63.84 2nxy s VAL 254 Cb 0.15 -3.99 0.00 0.00 0.00 0.00 0.00 36.38 32.54 2nxy s VAL 254 CO -0.08 -0.07 0.61 -0.69 0.00 0.00 0.00 175.10 174.87 2nxy s VAL 255 N 2.91 4.92 0.20 2.92 1.01 -1.26 -4.95 120.40 126.14 2nxy s VAL 255 Ca 0.56 0.53 -0.20 0.00 0.00 0.00 0.00 61.98 62.87 2nxy s VAL 255 Cb -0.23 -4.05 0.04 0.00 0.00 0.00 0.00 36.38 32.13 2nxy s VAL 255 CO 0.18 -0.29 0.59 -0.94 0.00 0.00 0.00 175.10 174.63 2nxy s SER 256 N 1.78 -0.36 0.29 3.32 1.04 -1.26 -4.17 113.70 114.34 2nxy s SER 256 Ca 0.23 -0.35 0.10 0.00 0.48 0.00 0.00 55.95 56.42 2nxy s SER 256 Cb -0.15 0.61 -0.05 0.00 0.10 0.00 0.00 66.02 66.54 2nxy s SER 256 CO 0.14 -1.08 -0.09 0.42 0.98 0.00 0.00 173.24 173.61 2nxy s THR 257 N -3.84 2.86 0.00 2.02 -4.23 -0.40 -4.68 115.64 107.37 2nxy s THR 257 Ca 0.07 -2.14 0.00 0.00 -1.18 0.00 0.00 61.69 58.43 2nxy s THR 257 Cb -0.02 -2.60 0.00 0.00 1.34 0.00 0.00 72.50 71.22 2nxy s THR 257 CO -0.04 -0.35 0.00 0.00 -0.54 0.00 0.00 174.62 173.68 2nxy n GLN 258 N -0.78 0.00 -4.61 3.99 6.02 0.23 -4.03 117.38 118.20 2nxy n GLN 258 Ca -0.05 0.00 -0.34 0.00 -0.01 0.00 0.00 57.00 56.60 2nxy n GLN 258 Cb 0.60 0.00 -0.12 0.00 1.02 0.00 0.00 30.24 31.74 2nxy n GLN 258 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 2nxy s LEU 259 N 0.00 3.11 -0.16 1.08 1.43 -1.26 -1.05 118.68 121.83 2nxy s LEU 259 Ca 0.00 -0.09 -0.17 0.00 -1.03 0.00 0.00 54.13 52.84 2nxy s LEU 259 Cb 0.00 -1.69 -0.04 0.00 0.03 0.00 0.00 46.19 44.49 2nxy s LEU 259 CO 0.00 0.29 0.44 -0.76 0.23 0.00 0.00 176.35 176.55 2nxy s LEU 260 N -0.40 4.22 0.02 1.79 1.43 0.02 -4.84 118.68 120.93 2nxy s LEU 260 Ca 0.06 0.67 0.07 0.00 -1.03 0.00 0.00 54.13 53.90 2nxy s LEU 260 Cb -0.12 -2.61 -0.03 0.00 0.03 0.00 0.00 46.19 43.46 2nxy s LEU 260 CO 0.02 -0.03 -0.21 -0.76 0.23 0.00 0.00 176.35 175.60 2nxy s LEU 261 N 0.94 2.41 -1.88 1.79 1.43 -1.26 -1.02 118.68 121.09 2nxy s LEU 261 Ca 0.23 -0.45 0.00 0.00 -1.03 0.00 0.00 54.13 52.87 2nxy s LEU 261 Cb -0.15 -1.43 0.00 0.00 0.03 0.00 0.00 46.19 44.65 2nxy s LEU 261 CO 0.09 0.28 0.00 0.59 0.23 0.00 0.00 176.35 177.53 2nxy n ASN 262 N 1.84 -5.83 -0.07 2.29 3.02 0.19 -4.80 115.26 111.89 2nxy n ASN 262 Ca -0.16 0.10 0.00 0.00 -0.03 0.00 0.00 54.58 54.49 2nxy n ASN 262 Cb 0.52 -4.92 0.00 0.00 -0.61 0.00 0.00 39.78 34.77 2nxy n ASN 262 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2nxy n GLY 263 N -0.88 1.85 3.85 7.41 0.00 -1.26 -4.74 105.19 111.42 2nxy n GLY 263 Ca -0.24 -2.02 -0.36 0.00 0.00 0.00 0.00 46.02 43.40 2nxy n GLY 263 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2nxy s SER 264 N -1.00 6.76 0.20 1.61 0.01 -1.26 -4.93 113.70 115.09 2nxy s SER 264 Ca 0.00 0.93 -0.09 0.00 1.31 0.00 0.00 55.95 58.10 2nxy s SER 264 Cb 0.00 -2.23 -0.07 0.00 0.21 0.00 0.00 66.02 63.93 2nxy s SER 264 CO 0.00 0.24 0.50 -0.76 0.41 0.00 0.00 173.24 173.63 2nxy s LEU 265 N -1.48 4.21 0.38 2.44 1.43 -1.26 -4.80 118.68 119.59 2nxy s LEU 265 Ca 0.29 0.84 -0.28 0.00 -1.03 0.00 0.00 54.13 53.95 2nxy s LEU 265 Cb -0.16 -3.54 -0.10 0.00 0.03 0.00 0.00 46.19 42.42 2nxy s LEU 265 CO 0.16 -0.02 1.43 0.00 0.23 0.00 0.00 176.35 178.14 2nxy s ALA 266 N -1.75 3.49 0.06 4.21 0.00 0.70 -4.94 121.76 123.54 2nxy s ALA 266 Ca 0.45 1.47 0.10 0.00 0.00 0.00 0.00 51.96 53.98 2nxy s ALA 266 Cb -0.12 -3.57 -0.04 0.00 0.00 0.00 0.00 23.12 19.39 2nxy s ALA 266 CO 0.22 -0.97 1.38 0.93 0.00 0.00 0.00 175.76 177.31 2nxy h GLU 267 N 2.97 0.00 0.00 0.00 5.08 -1.89 -3.40 114.58 117.35 2nxy h GLU 267 Ca -0.50 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.86 2nxy h GLU 267 Cb 1.24 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.49 2nxy h GLU 267 CO 0.64 0.80 0.00 0.39 -1.00 0.00 0.00 179.01 179.84 2nxy n GLU 268 N -3.36 0.00 -2.52 2.33 1.02 -1.26 -5.11 120.64 111.73 2nxy n GLU 268 Ca 0.00 0.00 -0.25 0.00 -0.02 0.00 0.00 57.16 56.89 2nxy n GLU 268 Cb 0.83 0.00 0.03 0.00 -0.02 0.00 0.00 31.44 32.29 2nxy n GLU 268 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 2nxy s GLU 269 N 2.12 2.82 0.37 3.49 2.02 -1.26 -4.79 118.70 123.46 2nxy s GLU 269 Ca 0.00 -0.22 -0.27 0.00 0.02 0.00 0.00 54.97 54.50 2nxy s GLU 269 Cb 0.00 -2.34 -0.12 0.00 0.10 0.00 0.00 34.13 31.77 2nxy s GLU 269 CO 0.00 -0.68 1.19 0.28 0.02 0.00 0.00 175.26 176.07 2nxy n VAL 270 N -2.49 2.21 -4.97 2.63 0.31 -1.26 -4.74 118.33 110.01 2nxy n VAL 270 Ca 0.05 -0.50 -0.27 0.00 -0.01 0.00 0.00 64.34 63.61 2nxy n VAL 270 Cb 0.58 -1.40 -0.16 0.00 -0.91 0.00 0.00 33.84 31.95 2nxy n VAL 270 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 2nxy s VAL 271 N -1.15 1.59 0.01 2.52 1.01 -0.75 -5.00 120.40 118.64 2nxy s VAL 271 Ca 0.59 -0.84 0.07 0.00 0.00 0.00 0.00 61.98 61.80 2nxy s VAL 271 Cb -0.57 -1.34 -0.03 0.00 0.00 0.00 0.00 36.38 34.44 2nxy s VAL 271 CO 0.60 0.45 -0.20 0.27 0.00 0.00 0.00 175.10 176.22 2nxy s ILE 272 N -0.29 2.58 -0.00 2.22 -4.36 -1.26 -0.49 121.20 119.60 2nxy s ILE 272 Ca 0.03 -1.12 0.02 0.00 -0.26 0.00 0.00 60.65 59.32 2nxy s ILE 272 Cb -0.10 -2.02 -0.00 0.00 1.25 0.00 0.00 42.46 41.59 2nxy s ILE 272 CO 0.01 0.44 -0.05 -0.13 0.24 0.00 0.00 174.94 175.45 2nxy s ARG 273 N -1.10 0.41 0.01 0.37 0.52 0.40 -4.97 118.95 114.59 2nxy s ARG 273 Ca 0.13 -0.21 -0.20 0.00 -0.52 0.00 0.00 55.73 54.93 2nxy s ARG 273 Cb -0.10 -0.38 0.04 0.00 0.52 0.00 0.00 34.95 35.03 2nxy s ARG 273 CO 0.02 0.10 0.44 0.45 0.02 0.00 0.00 175.30 176.34 2nxy s SER 274 N -0.20 -0.34 0.49 0.23 0.15 -1.26 -0.34 113.70 112.44 2nxy s SER 274 Ca 0.01 0.16 0.28 0.00 0.70 0.00 0.00 55.95 57.10 2nxy s SER 274 Cb -0.02 0.42 0.87 0.00 -1.71 0.00 0.00 66.02 65.57 2nxy s SER 274 CO -0.00 -0.61 1.80 1.62 1.20 0.00 0.00 173.24 177.25 2nxy h VAL 275 N 3.20 0.07 -0.58 4.45 3.04 -1.94 -3.41 116.25 121.07 2nxy h VAL 275 Ca -0.30 -0.81 0.09 0.00 -1.01 0.00 0.00 66.70 64.66 2nxy h VAL 275 Cb 1.19 1.76 -0.19 0.00 -2.01 0.00 0.00 31.29 32.04 2nxy h VAL 275 CO 0.42 0.03 -0.22 0.21 -1.01 0.00 0.00 177.57 176.99 2nxy s ASN 276 N -5.97 -0.92 0.50 3.17 3.84 -1.26 -5.04 114.94 109.26 2nxy s ASN 276 Ca 0.04 -0.18 0.14 0.00 0.21 0.00 0.00 52.86 53.07 2nxy s ASN 276 Cb 0.07 1.36 1.19 0.00 -0.55 0.00 0.00 41.25 43.33 2nxy s ASN 276 CO 0.61 -0.13 2.13 -0.26 -2.79 0.00 0.00 177.10 176.65 2nxy h PHE 277 N 6.84 0.10 0.00 0.43 -1.00 -1.95 -1.96 116.94 119.40 2nxy h PHE 277 Ca -0.02 0.00 -0.03 0.00 2.81 0.00 0.00 57.97 60.73 2nxy h PHE 277 Cb 1.20 -0.03 -0.00 0.00 3.61 0.00 0.00 35.95 40.72 2nxy h PHE 277 CO 0.02 0.06 -0.14 1.15 -1.61 0.00 0.00 178.31 177.79 2nxy h THR 278 N 0.11 0.49 -3.59 -1.55 2.02 -1.99 -3.41 112.91 105.00 2nxy h THR 278 Ca 0.03 -0.72 -0.62 0.00 0.77 0.00 0.00 66.41 65.87 2nxy h THR 278 Cb 0.00 1.49 -0.12 0.00 -1.74 0.00 0.00 68.15 67.78 2nxy h THR 278 CO -0.01 0.14 0.37 -0.62 0.37 0.00 0.00 175.52 175.77 2nxy s ASP 279 N -6.08 6.46 0.60 4.18 3.68 -0.74 -4.92 116.67 119.84 2nxy s ASP 279 Ca -0.01 0.07 0.38 0.00 2.13 0.00 0.00 52.55 55.11 2nxy s ASP 279 Cb 0.12 -2.39 1.81 0.00 -1.45 0.00 0.00 42.92 41.01 2nxy s ASP 279 CO 0.59 -0.85 2.15 -0.55 0.13 0.00 0.00 175.17 176.65 2nxy h ASN 280 N 8.80 0.00 1.20 -0.34 -1.07 -1.84 -2.46 115.58 119.88 2nxy h ASN 280 Ca -0.25 0.00 0.00 0.00 0.07 0.00 0.00 56.30 56.12 2nxy h ASN 280 Cb 1.09 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 37.34 2nxy h ASN 280 CO 0.94 0.02 -0.08 0.00 0.07 0.00 0.00 177.43 178.38 2nxy n ALA 281 N -2.11 2.42 -2.33 4.14 0.00 -1.26 -4.04 120.51 117.32 2nxy n ALA 281 Ca -0.01 -0.09 -0.39 0.00 0.00 0.00 0.00 53.44 52.95 2nxy n ALA 281 Cb 0.20 -1.43 -0.06 0.00 0.00 0.00 0.00 19.45 18.17 2nxy n ALA 281 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 2nxy s LYS 282 N -3.06 4.34 0.32 0.00 -0.14 -0.93 -5.04 119.74 115.23 2nxy s LYS 282 Ca 0.11 0.84 -0.29 0.00 -1.36 0.00 0.00 55.97 55.28 2nxy s LYS 282 Cb 0.15 -3.30 -0.10 0.00 -1.68 0.00 0.00 37.83 32.90 2nxy s LYS 282 CO 0.59 0.47 1.29 0.99 -0.76 0.00 0.00 175.35 177.93 2nxy s THR 283 N -0.61 2.79 -0.27 2.17 2.01 -1.26 -4.71 115.64 115.76 2nxy s THR 283 Ca 0.32 0.80 -0.09 0.00 0.31 0.00 0.00 61.69 63.03 2nxy s THR 283 Cb -0.20 -3.51 -0.03 0.00 0.01 0.00 0.00 72.50 68.78 2nxy s THR 283 CO 0.20 0.19 0.12 -0.63 -0.69 0.00 0.00 174.62 173.81 2nxy s ILE 284 N -1.12 4.64 -0.21 1.82 1.01 0.14 -4.52 121.20 122.96 2nxy s ILE 284 Ca 0.49 -0.13 -0.17 0.00 0.00 0.00 0.00 60.65 60.84 2nxy s ILE 284 Cb -0.39 -3.22 -0.03 0.00 0.01 0.00 0.00 42.46 38.82 2nxy s ILE 284 CO 0.52 0.26 0.46 -0.63 0.00 0.00 0.00 174.94 175.55 2nxy s ILE 285 N 1.65 5.14 -0.15 2.92 1.01 0.54 -1.01 121.20 131.32 2nxy s ILE 285 Ca 0.06 0.83 -0.06 0.00 0.00 0.00 0.00 60.65 61.49 2nxy s ILE 285 Cb -0.16 -3.79 -0.04 0.00 0.01 0.00 0.00 42.46 38.49 2nxy s ILE 285 CO 0.06 0.19 0.05 -0.69 0.00 0.00 0.00 174.94 174.55 2nxy s VAL 286 N 1.62 4.70 -0.22 2.92 1.01 -0.08 -0.45 120.40 129.89 2nxy s VAL 286 Ca 0.21 -0.08 0.01 0.00 0.00 0.00 0.00 61.98 62.12 2nxy s VAL 286 Cb -0.15 -3.07 0.03 0.00 0.00 0.00 0.00 36.38 33.19 2nxy s VAL 286 CO 0.09 0.53 -0.13 -1.58 0.00 0.00 0.00 175.10 174.01 2nxy s GLN 287 N -0.17 2.73 0.62 2.72 0.74 0.35 -1.77 119.66 124.87 2nxy s GLN 287 Ca 0.07 -1.02 -0.14 0.00 0.05 0.00 0.00 55.36 54.32 2nxy s GLN 287 Cb -0.12 -2.80 -0.03 0.00 1.10 0.00 0.00 33.01 31.17 2nxy s GLN 287 CO 0.01 -0.37 1.05 -0.51 -0.55 0.00 0.00 175.29 174.92 2nxy s LEU 288 N 1.25 3.38 0.00 3.68 1.43 -0.27 -1.81 118.68 126.34 2nxy s LEU 288 Ca -0.01 1.71 0.16 0.00 -1.03 0.00 0.00 54.13 54.96 2nxy s LEU 288 Cb -0.16 -4.52 -0.02 0.00 0.03 0.00 0.00 46.19 41.52 2nxy s LEU 288 CO -0.08 -1.18 0.83 -0.46 0.23 0.00 0.00 176.35 175.68 2nxy n ASN 289 N -2.37 1.51 -3.71 2.29 6.94 -1.26 -0.21 115.26 118.45 2nxy n ASN 289 Ca 0.08 -1.26 -0.17 0.00 -0.02 0.00 0.00 54.58 53.21 2nxy n ASN 289 Cb 0.53 0.53 -0.17 0.00 -2.36 0.00 0.00 39.78 38.31 2nxy n ASN 289 CO 0.00 0.00 0.00 -0.89 -1.03 0.00 0.00 177.26 175.34 2nxy s THR 290 N -1.94 -0.11 0.53 5.53 2.01 -1.26 -4.76 115.64 115.64 2nxy s THR 290 Ca 0.12 0.33 -0.18 0.00 0.31 0.00 0.00 61.69 62.27 2nxy s THR 290 Cb 0.13 -0.16 -0.07 0.00 0.01 0.00 0.00 72.50 72.41 2nxy s THR 290 CO 0.42 0.14 1.03 -0.94 -0.69 0.00 0.00 174.62 174.58 2nxy s SER 291 N 1.74 6.23 -0.11 3.53 1.04 -1.26 -4.93 113.70 119.94 2nxy s SER 291 Ca -0.01 1.78 0.03 0.00 0.48 0.00 0.00 55.95 58.23 2nxy s SER 291 Cb -0.12 -2.54 0.01 0.00 0.10 0.00 0.00 66.02 63.47 2nxy s SER 291 CO -0.04 -0.86 -0.19 -0.69 0.98 0.00 0.00 173.24 172.44 2nxy s VAL 292 N -2.33 1.77 0.22 5.02 1.01 -0.65 -4.92 120.40 120.52 2nxy s VAL 292 Ca 0.63 -0.83 -0.30 0.00 0.00 0.00 0.00 61.98 61.49 2nxy s VAL 292 Cb -0.14 -1.57 -0.09 0.00 0.00 0.00 0.00 36.38 34.58 2nxy s VAL 292 CO 0.29 0.50 1.25 -1.61 0.00 0.00 0.00 175.10 175.52 2nxy s GLU 293 N 0.70 4.45 -0.14 2.72 2.02 -1.26 0.10 118.70 127.28 2nxy s GLU 293 Ca -0.12 1.99 -0.00 0.00 0.02 0.00 0.00 54.97 56.86 2nxy s GLU 293 Cb -0.16 -3.19 0.03 0.00 0.10 0.00 0.00 34.13 30.91 2nxy s GLU 293 CO 0.02 -0.14 -0.07 -1.50 0.02 0.00 0.00 175.26 173.60 2nxy s ILE 294 N -0.28 1.11 -0.22 -1.63 2.07 -0.31 -4.34 121.20 117.59 2nxy s ILE 294 Ca 0.53 -0.48 -0.05 0.00 -1.41 0.00 0.00 60.65 59.23 2nxy s ILE 294 Cb -0.35 -1.20 -0.02 0.00 0.13 0.00 0.00 42.46 41.02 2nxy s ILE 294 CO 0.40 0.25 0.01 0.20 -1.91 0.00 0.00 174.94 173.90 2nxy s ASN 295 N 1.65 4.78 0.11 4.50 0.01 -0.33 -1.42 114.94 124.25 2nxy s ASN 295 Ca 0.03 -0.25 0.10 0.00 -0.71 0.00 0.00 52.86 52.03 2nxy s ASN 295 Cb -0.14 -1.83 -0.04 0.00 0.41 0.00 0.00 41.25 39.65 2nxy s ASN 295 CO -0.08 0.01 -0.24 0.00 -1.51 0.00 0.00 177.10 175.29 2nxy s THR 297 N -1.06 0.84 -1.40 0.00 -1.32 -0.30 -1.97 115.64 110.44 2nxy s THR 297 Ca 0.15 -0.88 0.05 0.00 -1.21 0.00 0.00 61.69 59.80 2nxy s THR 297 Cb -0.10 -0.79 0.09 0.00 -1.51 0.00 0.00 72.50 70.19 2nxy s THR 297 CO 0.07 -0.07 1.02 0.61 -2.21 0.00 0.00 174.62 174.04 2nxy n GLY 298 N 1.97 -0.48 0.00 6.08 0.00 0.75 -1.70 105.19 111.81 2nxy n GLY 298 Ca -0.18 -0.02 0.14 0.00 0.00 0.00 0.00 46.02 45.95 2nxy n GLY 298 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2nxy n ALA 299 N -1.30 2.44 0.00 4.61 0.00 -1.26 -4.90 120.51 120.10 2nxy n ALA 299 Ca 0.02 -0.14 0.00 0.00 0.00 0.00 0.00 53.44 53.32 2nxy n ALA 299 Cb 0.04 -1.47 0.00 0.00 0.00 0.00 0.00 19.45 18.03 2nxy n ALA 299 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2nxy n GLY 329 N 1.08 1.85 3.44 0.00 0.00 -0.69 -5.04 105.19 105.84 2nxy n GLY 329 Ca 0.15 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.06 2nxy n GLY 329 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 2nxy s HIS 330 N -2.00 -0.50 -0.05 1.61 0.00 -1.20 -0.30 115.29 112.84 2nxy s HIS 330 Ca 0.00 0.33 0.06 0.00 -3.00 0.00 0.00 55.06 52.44 2nxy s HIS 330 Cb 0.00 0.55 -0.01 0.00 -4.00 0.00 0.00 32.58 29.12 2nxy s HIS 330 CO 0.00 -0.78 -0.22 0.00 -1.00 0.00 0.00 174.74 172.74 2nxy s ASN 332 N -0.14 5.42 -0.02 0.00 0.01 0.23 -0.48 114.94 119.97 2nxy s ASN 332 Ca -0.02 0.20 0.00 0.00 -0.71 0.00 0.00 52.86 52.33 2nxy s ASN 332 Cb -0.13 -1.57 0.02 0.00 0.41 0.00 0.00 41.25 39.98 2nxy s ASN 332 CO 0.03 0.38 0.01 -0.63 -1.51 0.00 0.00 177.10 175.38 2nxy s ILE 333 N -0.90 0.07 0.08 0.60 1.01 -0.09 -1.18 121.20 120.78 2nxy s ILE 333 Ca 0.13 0.09 -0.31 0.00 0.00 0.00 0.00 60.65 60.57 2nxy s ILE 333 Cb -0.11 -0.15 -0.09 0.00 0.01 0.00 0.00 42.46 42.12 2nxy s ILE 333 CO 0.03 0.09 1.70 0.00 0.00 0.00 0.00 174.94 176.75 2nxy s ALA 334 N 0.72 3.70 0.16 9.38 0.00 -1.26 0.75 121.76 135.21 2nxy s ALA 334 Ca -0.07 1.26 -0.11 0.00 0.00 0.00 0.00 51.96 53.05 2nxy s ALA 334 Cb -0.09 -3.71 0.02 0.00 0.00 0.00 0.00 23.12 19.34 2nxy s ALA 334 CO -0.02 -1.14 1.58 -0.09 0.00 0.00 0.00 175.76 176.10 2nxy h ARG 335 N 8.41 0.99 -0.36 0.00 2.43 -1.74 -2.16 114.38 121.95 2nxy h ARG 335 Ca -0.43 -0.37 -0.02 0.00 -0.81 0.00 0.00 59.98 58.35 2nxy h ARG 335 Cb 1.20 -0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 30.68 2nxy h ARG 335 CO 0.93 1.04 0.14 0.00 -1.51 0.00 0.00 179.97 180.58 2nxy h ALA 336 N 0.92 0.47 -0.47 2.80 0.00 -1.89 -0.56 119.26 120.53 2nxy h ALA 336 Ca 0.14 -0.14 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 2nxy h ALA 336 Cb 0.66 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.29 2nxy h ALA 336 CO 0.05 0.07 0.19 0.87 0.00 0.00 0.00 179.25 180.43 2nxy h LYS 337 N 0.44 0.70 -0.69 0.00 1.57 -1.94 -1.38 116.57 115.27 2nxy h LYS 337 Ca 0.12 -0.13 -0.04 0.00 -1.87 0.00 0.00 60.65 58.74 2nxy h LYS 337 Cb 0.19 -0.11 -0.03 0.00 0.08 0.00 0.00 32.23 32.36 2nxy h LYS 337 CO -0.01 0.63 0.28 2.35 -0.57 0.00 0.00 179.45 182.13 2nxy h TRP 338 N 0.61 1.04 -0.77 -1.35 2.91 -1.27 -1.64 115.95 115.49 2nxy h TRP 338 Ca 0.16 -0.07 -0.01 0.00 1.13 0.00 0.00 58.89 60.09 2nxy h TRP 338 Cb 0.19 -0.31 -0.04 0.00 -0.51 0.00 0.00 29.16 28.49 2nxy h TRP 338 CO 0.00 0.80 0.45 -0.97 -1.03 0.00 0.00 178.44 177.69 2nxy h ASN 339 N 0.98 0.94 -0.62 2.65 -1.24 -0.83 -0.64 115.58 116.82 2nxy h ASN 339 Ca 0.23 -0.08 -0.04 0.00 0.71 0.00 0.00 56.30 57.13 2nxy h ASN 339 Cb 0.19 -0.24 -0.03 0.00 0.73 0.00 0.00 38.32 38.98 2nxy h ASN 339 CO -0.02 0.74 0.25 -1.13 -1.29 0.00 0.00 177.43 175.98 2nxy h ASN 340 N 1.06 0.88 -0.09 1.15 -1.24 -1.00 -2.51 115.58 113.83 2nxy h ASN 340 Ca 0.27 -0.12 -0.01 0.00 0.71 0.00 0.00 56.30 57.16 2nxy h ASN 340 Cb -0.01 -0.23 -0.00 0.00 0.73 0.00 0.00 38.32 38.81 2nxy h ASN 340 CO -0.05 0.79 0.03 0.74 -1.29 0.00 0.00 177.43 177.65 2nxy h THR 341 N 0.94 1.15 -0.92 -3.57 2.02 -0.62 -2.47 112.91 109.45 2nxy h THR 341 Ca 0.22 -0.46 0.07 0.00 0.77 0.00 0.00 66.41 67.01 2nxy h THR 341 Cb 0.19 1.30 -0.06 0.00 -1.74 0.00 0.00 68.15 67.83 2nxy h THR 341 CO -0.02 0.13 0.58 -0.07 0.37 0.00 0.00 175.52 176.51 2nxy h LEU 342 N -0.02 0.91 -0.78 2.58 3.38 -1.01 -1.25 115.31 119.13 2nxy h LEU 342 Ca 0.03 0.02 -0.03 0.00 0.09 0.00 0.00 57.88 57.99 2nxy h LEU 342 Cb 0.18 -0.18 -0.04 0.00 0.09 0.00 0.00 40.66 40.72 2nxy h LEU 342 CO -0.00 0.58 0.38 0.50 0.09 0.00 0.00 178.44 179.98 2nxy h LYS 343 N 1.05 1.12 -0.59 1.13 3.64 -1.31 0.59 116.57 122.20 2nxy h LYS 343 Ca 0.40 -0.16 -0.09 0.00 -1.27 0.00 0.00 60.65 59.53 2nxy h LYS 343 Cb 0.18 -0.20 -0.02 0.00 -0.41 0.00 0.00 32.23 31.78 2nxy h LYS 343 CO -0.18 0.87 0.02 1.96 -2.27 0.00 0.00 179.45 179.85 2nxy h GLN 344 N 1.10 1.02 -0.11 1.90 4.20 -0.95 -2.04 115.11 120.23 2nxy h GLN 344 Ca 0.27 -0.31 -0.02 0.00 0.06 0.00 0.00 58.65 58.64 2nxy h GLN 344 Cb 0.11 -0.10 -0.00 0.00 0.30 0.00 0.00 27.48 27.79 2nxy h GLN 344 CO -0.03 1.00 -0.02 0.82 -0.67 0.00 0.00 178.83 179.92 2nxy h ILE 345 N 0.91 1.28 -0.85 2.54 2.04 -0.83 -2.60 117.51 120.01 2nxy h ILE 345 Ca 0.17 -0.93 0.03 0.00 1.00 0.00 0.00 64.86 65.14 2nxy h ILE 345 Cb 0.52 1.67 -0.05 0.00 -0.74 0.00 0.00 36.82 38.22 2nxy h ILE 345 CO 0.03 0.26 0.54 0.00 0.00 0.00 0.00 178.15 178.98 2nxy h ALA 346 N 0.70 1.12 -0.72 1.87 0.00 -0.89 0.17 119.26 121.52 2nxy h ALA 346 Ca 0.03 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.90 2nxy h ALA 346 Cb 0.42 -0.29 -0.04 0.00 0.00 0.00 0.00 17.79 17.89 2nxy h ALA 346 CO 0.01 0.37 0.44 1.03 0.00 0.00 0.00 179.25 181.10 2nxy h SER 347 N 1.05 0.85 -0.09 0.00 0.87 -1.31 0.15 113.55 115.07 2nxy h SER 347 Ca 0.34 -0.04 -0.16 0.00 -1.23 0.00 0.00 61.79 60.70 2nxy h SER 347 Cb 0.02 -0.21 -0.01 0.00 -0.44 0.00 0.00 62.40 61.76 2nxy h SER 347 CO -0.12 0.64 -0.48 0.11 -0.53 0.00 0.00 176.83 176.45 2nxy h LYS 348 N 0.98 0.66 -0.39 2.24 1.79 -0.88 -2.42 116.57 118.54 2nxy h LYS 348 Ca 0.26 -0.38 -0.10 0.00 -2.18 0.00 0.00 60.65 58.25 2nxy h LYS 348 Cb -0.06 0.03 -0.02 0.00 -1.58 0.00 0.00 32.23 30.61 2nxy h LYS 348 CO -0.05 0.99 -0.17 -0.07 -1.08 0.00 0.00 179.45 179.08 2nxy h LEU 349 N 0.52 0.73 -0.34 2.94 3.38 -0.38 -2.55 115.31 119.61 2nxy h LEU 349 Ca 0.03 -0.24 -0.01 0.00 0.09 0.00 0.00 57.88 57.75 2nxy h LEU 349 Cb 1.03 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.57 2nxy h LEU 349 CO 0.10 0.90 0.19 0.03 0.09 0.00 0.00 178.44 179.75 2nxy h ARG 350 N 0.65 0.47 0.00 1.13 3.08 -0.69 0.07 114.38 119.10 2nxy h ARG 350 Ca 0.10 -0.05 -0.00 0.00 0.07 0.00 0.00 59.98 60.10 2nxy h ARG 350 Cb 0.65 -0.09 -0.00 0.00 0.08 0.00 0.00 29.97 30.60 2nxy h ARG 350 CO 0.05 0.39 -0.01 1.49 -1.07 0.00 0.00 179.97 180.81 2nxy h GLU 351 N 0.43 0.00 0.08 0.04 4.81 -1.22 0.43 114.58 119.14 2nxy h GLU 351 Ca 0.12 0.00 -0.35 0.00 -0.13 0.00 0.00 59.36 59.00 2nxy h GLU 351 Cb 0.05 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 29.40 2nxy h GLU 351 CO -0.02 0.01 -1.94 0.94 -0.73 0.00 0.00 179.01 177.27 2nxy n GLN 352 N -3.81 0.70 -0.02 1.92 -0.06 -0.98 -4.64 117.38 110.48 2nxy n GLN 352 Ca -0.03 0.31 0.08 0.00 -2.00 0.00 0.00 57.00 55.37 2nxy n GLN 352 Cb 0.10 -1.68 -0.16 0.00 -4.06 0.00 0.00 30.24 24.43 2nxy n GLN 352 CO 0.00 0.00 0.00 1.19 -0.20 0.00 0.00 177.06 178.05 2nxy n PHE 353 N -3.69 0.00 0.00 3.69 3.01 -0.01 -5.04 117.46 115.42 2nxy n PHE 353 Ca -0.35 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.11 2nxy n PHE 353 Cb 0.96 -0.53 0.00 0.00 -0.01 0.00 0.00 39.48 39.90 2nxy n PHE 353 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2nxy n GLY 354 N 1.37 3.67 0.30 1.37 0.00 0.15 -4.94 105.19 107.10 2nxy n GLY 354 Ca -0.07 -0.27 0.19 0.00 0.00 0.00 0.00 46.02 45.87 2nxy n GLY 354 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 2nxy h ASN 355 N 0.00 0.00 -0.43 1.61 2.35 -1.90 -2.68 115.58 114.52 2nxy h ASN 355 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 2nxy h ASN 355 Cb 0.00 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.37 2nxy h ASN 355 CO 0.00 0.02 0.00 -0.46 -1.65 0.00 0.00 177.43 175.34 2nxy n ASN 356 N -3.18 3.34 -4.79 5.81 6.94 -1.26 -4.97 115.26 117.14 2nxy n ASN 356 Ca -0.01 -1.95 -0.39 0.00 -0.02 0.00 0.00 54.58 52.21 2nxy n ASN 356 Cb 0.20 -0.28 -0.06 0.00 -2.36 0.00 0.00 39.78 37.28 2nxy n ASN 356 CO 0.00 0.00 0.00 -0.54 -1.03 0.00 0.00 177.26 175.69 2nxy s LYS 357 N -1.21 4.40 0.10 -3.83 1.02 -1.01 -4.92 119.74 114.29 2nxy s LYS 357 Ca 0.36 0.97 -0.30 0.00 0.02 0.00 0.00 55.97 57.01 2nxy s LYS 357 Cb 0.20 -3.25 -0.05 0.00 -0.52 0.00 0.00 37.83 34.20 2nxy s LYS 357 CO 0.27 0.60 0.99 0.99 -0.92 0.00 0.00 175.35 177.28 2nxy s THR 358 N -1.11 4.49 -0.24 2.17 2.01 -0.69 -4.91 115.64 117.35 2nxy s THR 358 Ca 0.33 2.01 -0.08 0.00 0.31 0.00 0.00 61.69 64.25 2nxy s THR 358 Cb -0.21 -4.28 -0.03 0.00 0.01 0.00 0.00 72.50 67.98 2nxy s THR 358 CO 0.23 0.28 0.09 -0.63 -0.69 0.00 0.00 174.62 173.89 2nxy s ILE 359 N 0.20 4.53 -0.10 1.82 -1.09 -0.54 -0.93 121.20 125.09 2nxy s ILE 359 Ca 0.48 -0.10 0.04 0.00 -2.23 0.00 0.00 60.65 58.84 2nxy s ILE 359 Cb -0.24 -3.11 -0.01 0.00 -1.58 0.00 0.00 42.46 37.52 2nxy s ILE 359 CO 0.30 0.35 -0.22 -0.63 -1.23 0.00 0.00 174.94 173.51 2nxy s ILE 360 N 1.43 2.27 -0.16 2.92 1.01 -0.23 0.41 121.20 128.86 2nxy s ILE 360 Ca 0.06 -0.95 -0.06 0.00 0.00 0.00 0.00 60.65 59.69 2nxy s ILE 360 Cb -0.15 -1.88 -0.04 0.00 0.01 0.00 0.00 42.46 40.41 2nxy s ILE 360 CO 0.04 0.56 0.07 -0.36 0.00 0.00 0.00 174.94 175.25 2nxy s PHE 361 N 0.24 3.29 0.13 3.97 0.40 0.20 -0.43 117.98 125.77 2nxy s PHE 361 Ca -0.14 0.17 0.03 0.00 -0.60 0.00 0.00 56.93 56.39 2nxy s PHE 361 Cb -0.17 -2.01 -0.04 0.00 0.51 0.00 0.00 43.02 41.31 2nxy s PHE 361 CO 0.07 0.30 -0.09 0.15 0.70 0.00 0.00 175.22 176.36 2nxy s LYS 362 N -0.06 0.97 0.88 0.44 1.02 -0.46 -2.41 119.74 120.13 2nxy s LYS 362 Ca 0.07 -1.40 -0.11 0.00 0.02 0.00 0.00 55.97 54.55 2nxy s LYS 362 Cb -0.12 -0.46 0.13 0.00 -0.52 0.00 0.00 37.83 36.86 2nxy s LYS 362 CO 0.01 0.04 1.15 1.14 -0.92 0.00 0.00 175.35 176.77 2nxy s GLN 363 N -3.77 1.21 0.22 1.68 -2.07 -0.84 -4.14 119.66 111.95 2nxy s GLN 363 Ca 0.15 1.57 -0.30 0.00 -1.82 0.00 0.00 55.36 54.95 2nxy s GLN 363 Cb 0.04 -1.75 -0.15 0.00 -1.09 0.00 0.00 33.01 30.06 2nxy s GLN 363 CO -0.02 -2.49 1.04 0.45 -1.32 0.00 0.00 175.29 172.95 2nxy n SER 364 N -4.02 1.07 -0.02 12.60 2.88 -1.26 -4.80 113.62 120.08 2nxy n SER 364 Ca 0.12 1.16 0.14 0.00 -1.33 0.00 0.00 58.87 58.96 2nxy n SER 364 Cb 0.52 -1.22 0.65 0.00 -0.75 0.00 0.00 64.21 63.40 2nxy n SER 364 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 2nxy n SER 365 N 1.67 0.10 0.00 -3.46 3.41 -1.26 -5.01 113.62 109.07 2nxy n SER 365 Ca 0.13 0.04 0.00 0.00 -0.26 0.00 0.00 58.87 58.78 2nxy n SER 365 Cb 0.28 -0.30 0.00 0.00 -0.26 0.00 0.00 64.21 63.93 2nxy n SER 365 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2nxy n GLY 366 N 1.39 1.60 0.00 5.00 0.00 -1.26 -5.17 105.19 106.74 2nxy n GLY 366 Ca 0.11 -1.97 0.00 0.00 0.00 0.00 0.00 46.02 44.16 2nxy n GLY 366 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2nxy n GLY 367 N -1.78 0.61 3.76 -0.02 0.00 -1.26 -4.79 105.19 101.71 2nxy n GLY 367 Ca 0.00 -2.18 -0.36 0.00 0.00 0.00 0.00 46.02 43.48 2nxy n GLY 367 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2nxy s ASP 368 N -4.00 5.49 0.42 1.61 -0.00 -1.26 -4.77 116.67 114.16 2nxy s ASP 368 Ca 0.00 2.40 0.18 0.00 -0.00 0.00 0.00 52.55 55.13 2nxy s ASP 368 Cb 0.00 -2.60 1.09 0.00 -0.00 0.00 0.00 42.92 41.40 2nxy s ASP 368 CO 0.00 -1.39 1.86 -0.65 -0.00 0.00 0.00 175.17 174.99 2nxy h PRO 369 N 1.28 0.39 -0.05 8.23 0.11 -1.98 -0.92 132.00 139.06 2nxy h PRO 369 Ca -0.50 -0.02 -0.05 0.00 0.11 0.00 0.00 66.00 65.54 2nxy h PRO 369 Cb 1.28 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 32.30 2nxy h PRO 369 CO 0.57 0.26 -0.20 0.93 -0.21 0.00 0.00 178.00 179.35 2nxy h GLU 370 N 0.40 0.08 0.00 1.05 3.07 -1.91 -2.26 114.58 115.02 2nxy h GLU 370 Ca 0.46 -0.02 0.00 0.00 -0.50 0.00 0.00 59.36 59.30 2nxy h GLU 370 Cb 1.15 -0.01 0.00 0.00 -0.84 0.00 0.00 28.75 29.05 2nxy h GLU 370 CO -0.17 0.28 -1.53 0.44 -1.40 0.00 0.00 179.01 176.63 2nxy n ILE 371 N -4.27 0.00 0.10 3.13 -6.64 -0.61 -4.15 119.36 106.92 2nxy n ILE 371 Ca -0.02 -0.32 -0.05 0.00 -1.77 0.00 0.00 62.75 60.59 2nxy n ILE 371 Cb 0.28 0.34 0.07 0.00 -1.44 0.00 0.00 39.64 38.89 2nxy n ILE 371 CO 0.00 0.00 0.00 0.58 -1.77 0.00 0.00 176.55 175.36 2nxy h VAL 372 N 0.00 1.48 -1.84 7.28 2.07 -1.15 -3.44 116.25 120.66 2nxy h VAL 372 Ca 0.00 -2.42 -0.50 0.00 0.82 0.00 0.00 66.70 64.60 2nxy h VAL 372 Cb 0.70 2.31 -0.04 0.00 -1.52 0.00 0.00 31.29 32.73 2nxy h VAL 372 CO 0.00 0.70 -0.46 0.42 0.02 0.00 0.00 177.57 178.25 2nxy s THR 373 N -3.40 3.44 -0.49 2.57 -4.23 -0.86 -4.61 115.64 108.07 2nxy s THR 373 Ca -0.02 -1.41 -0.28 0.00 -1.18 0.00 0.00 61.69 58.80 2nxy s THR 373 Cb 0.11 -3.15 0.01 0.00 1.34 0.00 0.00 72.50 70.81 2nxy s THR 373 CO 0.80 -0.17 1.40 -2.28 -0.54 0.00 0.00 174.62 173.83 2nxy s HIS 374 N -2.33 2.37 0.04 3.99 2.46 -0.50 -4.73 115.29 116.60 2nxy s HIS 374 Ca 0.41 0.59 0.06 0.00 0.47 0.00 0.00 55.06 56.59 2nxy s HIS 374 Cb -0.05 -4.36 -0.03 0.00 -0.13 0.00 0.00 32.58 28.01 2nxy s HIS 374 CO 0.26 -1.93 -0.15 -1.54 -2.47 0.00 0.00 174.74 168.91 2nxy s SER 375 N 4.10 4.00 0.18 9.88 1.04 -1.26 -0.98 113.70 130.66 2nxy s SER 375 Ca 0.56 -0.37 -0.23 0.00 0.48 0.00 0.00 55.95 56.38 2nxy s SER 375 Cb -0.12 -0.71 0.07 0.00 0.10 0.00 0.00 66.02 65.36 2nxy s SER 375 CO 0.29 0.25 0.97 0.72 0.98 0.00 0.00 173.24 176.45 2nxy s PHE 376 N -0.96 -0.05 -0.06 5.02 -0.71 -1.03 -1.28 117.98 118.90 2nxy s PHE 376 Ca 0.16 -0.31 0.05 0.00 -1.04 0.00 0.00 56.93 55.79 2nxy s PHE 376 Cb -0.11 0.67 -0.02 0.00 -1.21 0.00 0.00 43.02 42.36 2nxy s PHE 376 CO 0.06 -0.91 -0.21 0.54 -1.34 0.00 0.00 175.22 173.37 2nxy s ASN 377 N -3.08 3.46 -0.06 1.98 4.22 -1.26 -0.75 114.94 119.44 2nxy s ASN 377 Ca 0.15 -0.39 -0.02 0.00 -2.14 0.00 0.00 52.86 50.45 2nxy s ASN 377 Cb -0.02 -0.88 0.04 0.00 1.28 0.00 0.00 41.25 41.67 2nxy s ASN 377 CO 0.04 0.27 0.13 0.00 -2.04 0.00 0.00 177.10 175.50 2nxy n GLY 379 N 4.61 0.35 1.84 0.00 0.00 -1.26 -1.26 105.19 109.47 2nxy n GLY 379 Ca -0.19 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.83 2nxy n GLY 379 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2nxy n GLY 380 N -0.75 1.44 3.91 -0.02 0.00 -1.26 -4.50 105.19 104.01 2nxy n GLY 380 Ca -0.22 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.49 2nxy n GLY 380 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2nxy s GLU 381 N -0.39 3.47 -0.38 1.61 0.41 -0.39 -4.92 118.70 118.11 2nxy s GLU 381 Ca 0.00 -0.36 -0.15 0.00 -0.41 0.00 0.00 54.97 54.04 2nxy s GLU 381 Cb 0.00 -3.03 0.00 0.00 -1.78 0.00 0.00 34.13 29.32 2nxy s GLU 381 CO 0.00 0.61 0.35 -0.06 -0.49 0.00 0.00 175.26 175.67 2nxy s PHE 382 N -1.48 3.21 0.03 1.61 0.40 -1.26 -0.91 117.98 119.58 2nxy s PHE 382 Ca 0.34 -0.26 -0.06 0.00 -0.60 0.00 0.00 56.93 56.34 2nxy s PHE 382 Cb -0.13 -2.69 -0.05 0.00 0.51 0.00 0.00 43.02 40.67 2nxy s PHE 382 CO 0.25 -0.53 0.29 -0.06 0.70 0.00 0.00 175.22 175.87 2nxy s PHE 383 N 1.94 3.57 -0.27 0.36 0.40 0.07 -1.26 117.98 122.78 2nxy s PHE 383 Ca 0.10 0.58 -0.02 0.00 -0.60 0.00 0.00 56.93 56.98 2nxy s PHE 383 Cb -0.17 -2.00 0.09 0.00 0.51 0.00 0.00 43.02 41.45 2nxy s PHE 383 CO 0.12 0.59 0.09 0.71 0.70 0.00 0.00 175.22 177.42 2nxy s TYR 384 N -1.35 1.16 -0.18 0.36 1.51 0.17 -2.47 117.35 116.56 2nxy s TYR 384 Ca 0.30 -1.25 -0.05 0.00 -1.01 0.00 0.00 57.07 55.06 2nxy s TYR 384 Cb -0.13 -1.30 -0.03 0.00 -0.11 0.00 0.00 41.96 40.39 2nxy s TYR 384 CO 0.18 -0.78 -0.01 0.00 -1.11 0.00 0.00 175.55 173.83 2nxy s ASN 386 N 0.61 6.07 -0.03 0.00 3.84 -0.31 -1.40 114.94 123.71 2nxy s ASN 386 Ca -0.01 1.75 0.22 0.00 0.21 0.00 0.00 52.86 55.03 2nxy s ASN 386 Cb -0.14 -2.53 0.67 0.00 -0.55 0.00 0.00 41.25 38.71 2nxy s ASN 386 CO 0.02 -1.49 1.57 -1.54 -2.79 0.00 0.00 177.10 172.87 2nxy n SER 387 N 9.48 4.17 -0.25 -4.21 3.41 -1.26 -4.42 113.62 120.54 2nxy n SER 387 Ca 0.22 -2.10 0.06 0.00 -0.26 0.00 0.00 58.87 56.79 2nxy n SER 387 Cb 0.45 -0.52 0.19 0.00 -0.26 0.00 0.00 64.21 64.08 2nxy n SER 387 CO 0.00 0.00 0.00 0.74 -0.16 0.00 0.00 175.04 175.62 2nxy h THR 388 N 4.29 0.55 0.00 6.66 2.02 -1.89 -0.13 112.91 124.41 2nxy h THR 388 Ca 0.00 -0.11 0.00 0.00 0.77 0.00 0.00 66.41 67.07 2nxy h THR 388 Cb 1.10 0.20 0.00 0.00 -1.74 0.00 0.00 68.15 67.71 2nxy h THR 388 CO 0.05 0.06 0.00 1.56 0.37 0.00 0.00 175.52 177.56 2nxy h GLN 389 N 0.33 0.00 0.00 6.66 4.20 -1.97 -1.85 115.11 122.47 2nxy h GLN 389 Ca 0.43 0.00 -0.11 0.00 0.06 0.00 0.00 58.65 59.02 2nxy h GLN 389 Cb 0.71 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.47 2nxy h GLN 389 CO -0.48 0.00 -0.97 -0.07 -0.67 0.00 0.00 178.83 176.64 2nxy h LEU 390 N 0.00 0.00 -6.38 1.46 3.38 -1.36 -3.41 115.31 109.01 2nxy h LEU 390 Ca 0.00 0.00 -0.59 0.00 0.09 0.00 0.00 57.88 57.38 2nxy h LEU 390 Cb 0.25 0.00 -0.41 0.00 0.09 0.00 0.00 40.66 40.59 2nxy h LEU 390 CO 0.00 0.43 -0.78 0.49 0.09 0.00 0.00 178.44 178.67 2nxy n PHE 391 N -2.98 1.78 -2.78 1.13 3.01 -0.70 -4.89 117.46 112.04 2nxy n PHE 391 Ca -0.04 -3.90 -0.10 0.00 1.01 0.00 0.00 57.45 54.43 2nxy n PHE 391 Cb 0.74 -0.38 0.06 0.00 -0.01 0.00 0.00 39.48 39.89 2nxy n PHE 391 CO 0.00 0.00 0.00 -1.71 1.01 0.00 0.00 176.76 176.06 2nxy n ASN 392 N 1.58 -2.42 -3.61 4.37 5.15 -1.17 -1.99 115.26 117.16 2nxy n ASN 392 Ca 0.25 -3.41 -0.11 0.00 -0.60 0.00 0.00 54.58 50.71 2nxy n ASN 392 Cb 0.44 1.66 -0.05 0.00 -0.53 0.00 0.00 39.78 41.31 2nxy n ASN 392 CO 0.00 0.00 0.00 -0.94 1.40 0.00 0.00 177.26 177.72 2nxy s SER 393 N -1.54 -0.30 -0.07 1.20 1.04 -1.01 -5.00 113.70 108.02 2nxy s SER 393 Ca 0.29 -0.17 0.05 0.00 0.48 0.00 0.00 55.95 56.59 2nxy s SER 393 Cb 0.25 0.48 -0.00 0.00 0.10 0.00 0.00 66.02 66.85 2nxy s SER 393 CO -0.16 -0.82 -0.22 -0.89 0.98 0.00 0.00 173.24 172.13 2nxy s THR 394 N -3.42 1.85 -0.02 2.02 2.01 -1.26 -0.63 115.64 116.18 2nxy s THR 394 Ca 0.00 -0.93 0.05 0.00 0.31 0.00 0.00 61.69 61.13 2nxy s THR 394 Cb 0.01 -1.58 -0.01 0.00 0.01 0.00 0.00 72.50 70.92 2nxy s THR 394 CO -0.09 0.52 -0.19 0.26 -0.69 0.00 0.00 174.62 174.43 2nxy s TRP 395 N 0.08 1.72 -1.32 4.92 0.52 0.17 -4.74 118.94 120.28 2nxy s TRP 395 Ca -0.09 -0.38 -0.06 0.00 0.02 0.00 0.00 56.10 55.59 2nxy s TRP 395 Cb -0.15 -1.12 0.01 0.00 -1.15 0.00 0.00 33.47 31.06 2nxy s TRP 395 CO 0.05 -0.07 1.10 1.19 0.02 0.00 0.00 176.95 179.23 2nxy n PHE 396 N 2.77 -2.59 -0.01 -1.98 3.01 -1.26 -1.47 117.46 115.93 2nxy n PHE 396 Ca -0.16 0.98 -0.00 0.00 1.01 0.00 0.00 57.45 59.28 2nxy n PHE 396 Cb 0.53 -4.97 -0.00 0.00 -0.01 0.00 0.00 39.48 35.03 2nxy n PHE 396 CO 0.00 0.00 0.00 -0.97 1.01 0.00 0.00 176.76 176.80 2nxy h ASN 397 N -2.38 0.00 0.00 4.37 -1.24 -1.93 -3.41 115.58 110.99 2nxy h ASN 397 Ca -0.58 0.00 0.00 0.00 0.71 0.00 0.00 56.30 56.43 2nxy h ASN 397 Cb 1.36 0.00 0.00 0.00 0.73 0.00 0.00 38.32 40.41 2nxy h ASN 397 CO 0.55 0.10 0.00 0.61 -1.29 0.00 0.00 177.43 177.40 2nxy n GLY 410 N 1.79 -0.66 3.78 1.57 0.00 -1.26 -5.05 105.19 105.35 2nxy n GLY 410 Ca -0.01 -0.39 -0.30 0.00 0.00 0.00 0.00 46.02 45.32 2nxy n GLY 410 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2nxy s SER 411 N -4.00 4.23 0.37 1.61 0.15 -1.26 -4.97 113.70 109.84 2nxy s SER 411 Ca 0.00 1.39 0.08 0.00 0.70 0.00 0.00 55.95 58.12 2nxy s SER 411 Cb 0.00 -2.11 0.73 0.00 -1.71 0.00 0.00 66.02 62.93 2nxy s SER 411 CO 0.00 -2.15 1.90 -0.78 1.20 0.00 0.00 173.24 173.41 2nxy h ASP 412 N -1.21 0.29 -4.10 5.45 3.58 -2.01 -3.43 116.42 114.99 2nxy h ASP 412 Ca -0.47 -0.06 -0.42 0.00 0.42 0.00 0.00 57.03 56.49 2nxy h ASP 412 Cb 1.27 -0.08 -0.29 0.00 1.72 0.00 0.00 39.33 41.96 2nxy h ASP 412 CO 0.58 0.43 -0.79 0.28 -2.88 0.00 0.00 179.24 176.86 2nxy s THR 413 N -4.78 0.85 -0.22 2.25 -1.32 -1.26 -2.38 115.64 108.79 2nxy s THR 413 Ca -0.06 -0.47 -0.20 0.00 -1.21 0.00 0.00 61.69 59.75 2nxy s THR 413 Cb 0.15 -0.72 -0.03 0.00 -1.51 0.00 0.00 72.50 70.40 2nxy s THR 413 CO 0.74 0.23 0.58 -0.63 -2.21 0.00 0.00 174.62 173.34 2nxy s ILE 414 N -0.27 5.04 -0.30 5.08 1.01 0.23 -4.82 121.20 127.17 2nxy s ILE 414 Ca 0.04 1.07 -0.07 0.00 0.00 0.00 0.00 60.65 61.69 2nxy s ILE 414 Cb -0.04 -3.90 0.01 0.00 0.01 0.00 0.00 42.46 38.54 2nxy s ILE 414 CO -0.00 0.11 0.09 -0.89 0.00 0.00 0.00 174.94 174.24 2nxy s THR 415 N 2.02 3.94 -0.17 2.92 2.01 -1.26 -0.92 115.64 124.18 2nxy s THR 415 Ca 0.26 -0.77 -0.16 0.00 0.31 0.00 0.00 61.69 61.33 2nxy s THR 415 Cb -0.16 -3.07 -0.04 0.00 0.01 0.00 0.00 72.50 69.25 2nxy s THR 415 CO 0.10 0.03 0.38 -0.76 -0.69 0.00 0.00 174.62 173.68 2nxy s LEU 416 N 1.48 4.21 0.18 4.42 1.43 0.37 -4.93 118.68 125.85 2nxy s LEU 416 Ca 0.02 0.58 -0.30 0.00 -1.03 0.00 0.00 54.13 53.40 2nxy s LEU 416 Cb -0.18 -2.51 -0.08 0.00 0.03 0.00 0.00 46.19 43.45 2nxy s LEU 416 CO 0.02 -0.00 1.27 -2.16 0.23 0.00 0.00 176.35 175.71 2nxy s PRO 417 N 0.88 4.42 0.36 1.29 0.04 -1.26 -1.09 135.00 139.64 2nxy s PRO 417 Ca 0.20 1.97 0.05 0.00 0.04 0.00 0.00 61.00 63.26 2nxy s PRO 417 Cb -0.14 -3.22 -0.07 0.00 0.04 0.00 0.00 34.50 31.10 2nxy s PRO 417 CO 0.07 -0.21 0.04 0.00 0.04 0.00 0.00 177.00 176.95 2nxy s ARG 419 N -3.83 0.11 -0.12 0.00 3.52 -0.54 -4.55 118.95 113.55 2nxy s ARG 419 Ca 0.36 0.41 -0.19 0.00 -0.13 0.00 0.00 55.73 56.17 2nxy s ARG 419 Cb 0.09 -0.17 -0.04 0.00 -1.56 0.00 0.00 34.95 33.27 2nxy s ARG 419 CO 0.16 -0.17 0.53 0.42 -0.81 0.00 0.00 175.30 175.44 2nxy s ILE 420 N 1.23 5.14 0.12 4.11 1.01 -1.26 -0.66 121.20 130.89 2nxy s ILE 420 Ca -0.09 1.07 0.07 0.00 0.00 0.00 0.00 60.65 61.70 2nxy s ILE 420 Cb -0.11 -3.87 -0.04 0.00 0.01 0.00 0.00 42.46 38.44 2nxy s ILE 420 CO -0.06 0.29 -0.10 -0.54 0.00 0.00 0.00 174.94 174.52 2nxy s LYS 421 N 0.82 2.11 -0.19 2.79 1.02 -0.39 -5.02 119.74 120.89 2nxy s LYS 421 Ca 0.28 -1.06 0.18 0.00 0.02 0.00 0.00 55.97 55.39 2nxy s LYS 421 Cb -0.16 -2.29 -0.25 0.00 -0.52 0.00 0.00 37.83 34.62 2nxy s LYS 421 CO 0.12 0.50 0.09 1.04 -0.92 0.00 0.00 175.35 176.17 2nxy n GLN 422 N 0.60 0.77 -3.77 1.68 3.00 -1.26 -4.33 117.38 114.07 2nxy n GLN 422 Ca -0.13 -0.02 -0.37 0.00 -0.01 0.00 0.00 57.00 56.47 2nxy n GLN 422 Cb 0.53 -1.51 -0.13 0.00 0.00 0.00 0.00 30.24 29.13 2nxy n GLN 422 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.06 177.48 2nxy s ILE 423 N -2.53 3.98 0.10 5.09 1.01 -1.26 -0.17 121.20 127.43 2nxy s ILE 423 Ca -0.10 -0.55 0.06 0.00 0.00 0.00 0.00 60.65 60.06 2nxy s ILE 423 Cb 0.06 -2.99 -0.03 0.00 0.01 0.00 0.00 42.46 39.51 2nxy s ILE 423 CO 0.81 0.17 -0.15 0.27 0.00 0.00 0.00 174.94 176.05 2nxy s ILE 424 N 1.52 1.30 0.08 2.92 -4.36 -0.51 -4.99 121.20 117.16 2nxy s ILE 424 Ca 0.04 -1.56 -0.28 0.00 -0.26 0.00 0.00 60.65 58.59 2nxy s ILE 424 Cb -0.16 -1.38 -0.06 0.00 1.25 0.00 0.00 42.46 42.11 2nxy s ILE 424 CO 0.02 -0.31 0.88 0.20 0.24 0.00 0.00 174.94 175.97 2nxy s ASN 425 N -2.15 7.38 0.23 4.36 0.01 -1.26 -1.18 114.94 122.32 2nxy s ASN 425 Ca 0.05 1.65 -0.30 0.00 -0.71 0.00 0.00 52.86 53.55 2nxy s ASN 425 Cb -0.07 -2.54 -0.09 0.00 0.41 0.00 0.00 41.25 38.96 2nxy s ASN 425 CO 0.03 -0.04 1.02 -0.04 -1.51 0.00 0.00 177.10 176.55 2nxy s MET 426 N 0.02 4.73 0.22 -0.60 -1.94 -0.39 -4.92 119.30 116.43 2nxy s MET 426 Ca 0.44 1.62 0.15 0.00 -1.71 0.00 0.00 55.69 56.19 2nxy s MET 426 Cb -0.22 -3.26 0.01 0.00 2.01 0.00 0.00 34.83 33.37 2nxy s MET 426 CO 0.27 0.32 1.29 0.11 -0.01 0.00 0.00 175.02 177.00 2nxy h TRP 427 N 4.38 0.00 -0.26 -0.03 5.08 -1.93 -3.37 115.95 119.82 2nxy h TRP 427 Ca -0.45 0.00 -0.13 0.00 1.08 0.00 0.00 58.89 59.39 2nxy h TRP 427 Cb 1.21 0.00 -0.01 0.00 -3.00 0.00 0.00 29.16 27.36 2nxy h TRP 427 CO 0.61 0.52 -0.37 1.96 -1.28 0.00 0.00 178.44 179.88 2nxy h GLN 428 N 0.00 0.60 -2.48 0.12 7.50 -1.95 -3.47 115.11 115.42 2nxy h GLN 428 Ca -0.04 -0.29 0.15 0.00 0.50 0.00 0.00 58.65 58.97 2nxy h GLN 428 Cb 1.43 -0.00 -0.05 0.00 0.05 0.00 0.00 27.48 28.91 2nxy h GLN 428 CO 0.06 0.88 0.51 -1.59 -1.50 0.00 0.00 178.83 177.19 2nxy s LYS 429 N -4.31 1.34 -0.07 1.46 0.00 -1.26 -5.11 119.74 111.80 2nxy s LYS 429 Ca -0.08 -0.81 -0.30 0.00 0.00 0.00 0.00 55.97 54.78 2nxy s LYS 429 Cb 0.12 0.41 -0.06 0.00 0.00 0.00 0.00 37.83 38.31 2nxy s LYS 429 CO 0.83 -0.62 1.70 0.08 0.00 0.00 0.00 175.35 177.33 2nxy s VAL 430 N -2.72 3.52 -2.76 1.79 1.01 -1.26 -4.44 120.40 115.54 2nxy s VAL 430 Ca 0.17 0.62 0.00 0.00 0.00 0.00 0.00 61.98 62.77 2nxy s VAL 430 Cb -0.02 -3.43 0.00 0.00 0.00 0.00 0.00 36.38 32.93 2nxy s VAL 430 CO 0.04 -0.08 0.00 0.61 0.00 0.00 0.00 175.10 175.67 2nxy n GLY 431 N 4.28 -2.09 3.27 4.51 0.00 -1.26 -4.20 105.19 109.70 2nxy n GLY 431 Ca 0.18 -1.18 -0.21 0.00 0.00 0.00 0.00 46.02 44.80 2nxy n GLY 431 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2nxy s LYS 432 N -1.97 1.10 0.03 1.61 1.02 0.25 -1.26 119.74 120.51 2nxy s LYS 432 Ca 0.00 -1.21 0.03 0.00 0.02 0.00 0.00 55.97 54.81 2nxy s LYS 432 Cb 0.00 -1.20 -0.02 0.00 -0.52 0.00 0.00 37.83 36.09 2nxy s LYS 432 CO 0.00 0.26 -0.09 0.00 -0.92 0.00 0.00 175.35 174.60 2nxy s ALA 433 N -1.60 0.74 -0.11 5.17 0.00 -0.33 -0.32 121.76 125.32 2nxy s ALA 433 Ca 0.08 -0.67 0.02 0.00 0.00 0.00 0.00 51.96 51.39 2nxy s ALA 433 Cb -0.08 -0.06 -0.01 0.00 0.00 0.00 0.00 23.12 22.97 2nxy s ALA 433 CO 0.04 0.09 -0.17 1.41 0.00 0.00 0.00 175.76 177.12 2nxy s MET 434 N -1.13 3.11 0.29 0.00 1.75 0.36 -1.43 119.30 122.25 2nxy s MET 434 Ca -0.04 -0.76 0.10 0.00 -1.25 0.00 0.00 55.69 53.74 2nxy s MET 434 Cb -0.08 -2.46 -0.05 0.00 2.84 0.00 0.00 34.83 35.08 2nxy s MET 434 CO 0.01 0.27 -0.06 0.71 -0.65 0.00 0.00 175.02 175.29 2nxy s TYR 435 N 0.17 2.53 0.62 4.11 1.51 0.76 0.60 117.35 127.65 2nxy s TYR 435 Ca -0.10 -0.32 -0.14 0.00 -1.01 0.00 0.00 57.07 55.50 2nxy s TYR 435 Cb -0.16 -1.22 -0.02 0.00 -0.11 0.00 0.00 41.96 40.45 2nxy s TYR 435 CO 0.06 0.61 1.06 0.00 -1.11 0.00 0.00 175.55 176.17 2nxy s ALA 436 N -2.44 2.71 0.99 3.71 0.00 -1.26 -4.73 121.76 120.74 2nxy s ALA 436 Ca 0.32 0.31 -0.11 0.00 0.00 0.00 0.00 51.96 52.48 2nxy s ALA 436 Cb -0.04 -3.22 0.19 0.00 0.00 0.00 0.00 23.12 20.05 2nxy s ALA 436 CO 0.18 -0.94 1.10 -2.14 0.00 0.00 0.00 175.76 173.97 2nxy s PRO 437 N -4.33 0.41 0.66 0.00 0.02 -1.26 -4.94 135.00 125.56 2nxy s PRO 437 Ca 0.62 1.27 -0.16 0.00 0.02 0.00 0.00 61.00 62.74 2nxy s PRO 437 Cb -0.16 -1.68 0.00 0.00 0.02 0.00 0.00 34.50 32.69 2nxy s PRO 437 CO 0.42 -2.95 1.18 -2.14 -0.33 0.00 0.00 177.00 173.17 2nxy s PRO 438 N -4.61 2.61 0.00 5.54 0.02 -1.26 -4.96 135.00 132.35 2nxy s PRO 438 Ca 0.67 1.68 0.04 0.00 0.02 0.00 0.00 61.00 63.40 2nxy s PRO 438 Cb -0.23 -1.90 0.00 0.00 0.02 0.00 0.00 34.50 32.39 2nxy s PRO 438 CO 0.60 -1.45 0.43 0.44 -0.33 0.00 0.00 177.00 176.69 2nxy n ILE 439 N -2.24 0.00 -4.40 2.83 -5.35 -1.26 -5.00 119.36 103.94 2nxy n ILE 439 Ca 0.13 -0.47 -0.34 0.00 -0.27 0.00 0.00 62.75 61.80 2nxy n ILE 439 Cb 0.50 1.05 -0.11 0.00 -1.74 0.00 0.00 39.64 39.34 2nxy n ILE 439 CO 0.00 0.00 0.00 -0.55 -1.76 0.00 0.00 176.55 174.24 2nxy s SER 440 N -0.72 4.96 0.00 7.28 0.15 -1.26 -4.99 113.70 119.12 2nxy s SER 440 Ca 0.03 -0.02 0.20 0.00 0.70 0.00 0.00 55.95 56.87 2nxy s SER 440 Cb 0.03 -1.61 0.63 0.00 -1.71 0.00 0.00 66.02 63.36 2nxy s SER 440 CO 0.08 0.26 1.48 0.61 1.20 0.00 0.00 173.24 176.88 2nxy n GLY 441 N 2.92 0.68 2.27 9.45 0.00 -1.26 -4.47 105.19 114.78 2nxy n GLY 441 Ca -0.18 -0.49 -0.22 0.00 0.00 0.00 0.00 46.02 45.13 2nxy n GLY 441 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2nxy n GLN 442 N 0.63 1.16 -2.98 1.61 6.02 -1.26 -4.95 117.38 117.62 2nxy n GLN 442 Ca 0.16 -3.54 -0.42 0.00 -0.01 0.00 0.00 57.00 53.20 2nxy n GLN 442 Cb 0.39 -1.57 -0.05 0.00 1.02 0.00 0.00 30.24 30.04 2nxy n GLN 442 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 2nxy s ILE 443 N -2.00 4.77 -0.01 5.09 1.01 -1.26 -4.99 121.20 123.82 2nxy s ILE 443 Ca 0.38 0.89 0.01 0.00 0.00 0.00 0.00 60.65 61.93 2nxy s ILE 443 Cb 0.24 -4.17 0.00 0.00 0.01 0.00 0.00 42.46 38.54 2nxy s ILE 443 CO -0.09 -0.38 -0.03 -0.13 0.00 0.00 0.00 174.94 174.31 2nxy s ARG 444 N 3.00 0.30 -0.07 2.79 1.81 -1.26 -0.18 118.95 125.34 2nxy s ARG 444 Ca 0.30 -0.09 -0.18 0.00 -1.72 0.00 0.00 55.73 54.04 2nxy s ARG 444 Cb -0.14 -0.33 0.04 0.00 -0.45 0.00 0.00 34.95 34.08 2nxy s ARG 444 CO 0.16 0.03 0.43 0.00 -0.68 0.00 0.00 175.30 175.24 2nxy s SER 446 N -0.80 3.08 0.27 0.00 1.04 -1.26 -0.90 113.70 115.14 2nxy s SER 446 Ca -0.09 -0.56 0.09 0.00 0.48 0.00 0.00 55.95 55.87 2nxy s SER 446 Cb -0.04 -1.37 -0.05 0.00 0.10 0.00 0.00 66.02 64.66 2nxy s SER 446 CO 0.04 0.17 -0.12 -0.44 0.98 0.00 0.00 173.24 173.87 2nxy s SER 447 N 0.30 3.05 -0.25 7.02 0.01 -0.51 -4.98 113.70 118.35 2nxy s SER 447 Ca -0.18 -1.11 -0.09 0.00 1.31 0.00 0.00 55.95 55.88 2nxy s SER 447 Cb -0.18 -0.22 -0.04 0.00 0.21 0.00 0.00 66.02 65.79 2nxy s SER 447 CO 0.09 -0.18 0.14 0.20 0.41 0.00 0.00 173.24 173.89 2nxy s ASN 448 N -3.45 5.78 -0.09 2.44 0.01 -1.26 -1.16 114.94 117.21 2nxy s ASN 448 Ca 0.28 -0.01 -0.30 0.00 -0.71 0.00 0.00 52.86 52.12 2nxy s ASN 448 Cb 0.00 -2.05 -0.04 0.00 0.41 0.00 0.00 41.25 39.57 2nxy s ASN 448 CO 0.12 0.02 1.49 -0.63 -1.51 0.00 0.00 177.10 176.58 2nxy s ILE 449 N 1.33 3.85 0.00 0.60 1.01 0.12 -0.64 121.20 127.47 2nxy s ILE 449 Ca 0.06 1.05 0.00 0.00 0.00 0.00 0.00 60.65 61.76 2nxy s ILE 449 Cb -0.15 -3.68 0.00 0.00 0.01 0.00 0.00 42.46 38.65 2nxy s ILE 449 CO 0.06 -0.08 0.10 0.35 0.00 0.00 0.00 174.94 175.36 2nxy n THR 450 N 5.36 0.00 -3.82 2.92 -2.24 -0.19 -1.64 114.28 114.67 2nxy n THR 450 Ca 0.16 -0.49 -0.05 0.00 -2.27 0.00 0.00 64.05 61.39 2nxy n THR 450 Cb 0.44 1.00 -0.00 0.00 -2.10 0.00 0.00 70.33 69.67 2nxy n THR 450 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 2nxy s GLY 451 N -0.79 -0.01 0.10 3.38 0.00 -1.09 -1.11 107.32 107.80 2nxy s GLY 451 Ca 0.00 -0.25 0.02 0.00 0.00 0.00 0.00 44.72 44.49 2nxy s GLY 451 CO 0.00 0.35 -0.07 1.08 0.00 0.00 0.00 173.10 174.46 2nxy s LEU 452 N -3.05 2.51 -0.18 0.66 1.02 -0.73 -0.80 118.68 118.11 2nxy s LEU 452 Ca 0.14 -0.99 0.00 0.00 0.02 0.00 0.00 54.13 53.30 2nxy s LEU 452 Cb -0.04 -0.09 0.01 0.00 0.02 0.00 0.00 46.19 46.09 2nxy s LEU 452 CO 0.06 -0.45 -0.17 -0.76 0.02 0.00 0.00 176.35 175.05 2nxy s LEU 453 N -3.01 2.28 0.16 1.79 1.43 -0.22 -0.91 118.68 120.20 2nxy s LEU 453 Ca 0.12 -0.59 0.07 0.00 -1.03 0.00 0.00 54.13 52.69 2nxy s LEU 453 Cb 0.05 -1.52 -0.04 0.00 0.03 0.00 0.00 46.19 44.70 2nxy s LEU 453 CO -0.04 0.01 -0.16 -0.76 0.23 0.00 0.00 176.35 175.63 2nxy s LEU 454 N 1.25 2.45 0.06 1.79 1.43 -0.18 -0.47 118.68 125.02 2nxy s LEU 454 Ca 0.03 -0.88 0.05 0.00 -1.03 0.00 0.00 54.13 52.30 2nxy s LEU 454 Cb -0.14 -0.67 -0.03 0.00 0.03 0.00 0.00 46.19 45.39 2nxy s LEU 454 CO -0.10 -0.12 -0.15 0.42 0.23 0.00 0.00 176.35 176.64 2nxy s THR 455 N -2.33 1.17 -0.09 5.49 -4.23 -0.34 0.25 115.64 115.54 2nxy s THR 455 Ca 0.15 -1.17 -0.12 0.00 -1.18 0.00 0.00 61.69 59.36 2nxy s THR 455 Cb -0.04 -1.09 -0.05 0.00 1.34 0.00 0.00 72.50 72.67 2nxy s THR 455 CO 0.05 -0.09 0.28 -0.60 -0.54 0.00 0.00 174.62 173.72 2nxy s ARG 456 N -1.45 3.88 0.08 3.99 3.52 -1.26 -1.33 118.95 126.38 2nxy s ARG 456 Ca 0.01 0.13 -0.31 0.00 -0.13 0.00 0.00 55.73 55.43 2nxy s ARG 456 Cb -0.09 -3.28 -0.17 0.00 -1.56 0.00 0.00 34.95 29.85 2nxy s ARG 456 CO 0.02 0.57 1.64 -0.44 -0.81 0.00 0.00 175.30 176.28 2nxy h ASP 457 N 5.44 -0.67 0.00 -2.12 3.45 -1.00 -3.43 116.42 118.09 2nxy h ASP 457 Ca -0.49 0.03 0.00 0.00 0.43 0.00 0.00 57.03 57.00 2nxy h ASP 457 Cb 1.20 0.19 0.00 0.00 -0.56 0.00 0.00 39.33 40.16 2nxy h ASP 457 CO 0.65 -0.44 0.00 0.61 -1.57 0.00 0.00 179.24 178.49 2nxy n GLY 458 N -1.41 1.16 0.00 2.75 0.00 -1.26 -4.88 105.19 101.55 2nxy n GLY 458 Ca -0.12 -0.66 0.00 0.00 0.00 0.00 0.00 46.02 45.25 2nxy n GLY 458 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2nxy n GLY 459 N 0.00 0.71 3.56 -0.02 0.00 -1.26 -4.81 105.19 103.36 2nxy n GLY 459 Ca 0.00 -1.82 -0.35 0.00 0.00 0.00 0.00 46.02 43.85 2nxy n GLY 459 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2nxy s ASN 460 N -1.20 5.70 -0.09 1.61 -0.87 -1.26 -4.93 114.94 113.90 2nxy s ASN 460 Ca 0.00 -0.70 -0.01 0.00 -1.57 0.00 0.00 52.86 50.58 2nxy s ASN 460 Cb 0.00 -2.56 0.03 0.00 -0.02 0.00 0.00 41.25 38.70 2nxy s ASN 460 CO 0.00 -2.20 -0.03 -0.55 -2.57 0.00 0.00 177.10 171.75 2nxy s SER 461 N 6.60 1.79 0.00 -1.22 0.15 -1.26 -4.98 113.70 114.78 2nxy s SER 461 Ca 0.58 -0.17 0.05 0.00 0.70 0.00 0.00 55.95 57.10 2nxy s SER 461 Cb -0.06 -0.60 0.28 0.00 -1.71 0.00 0.00 66.02 63.92 2nxy s SER 461 CO 0.02 -0.16 1.18 -0.46 1.20 0.00 0.00 173.24 175.03 2nxy n ASN 462 N 5.01 0.02 -4.74 5.45 0.23 -1.26 -4.84 115.26 115.12 2nxy n ASN 462 Ca -0.10 -1.86 -0.41 0.00 -0.53 0.00 0.00 54.58 51.68 2nxy n ASN 462 Cb 0.50 -0.00 -0.04 0.00 -2.08 0.00 0.00 39.78 38.16 2nxy n ASN 462 CO 0.00 0.00 0.00 0.21 -0.93 0.00 0.00 177.26 176.54 2nxy s ASN 463 N -1.14 7.19 -0.28 0.53 3.84 -1.26 -4.94 114.94 118.88 2nxy s ASN 463 Ca 0.07 2.21 -0.05 0.00 0.21 0.00 0.00 52.86 55.30 2nxy s ASN 463 Cb 0.03 -2.61 -0.08 0.00 -0.55 0.00 0.00 41.25 38.04 2nxy s ASN 463 CO 0.05 -0.26 3.13 1.21 -2.79 0.00 0.00 177.10 178.45 2nxy n GLU 464 N 2.03 2.26 -3.78 0.43 4.07 -1.26 -4.84 120.64 119.55 2nxy n GLU 464 Ca 0.02 -1.79 -0.11 0.00 -0.06 0.00 0.00 57.16 55.22 2nxy n GLU 464 Cb 0.45 -2.09 -0.08 0.00 -0.06 0.00 0.00 31.44 29.66 2nxy n GLU 464 CO 0.00 0.00 0.00 -1.54 -0.06 0.00 0.00 177.13 175.53 2nxy s SER 465 N 1.05 -0.10 -0.02 4.31 1.04 -1.26 -1.71 113.70 117.01 2nxy s SER 465 Ca 0.62 -0.20 0.07 0.00 0.48 0.00 0.00 55.95 56.93 2nxy s SER 465 Cb 0.35 0.33 -0.02 0.00 0.10 0.00 0.00 66.02 66.79 2nxy s SER 465 CO -0.13 -0.58 -0.24 -1.61 0.98 0.00 0.00 173.24 171.67 2nxy s GLU 466 N -2.39 1.96 -0.15 4.02 0.41 -0.11 -4.91 118.70 117.53 2nxy s GLU 466 Ca -0.06 -0.84 -0.03 0.00 -0.41 0.00 0.00 54.97 53.63 2nxy s GLU 466 Cb -0.02 -1.87 -0.03 0.00 -1.78 0.00 0.00 34.13 30.44 2nxy s GLU 466 CO -0.02 0.49 -0.06 0.42 -0.49 0.00 0.00 175.26 175.60 2nxy s ILE 467 N -0.51 3.73 -0.06 -1.63 1.01 -1.26 -1.06 121.20 121.42 2nxy s ILE 467 Ca 0.08 -0.42 0.05 0.00 0.00 0.00 0.00 60.65 60.36 2nxy s ILE 467 Cb -0.09 -2.62 -0.01 0.00 0.01 0.00 0.00 42.46 39.75 2nxy s ILE 467 CO -0.01 0.50 -0.22 -0.36 0.00 0.00 0.00 174.94 174.86 2nxy s PHE 468 N 0.32 2.16 0.12 3.97 0.40 0.42 -0.35 117.98 125.01 2nxy s PHE 468 Ca -0.05 -0.66 0.08 0.00 -0.60 0.00 0.00 56.93 55.70 2nxy s PHE 468 Cb -0.14 -1.43 -0.04 0.00 0.51 0.00 0.00 43.02 41.92 2nxy s PHE 468 CO 0.03 -0.21 -0.20 1.03 0.70 0.00 0.00 175.22 176.57 2nxy s ARG 469 N -0.04 1.15 0.53 0.44 0.52 -0.45 -1.35 118.95 119.76 2nxy s ARG 469 Ca -0.05 -1.21 -0.21 0.00 -0.52 0.00 0.00 55.73 53.73 2nxy s ARG 469 Cb -0.13 -1.36 -0.05 0.00 0.52 0.00 0.00 34.95 33.93 2nxy s ARG 469 CO 0.04 0.31 1.26 -1.25 0.02 0.00 0.00 175.30 175.67 2nxy s PRO 470 N -2.12 3.29 0.00 3.54 0.04 -1.26 -1.20 135.00 137.29 2nxy s PRO 470 Ca 0.08 2.00 0.00 0.00 0.04 0.00 0.00 61.00 63.12 2nxy s PRO 470 Cb -0.09 -2.23 0.00 0.00 0.04 0.00 0.00 34.50 32.22 2nxy s PRO 470 CO 0.05 -1.00 0.00 0.41 0.04 0.00 0.00 177.00 176.50 2nxy n GLY 471 N 0.59 5.16 0.00 0.56 0.00 0.38 -4.60 105.19 107.28 2nxy n GLY 471 Ca 0.10 -0.93 0.00 0.00 0.00 0.00 0.00 46.02 45.19 2nxy n GLY 471 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2nxy n GLY 472 N 0.00 -2.25 0.00 -0.02 0.00 -1.26 -0.60 105.19 101.06 2nxy n GLY 472 Ca 0.00 -2.13 0.00 0.00 0.00 0.00 0.00 46.02 43.89 2nxy n GLY 472 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2nxy n GLY 473 N -0.09 3.64 3.54 -0.02 0.00 -1.26 -4.88 105.19 106.12 2nxy n GLY 473 Ca 0.00 -0.99 -0.43 0.00 0.00 0.00 0.00 46.02 44.60 2nxy n GLY 473 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2nxy s ASP 474 N 0.00 6.39 0.06 1.61 -1.08 -1.26 -4.90 116.67 117.50 2nxy s ASP 474 Ca 0.00 -0.16 0.13 0.00 -0.52 0.00 0.00 52.55 52.00 2nxy s ASP 474 Cb 0.00 -2.47 0.56 0.00 -1.46 0.00 0.00 42.92 39.56 2nxy s ASP 474 CO 0.00 -1.26 1.40 0.23 0.52 0.00 0.00 175.17 176.06 2nxy n MET 475 N 7.66 0.04 0.12 4.34 2.81 -1.26 -1.52 117.12 129.30 2nxy n MET 475 Ca 0.04 0.36 0.02 0.00 -1.81 0.00 0.00 57.70 56.32 2nxy n MET 475 Cb 0.48 -1.59 0.39 0.00 -0.71 0.00 0.00 33.22 31.79 2nxy n MET 475 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2nxy h ARG 476 N 0.00 0.23 -0.68 0.03 3.08 -1.94 -1.96 114.38 113.14 2nxy h ARG 476 Ca 0.00 -0.05 -0.07 0.00 0.07 0.00 0.00 59.98 59.93 2nxy h ARG 476 Cb 0.19 -0.03 -0.03 0.00 0.08 0.00 0.00 29.97 30.18 2nxy h ARG 476 CO 0.00 0.37 0.15 -0.44 -1.07 0.00 0.00 179.97 178.98 2nxy h ASP 477 N 0.22 1.04 -0.51 7.04 3.32 -1.69 0.22 116.42 126.05 2nxy h ASP 477 Ca 0.05 -0.23 0.04 0.00 0.02 0.00 0.00 57.03 56.91 2nxy h ASP 477 Cb 0.37 -0.28 -0.04 0.00 0.22 0.00 0.00 39.33 39.60 2nxy h ASP 477 CO 0.02 1.01 0.27 0.78 -1.72 0.00 0.00 179.24 179.60 2nxy h ASN 478 N 1.04 0.40 -0.09 6.45 4.21 -1.52 -1.40 115.58 124.66 2nxy h ASN 478 Ca 0.21 0.02 -0.16 0.00 1.21 0.00 0.00 56.30 57.59 2nxy h ASN 478 Cb 0.39 -0.05 -0.01 0.00 -1.12 0.00 0.00 38.32 37.53 2nxy h ASN 478 CO 0.01 0.28 -0.49 -0.50 -1.29 0.00 0.00 177.43 175.44 2nxy h TRP 479 N 0.53 0.81 -0.75 1.19 -0.00 -0.97 -2.90 115.95 113.85 2nxy h TRP 479 Ca 0.22 -0.27 0.06 0.00 -0.00 0.00 0.00 58.89 58.91 2nxy h TRP 479 Cb 0.11 -0.16 -0.05 0.00 -0.00 0.00 0.00 29.16 29.06 2nxy h TRP 479 CO -0.09 1.01 0.49 0.00 -0.00 0.00 0.00 178.44 179.86 2nxy h ARG 480 N 0.52 0.79 0.00 0.49 3.08 -0.34 -1.06 114.38 117.86 2nxy h ARG 480 Ca 0.02 -0.05 -0.00 0.00 0.07 0.00 0.00 59.98 60.03 2nxy h ARG 480 Cb 1.04 -0.18 -0.00 0.00 0.08 0.00 0.00 29.97 30.91 2nxy h ARG 480 CO 0.10 0.52 -0.00 0.66 -1.07 0.00 0.00 179.97 180.18 2nxy h SER 481 N 0.81 0.00 0.00 7.04 4.64 -1.04 -1.55 113.55 123.46 2nxy h SER 481 Ca 0.32 0.00 -0.29 0.00 -0.47 0.00 0.00 61.79 61.35 2nxy h SER 481 Cb 0.23 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 62.27 2nxy h SER 481 CO -0.11 0.00 -2.09 -0.62 -0.87 0.00 0.00 176.83 173.14 2nxy n GLU 482 N -3.22 1.14 -0.04 4.77 -0.58 -0.85 -4.66 120.64 117.19 2nxy n GLU 482 Ca -0.03 0.03 0.12 0.00 -0.42 0.00 0.00 57.16 56.87 2nxy n GLU 482 Cb 0.07 -1.40 0.28 0.00 -0.57 0.00 0.00 31.44 29.83 2nxy n GLU 482 CO 0.00 0.00 0.00 1.28 -0.48 0.00 0.00 177.13 177.93 2nxy n LEU 483 N -2.75 2.45 0.23 -4.62 4.77 -0.46 -4.46 117.00 112.17 2nxy n LEU 483 Ca -0.29 -0.89 0.17 0.00 -0.03 0.00 0.00 56.01 54.97 2nxy n LEU 483 Cb 0.96 -0.06 0.87 0.00 -2.33 0.00 0.00 43.42 42.87 2nxy n LEU 483 CO 0.29 0.45 1.15 0.10 -1.33 0.00 0.00 177.39 178.04 2nxy h TYR 484 N 3.64 0.00 -0.14 -1.77 -0.00 -1.55 -1.79 116.97 115.36 2nxy h TYR 484 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.73 2nxy h TYR 484 Cb 0.78 0.00 0.00 0.00 0.00 0.00 0.00 36.73 37.51 2nxy h TYR 484 CO 0.06 0.00 0.00 0.36 -0.00 0.00 0.00 178.16 178.58 2nxy n LYS 485 N -3.66 2.18 -4.30 0.10 2.85 -1.26 -4.62 118.16 109.44 2nxy n LYS 485 Ca 0.01 -1.74 -0.28 0.00 -1.05 0.00 0.00 58.31 55.25 2nxy n LYS 485 Cb 0.29 -1.47 -0.10 0.00 -0.65 0.00 0.00 35.03 33.10 2nxy n LYS 485 CO 0.00 0.00 0.00 0.71 -0.05 0.00 0.00 177.40 178.06 2nxy s TYR 486 N -1.85 2.58 0.03 5.58 1.51 -0.67 -0.84 117.35 123.69 2nxy s TYR 486 Ca 0.33 -0.24 -0.11 0.00 -1.01 0.00 0.00 57.07 56.04 2nxy s TYR 486 Cb 0.21 -1.29 0.01 0.00 -0.11 0.00 0.00 41.96 40.77 2nxy s TYR 486 CO 0.31 0.48 0.24 -1.59 -1.11 0.00 0.00 175.55 173.87 2nxy s LYS 487 N -2.61 0.70 -0.19 -0.62 -2.85 -0.52 -4.97 119.74 108.68 2nxy s LYS 487 Ca 0.23 -0.51 -0.06 0.00 -1.00 0.00 0.00 55.97 54.63 2nxy s LYS 487 Cb -0.09 0.30 -0.03 0.00 -2.06 0.00 0.00 37.83 35.94 2nxy s LYS 487 CO 0.13 -0.21 0.02 0.08 0.10 0.00 0.00 175.35 175.48 2nxy s VAL 488 N -2.27 4.26 0.04 1.79 1.01 -1.26 -0.56 120.40 123.41 2nxy s VAL 488 Ca -0.07 -0.21 0.08 0.00 0.00 0.00 0.00 61.98 61.77 2nxy s VAL 488 Cb -0.02 -2.92 -0.03 0.00 0.00 0.00 0.00 36.38 33.41 2nxy s VAL 488 CO -0.02 0.44 -0.23 0.68 0.00 0.00 0.00 175.10 175.97 2nxy s VAL 489 N 0.77 1.85 0.07 2.92 -7.23 -0.11 -4.94 120.40 113.74 2nxy s VAL 489 Ca 0.01 -1.25 -0.28 0.00 -1.81 0.00 0.00 61.98 58.65 2nxy s VAL 489 Cb -0.14 -1.59 -0.05 0.00 0.56 0.00 0.00 36.38 35.15 2nxy s VAL 489 CO 0.02 0.29 0.90 -1.59 -0.31 0.00 0.00 175.10 174.41 2nxy s LYS 490 N -1.15 4.62 0.00 4.82 -2.85 -1.26 0.13 119.74 124.04 2nxy s LYS 490 Ca 0.09 1.32 0.21 0.00 -1.00 0.00 0.00 55.97 56.59 2nxy s LYS 490 Cb -0.09 -3.38 1.26 0.00 -2.06 0.00 0.00 37.83 33.56 2nxy s LYS 490 CO 0.02 0.20 1.65 -0.89 0.10 0.00 0.00 175.35 176.42