#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wgx s PRO 98 N 0.00 3.44 0.44 5.55 0.02 -1.26 -4.95 135.00 138.24 2wgx s PRO 98 Ca 0.00 2.23 -0.25 0.00 0.02 0.00 0.00 61.00 63.00 2wgx s PRO 98 Cb 0.00 -2.43 -0.08 0.00 0.02 0.00 0.00 34.50 32.01 2wgx s PRO 98 CO 0.00 -0.95 1.27 0.45 -0.33 0.00 0.00 177.00 177.44 2wgx s SER 99 N -0.85 6.15 -0.00 2.53 0.15 -1.26 -4.93 113.70 115.49 2wgx s SER 99 Ca 0.66 2.57 0.09 0.00 0.70 0.00 0.00 55.95 59.97 2wgx s SER 99 Cb -0.40 -2.63 0.25 0.00 -1.71 0.00 0.00 66.02 61.53 2wgx s SER 99 CO 0.49 -0.95 1.21 0.00 1.20 0.00 0.00 173.24 175.18 2wgx n GLN 100 N -0.17 2.90 -2.18 5.44 10.64 -1.26 -5.03 117.38 127.72 2wgx n GLN 100 Ca 0.05 -1.95 -0.42 0.00 -1.83 0.00 0.00 57.00 52.86 2wgx n GLN 100 Cb 0.45 -1.22 -0.03 0.00 -0.86 0.00 0.00 30.24 28.58 2wgx n GLN 100 CO 0.00 0.00 0.00 0.15 -1.83 0.00 0.00 177.06 175.38 2wgx s LYS 101 N -1.01 4.29 0.27 2.61 -0.14 -1.26 -4.79 119.74 119.70 2wgx s LYS 101 Ca 0.19 2.04 -0.31 0.00 -1.36 0.00 0.00 55.97 56.53 2wgx s LYS 101 Cb 0.10 -3.48 -0.12 0.00 -1.68 0.00 0.00 37.83 32.65 2wgx s LYS 101 CO 0.13 -0.55 1.63 2.41 -0.76 0.00 0.00 175.35 178.20 2wgx n THR 102 N 4.46 0.73 -3.30 2.17 -1.04 -1.26 -4.74 114.28 111.30 2wgx n THR 102 Ca 0.13 -0.18 -0.08 0.00 -2.04 0.00 0.00 64.05 61.88 2wgx n THR 102 Cb 0.43 -1.96 -0.06 0.00 -1.82 0.00 0.00 70.33 66.92 2wgx n THR 102 CO 0.00 0.00 0.00 -0.47 -0.64 0.00 0.00 175.07 173.96 2wgx s TYR 103 N 0.32 -1.03 0.28 -1.42 5.04 -0.39 -4.96 117.35 115.19 2wgx s TYR 103 Ca 0.67 0.52 0.06 0.00 -2.44 0.00 0.00 57.07 55.88 2wgx s TYR 103 Cb -0.50 -0.07 0.39 0.00 0.35 0.00 0.00 41.96 42.13 2wgx s TYR 103 CO 0.44 -0.93 1.66 1.96 -1.34 0.00 0.00 175.55 177.34 2wgx h GLN 104 N 8.15 0.25 0.00 4.97 4.20 -1.78 0.31 115.11 131.21 2wgx h GLN 104 Ca -0.11 -0.13 0.02 0.00 0.06 0.00 0.00 58.65 58.48 2wgx h GLN 104 Cb 1.13 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.91 2wgx h GLN 104 CO 0.26 0.67 -0.03 0.41 -0.67 0.00 0.00 178.83 179.47 2wgx n GLY 105 N -0.05 -1.48 0.24 3.46 0.00 -1.26 -0.69 105.19 105.41 2wgx n GLY 105 Ca -0.02 -1.19 0.07 0.00 0.00 0.00 0.00 46.02 44.89 2wgx n GLY 105 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2wgx h SER 106 N -0.07 0.00 -0.15 1.61 0.02 -1.95 -2.75 113.55 110.25 2wgx h SER 106 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2wgx h SER 106 Cb 0.07 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.61 2wgx h SER 106 CO 0.00 0.13 0.00 -1.22 -1.14 0.00 0.00 176.83 174.60 2wgx n TYR 107 N -4.27 0.18 -3.04 3.45 4.01 -1.26 -4.85 117.16 111.39 2wgx n TYR 107 Ca -0.03 -0.09 -0.13 0.00 -0.16 0.00 0.00 57.90 57.50 2wgx n TYR 107 Cb 0.20 0.00 0.06 0.00 -0.31 0.00 0.00 39.34 39.29 2wgx n TYR 107 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2wgx n GLY 108 N 1.29 -0.10 3.72 2.72 0.00 -1.04 0.07 105.19 111.85 2wgx n GLY 108 Ca 0.17 -0.07 -0.42 0.00 0.00 0.00 0.00 46.02 45.70 2wgx n GLY 108 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2wgx s PHE 109 N -3.24 3.68 0.15 1.61 5.36 0.14 -3.29 117.98 122.38 2wgx s PHE 109 Ca 0.09 1.66 -0.22 0.00 -0.96 0.00 0.00 56.93 57.51 2wgx s PHE 109 Cb -0.04 -3.06 0.06 0.00 -0.34 0.00 0.00 43.02 39.64 2wgx s PHE 109 CO 0.50 0.05 0.55 -0.98 -1.46 0.00 0.00 175.22 173.88 2wgx s ARG 110 N 0.76 1.22 0.55 10.12 3.03 -0.36 -4.30 118.95 129.98 2wgx s ARG 110 Ca 0.49 -0.51 -0.04 0.00 2.03 0.00 0.00 55.73 57.70 2wgx s ARG 110 Cb -0.21 0.56 0.00 0.00 -1.03 0.00 0.00 34.95 34.27 2wgx s ARG 110 CO 0.27 -0.52 0.84 -0.51 -1.13 0.00 0.00 175.30 174.25 2wgx s LEU 111 N -2.73 3.37 0.11 -1.89 1.43 -1.26 -0.69 118.68 117.02 2wgx s LEU 111 Ca 0.01 0.64 -0.07 0.00 -1.03 0.00 0.00 54.13 53.69 2wgx s LEU 111 Cb -0.00 -3.50 -0.01 0.00 0.03 0.00 0.00 46.19 42.71 2wgx s LEU 111 CO -0.12 -0.93 0.17 -0.83 0.23 0.00 0.00 176.35 174.87 2wgx s GLY 112 N -4.26 0.36 0.02 -3.19 0.00 -0.46 -4.84 107.32 94.95 2wgx s GLY 112 Ca 0.52 -0.88 0.02 0.00 0.00 0.00 0.00 44.72 44.37 2wgx s GLY 112 CO 0.43 -0.95 -0.06 -1.36 0.00 0.00 0.00 173.10 171.16 2wgx s PHE 113 N -3.92 0.52 0.92 1.90 0.08 -1.26 -0.72 117.98 115.49 2wgx s PHE 113 Ca 0.11 -0.36 -0.10 0.00 0.12 0.00 0.00 56.93 56.69 2wgx s PHE 113 Cb 0.05 -0.32 0.15 0.00 -0.57 0.00 0.00 43.02 42.33 2wgx s PHE 113 CO -0.06 -0.07 1.12 -0.51 -0.10 0.00 0.00 175.22 175.60 2wgx s LEU 114 N -1.08 2.62 -0.68 -0.37 1.43 -1.26 -4.97 118.68 114.36 2wgx s LEU 114 Ca -0.07 2.02 -0.11 0.00 -1.03 0.00 0.00 54.13 54.94 2wgx s LEU 114 Cb -0.07 -4.40 0.18 0.00 0.03 0.00 0.00 46.19 41.92 2wgx s LEU 114 CO 0.00 -3.05 0.58 -1.00 0.23 0.00 0.00 176.35 173.11 2wgx s HIS 115 N -2.68 3.55 -1.73 0.29 3.76 -1.26 -4.55 115.29 112.67 2wgx s HIS 115 Ca 0.66 -2.03 0.23 0.00 -0.15 0.00 0.00 55.06 53.76 2wgx s HIS 115 Cb -0.22 -3.62 0.02 0.00 1.11 0.00 0.00 32.58 29.87 2wgx s HIS 115 CO 0.58 -0.96 1.10 0.43 -0.85 0.00 0.00 174.74 175.04 2wgx n SER 116 N 4.22 1.65 -0.19 1.40 7.64 -1.26 -5.08 113.62 121.99 2wgx n SER 116 Ca 0.04 -1.30 0.01 0.00 1.01 0.00 0.00 58.87 58.63 2wgx n SER 116 Cb 0.43 0.57 -0.00 0.00 -1.01 0.00 0.00 64.21 64.19 2wgx n SER 116 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2wgx n GLY 117 N 1.44 -1.95 0.59 0.23 0.00 -1.26 -4.70 105.19 99.53 2wgx n GLY 117 Ca 0.08 -1.37 0.05 0.00 0.00 0.00 0.00 46.02 44.78 2wgx n GLY 117 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2wgx n THR 118 N -0.57 0.94 -1.69 2.61 -2.24 -1.26 -4.79 114.28 107.28 2wgx n THR 118 Ca 0.00 -1.43 -0.41 0.00 -2.27 0.00 0.00 64.05 59.94 2wgx n THR 118 Cb 0.02 0.25 0.01 0.00 -2.10 0.00 0.00 70.33 68.51 2wgx n THR 118 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2wgx n ALA 119 N -0.52 1.11 0.32 6.98 0.00 -1.26 -4.27 120.51 122.87 2wgx n ALA 119 Ca 0.09 0.27 0.20 0.00 0.00 0.00 0.00 53.44 54.00 2wgx n ALA 119 Cb 0.77 -2.24 1.08 0.00 0.00 0.00 0.00 19.45 19.07 2wgx n ALA 119 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 2wgx h LYS 120 N 2.05 0.00 0.00 0.00 1.57 -1.97 0.55 116.57 118.76 2wgx h LYS 120 Ca -0.47 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.31 2wgx h LYS 120 Cb 1.30 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.61 2wgx h LYS 120 CO 0.60 0.00 -0.18 -1.13 -0.57 0.00 0.00 179.45 178.17 2wgx n SER 121 N -3.26 0.56 -4.77 0.86 3.41 -1.26 -4.75 113.62 104.42 2wgx n SER 121 Ca -0.02 0.39 -0.40 0.00 -0.26 0.00 0.00 58.87 58.57 2wgx n SER 121 Cb 0.14 -0.43 -0.00 0.00 -0.26 0.00 0.00 64.21 63.65 2wgx n SER 121 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2wgx s VAL 122 N -3.08 2.35 -0.18 -3.33 0.11 0.18 -4.92 120.40 111.53 2wgx s VAL 122 Ca 0.11 0.34 0.22 0.00 -2.93 0.00 0.00 61.98 59.71 2wgx s VAL 122 Cb 0.15 -3.21 -0.29 0.00 -1.53 0.00 0.00 36.38 31.50 2wgx s VAL 122 CO 0.62 0.07 0.60 0.35 -3.33 0.00 0.00 175.10 173.41 2wgx n THR 123 N 0.39 0.06 -3.66 5.04 -2.24 -1.26 -4.44 114.28 108.18 2wgx n THR 123 Ca 0.02 -0.44 -0.07 0.00 -2.27 0.00 0.00 64.05 61.28 2wgx n THR 123 Cb 0.41 0.08 -0.08 0.00 -2.10 0.00 0.00 70.33 68.65 2wgx n THR 123 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2wgx s THR 125 N 1.72 0.00 -0.10 0.00 -1.32 0.04 -4.75 115.64 111.22 2wgx s THR 125 Ca -0.09 -0.01 -0.01 0.00 -1.21 0.00 0.00 61.69 60.37 2wgx s THR 125 Cb -0.07 -0.54 -0.03 0.00 -1.51 0.00 0.00 72.50 70.35 2wgx s THR 125 CO -0.18 -0.01 -0.07 -0.47 -2.21 0.00 0.00 174.62 171.69 2wgx s TYR 126 N 0.15 2.94 -0.38 9.09 5.04 -1.26 -0.53 117.35 132.40 2wgx s TYR 126 Ca -0.00 -0.16 -0.11 0.00 -2.44 0.00 0.00 57.07 54.36 2wgx s TYR 126 Cb -0.03 -1.80 0.03 0.00 0.35 0.00 0.00 41.96 40.51 2wgx s TYR 126 CO 0.01 0.15 0.21 0.45 -1.34 0.00 0.00 175.55 175.02 2wgx s SER 127 N -0.31 5.72 0.30 4.32 0.15 0.22 -4.90 113.70 119.20 2wgx s SER 127 Ca 0.04 -1.03 0.01 0.00 0.70 0.00 0.00 55.95 55.67 2wgx s SER 127 Cb -0.13 -2.02 0.48 0.00 -1.71 0.00 0.00 66.02 62.65 2wgx s SER 127 CO 0.02 -0.40 1.84 -0.65 1.20 0.00 0.00 173.24 175.26 2wgx h PRO 128 N 8.43 0.70 -0.14 5.44 0.11 -1.96 0.48 132.00 145.06 2wgx h PRO 128 Ca -0.25 -0.15 -0.05 0.00 0.11 0.00 0.00 66.00 65.66 2wgx h PRO 128 Cb 1.10 -0.10 -0.01 0.00 0.11 0.00 0.00 31.00 32.10 2wgx h PRO 128 CO 0.67 0.67 -0.16 0.00 -0.21 0.00 0.00 178.00 178.97 2wgx h ALA 129 N 1.40 1.48 -0.01 -0.75 0.00 -1.96 -2.67 119.26 116.75 2wgx h ALA 129 Ca 0.15 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.83 2wgx h ALA 129 Cb 0.31 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.02 2wgx h ALA 129 CO 0.00 0.37 -0.50 1.28 0.00 0.00 0.00 179.25 180.40 2wgx n LEU 130 N -4.25 1.96 -4.11 0.00 4.77 -1.10 -4.98 117.00 109.29 2wgx n LEU 130 Ca -0.01 -0.75 -0.36 0.00 -0.03 0.00 0.00 56.01 54.86 2wgx n LEU 130 Cb 0.29 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.35 2wgx n LEU 130 CO 0.38 0.37 -0.28 -3.20 -1.33 0.00 0.00 177.39 173.33 2wgx n ASN 131 N -0.11 -1.77 -3.74 -1.43 5.15 0.09 -4.82 115.26 108.64 2wgx n ASN 131 Ca 0.09 -1.22 -0.16 0.00 -0.60 0.00 0.00 54.58 52.69 2wgx n ASN 131 Cb 0.46 -2.01 -0.16 0.00 -0.53 0.00 0.00 39.78 37.53 2wgx n ASN 131 CO 0.00 0.00 0.00 -0.75 1.40 0.00 0.00 177.26 177.91 2wgx s LYS 132 N -7.15 -0.02 -0.06 1.20 2.20 -0.78 -1.04 119.74 114.09 2wgx s LYS 132 Ca 0.23 0.29 -0.14 0.00 -0.36 0.00 0.00 55.97 55.99 2wgx s LYS 132 Cb -0.12 -0.29 -0.05 0.00 -1.51 0.00 0.00 37.83 35.86 2wgx s LYS 132 CO 0.96 -0.21 0.37 -1.17 -0.36 0.00 0.00 175.35 174.94 2wgx s LEU 133 N 1.40 4.39 -0.13 5.43 2.96 0.87 -0.61 118.68 132.99 2wgx s LEU 133 Ca -0.05 0.80 0.01 0.00 -0.22 0.00 0.00 54.13 54.67 2wgx s LEU 133 Cb -0.12 -2.51 -0.01 0.00 0.50 0.00 0.00 46.19 44.05 2wgx s LEU 133 CO -0.04 0.24 -0.17 -0.36 -1.32 0.00 0.00 176.35 174.71 2wgx s PHE 134 N -0.52 2.73 0.13 5.38 0.40 0.31 -0.69 117.98 125.71 2wgx s PHE 134 Ca 0.22 -0.89 -0.08 0.00 -0.60 0.00 0.00 56.93 55.58 2wgx s PHE 134 Cb -0.15 -1.82 -0.01 0.00 0.51 0.00 0.00 43.02 41.55 2wgx s PHE 134 CO 0.10 -0.36 0.22 0.00 0.70 0.00 0.00 175.22 175.89 2wgx s GLN 136 N -3.92 3.49 -0.01 0.00 -0.21 -0.42 -0.56 119.66 118.03 2wgx s GLN 136 Ca 0.12 0.28 -0.34 0.00 0.02 0.00 0.00 55.36 55.43 2wgx s GLN 136 Cb 0.04 -2.31 -0.13 0.00 1.00 0.00 0.00 33.01 31.62 2wgx s GLN 136 CO -0.05 -0.32 1.77 -0.11 -2.12 0.00 0.00 175.29 174.45 2wgx n LEU 137 N -2.38 3.26 -0.28 2.90 7.94 -1.26 -2.78 117.00 124.40 2wgx n LEU 137 Ca 0.02 1.01 -0.04 0.00 -1.11 0.00 0.00 56.01 55.90 2wgx n LEU 137 Cb 0.55 -1.38 -0.02 0.00 0.53 0.00 0.00 43.42 43.11 2wgx n LEU 137 CO 0.54 -0.16 -0.03 0.00 -1.11 0.00 0.00 177.39 176.62 2wgx n ALA 138 N 5.46 -0.05 -2.10 1.96 0.00 0.17 -4.97 120.51 120.97 2wgx n ALA 138 Ca 0.21 0.06 -0.29 0.00 0.00 0.00 0.00 53.44 53.42 2wgx n ALA 138 Cb 0.29 -1.46 0.01 0.00 0.00 0.00 0.00 19.45 18.28 2wgx n ALA 138 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 2wgx s LYS 139 N -2.15 3.48 0.12 0.00 -0.14 -1.12 -4.79 119.74 115.15 2wgx s LYS 139 Ca 0.00 0.38 -0.31 0.00 -1.36 0.00 0.00 55.97 54.68 2wgx s LYS 139 Cb 0.00 -2.25 -0.10 0.00 -1.68 0.00 0.00 37.83 33.80 2wgx s LYS 139 CO 0.00 -0.41 1.72 0.99 -0.76 0.00 0.00 175.35 176.89 2wgx s THR 140 N -2.94 2.66 -0.32 2.17 2.01 -1.26 -4.42 115.64 113.54 2wgx s THR 140 Ca 0.51 0.26 0.03 0.00 0.31 0.00 0.00 61.69 62.79 2wgx s THR 140 Cb -0.11 -3.17 0.09 0.00 0.01 0.00 0.00 72.50 69.33 2wgx s THR 140 CO 0.48 0.01 0.04 0.00 -0.69 0.00 0.00 174.62 174.46 2wgx s PRO 142 N 1.10 4.51 -0.09 0.00 0.02 -1.26 -0.85 135.00 138.44 2wgx s PRO 142 Ca 0.08 1.69 0.02 0.00 0.02 0.00 0.00 61.00 62.81 2wgx s PRO 142 Cb -0.19 -3.34 0.01 0.00 0.02 0.00 0.00 34.50 31.01 2wgx s PRO 142 CO -0.11 -0.10 -0.13 0.08 -0.33 0.00 0.00 177.00 176.40 2wgx s VAL 143 N 0.58 1.28 0.11 3.83 1.01 0.10 -4.64 120.40 122.66 2wgx s VAL 143 Ca 0.54 -0.53 -0.11 0.00 0.00 0.00 0.00 61.98 61.87 2wgx s VAL 143 Cb -0.28 -1.18 -0.06 0.00 0.00 0.00 0.00 36.38 34.86 2wgx s VAL 143 CO 0.31 0.39 0.46 -1.10 0.00 0.00 0.00 175.10 175.16 2wgx s GLN 144 N 0.86 3.84 -0.19 2.72 -0.21 0.10 -0.85 119.66 125.93 2wgx s GLN 144 Ca -0.10 0.29 -0.02 0.00 0.02 0.00 0.00 55.36 55.55 2wgx s GLN 144 Cb -0.15 -2.96 -0.01 0.00 1.00 0.00 0.00 33.01 30.89 2wgx s GLN 144 CO 0.01 0.52 -0.09 -0.51 -2.12 0.00 0.00 175.29 173.10 2wgx s LEU 145 N -1.98 2.77 -0.09 2.90 1.43 0.17 -1.36 118.68 122.52 2wgx s LEU 145 Ca 0.35 -0.39 0.03 0.00 -1.03 0.00 0.00 54.13 53.09 2wgx s LEU 145 Cb -0.14 -1.67 -0.02 0.00 0.03 0.00 0.00 46.19 44.39 2wgx s LEU 145 CO 0.19 0.05 -0.16 0.26 0.23 0.00 0.00 176.35 176.91 2wgx s TRP 146 N 1.06 2.69 0.09 0.29 0.52 0.13 -2.00 118.94 121.72 2wgx s TRP 146 Ca 0.00 -0.52 0.04 0.00 0.02 0.00 0.00 56.10 55.65 2wgx s TRP 146 Cb -0.15 -1.72 -0.03 0.00 -1.15 0.00 0.00 33.47 30.42 2wgx s TRP 146 CO -0.01 -0.09 -0.11 0.14 0.02 0.00 0.00 176.95 176.90 2wgx s VAL 147 N -0.11 0.96 0.10 4.03 -7.23 -1.26 -1.22 120.40 115.66 2wgx s VAL 147 Ca -0.02 -1.59 0.02 0.00 -1.81 0.00 0.00 61.98 58.58 2wgx s VAL 147 Cb -0.14 -1.31 -0.24 0.00 0.56 0.00 0.00 36.38 35.25 2wgx s VAL 147 CO 0.04 -0.51 1.21 0.44 -0.31 0.00 0.00 175.10 175.97 2wgx h ASP 148 N 3.67 0.19 -5.12 4.85 3.32 -0.36 -3.47 116.42 119.50 2wgx h ASP 148 Ca -0.38 -0.20 -0.14 0.00 0.02 0.00 0.00 57.03 56.33 2wgx h ASP 148 Cb 1.19 -0.06 -0.17 0.00 0.22 0.00 0.00 39.33 40.50 2wgx h ASP 148 CO 0.51 1.16 -0.64 -0.94 -1.72 0.00 0.00 179.24 177.61 2wgx s SER 149 N -6.90 0.34 -0.17 6.45 1.04 -1.10 -5.03 113.70 108.33 2wgx s SER 149 Ca -0.01 -0.74 -0.29 0.00 0.48 0.00 0.00 55.95 55.39 2wgx s SER 149 Cb 0.09 0.18 -0.01 0.00 0.10 0.00 0.00 66.02 66.37 2wgx s SER 149 CO 0.85 -0.49 1.20 -0.89 0.98 0.00 0.00 173.24 174.89 2wgx s THR 150 N -2.87 4.37 0.82 2.02 2.01 -1.26 -4.79 115.64 115.94 2wgx s THR 150 Ca -0.03 1.67 -0.11 0.00 0.31 0.00 0.00 61.69 63.52 2wgx s THR 150 Cb 0.00 -4.07 0.08 0.00 0.01 0.00 0.00 72.50 68.52 2wgx s THR 150 CO -0.06 -0.13 1.09 -2.16 -0.69 0.00 0.00 174.62 172.67 2wgx s PRO 151 N 3.27 1.89 0.67 4.92 0.04 -1.26 -4.98 135.00 139.54 2wgx s PRO 151 Ca 0.52 0.79 -0.17 0.00 0.04 0.00 0.00 61.00 62.19 2wgx s PRO 151 Cb -0.20 -1.88 0.00 0.00 0.04 0.00 0.00 34.50 32.46 2wgx s PRO 151 CO 0.14 -1.80 1.22 -2.14 0.04 0.00 0.00 177.00 174.46 2wgx s PRO 152 N -5.04 2.52 0.26 0.56 0.02 -1.26 -4.90 135.00 127.16 2wgx s PRO 152 Ca 0.61 1.81 -0.31 0.00 0.02 0.00 0.00 61.00 63.14 2wgx s PRO 152 Cb -0.16 -1.87 -0.13 0.00 0.02 0.00 0.00 34.50 32.36 2wgx s PRO 152 CO 0.55 -1.56 1.40 -2.30 -0.33 0.00 0.00 177.00 174.77 2wgx n PRO 153 N -2.20 2.09 0.00 5.54 -0.02 -1.26 -1.54 135.00 137.61 2wgx n PRO 153 Ca 0.14 0.74 0.00 0.00 -2.02 0.00 0.00 63.50 62.36 2wgx n PRO 153 Cb 0.50 -2.39 0.00 0.00 -0.02 0.00 0.00 33.50 31.58 2wgx n PRO 153 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2wgx n GLY 154 N 1.97 1.40 3.76 -1.23 0.00 -1.26 -4.96 105.19 104.87 2wgx n GLY 154 Ca 0.10 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.73 2wgx n GLY 154 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2wgx s THR 155 N -2.30 2.18 0.28 2.61 2.01 -0.59 -3.40 115.64 116.44 2wgx s THR 155 Ca 0.00 0.15 0.06 0.00 0.31 0.00 0.00 61.69 62.21 2wgx s THR 155 Cb 0.00 -3.09 -0.06 0.00 0.01 0.00 0.00 72.50 69.37 2wgx s THR 155 CO 0.00 0.01 -0.03 -0.13 -0.69 0.00 0.00 174.62 173.78 2wgx s ARG 156 N -2.58 1.54 -0.13 4.92 0.52 0.23 -0.37 118.95 123.08 2wgx s ARG 156 Ca 0.64 -1.79 -0.01 0.00 -0.52 0.00 0.00 55.73 54.05 2wgx s ARG 156 Cb -0.41 -1.05 0.04 0.00 0.52 0.00 0.00 34.95 34.04 2wgx s ARG 156 CO 0.52 -0.01 -0.04 0.08 0.02 0.00 0.00 175.30 175.87 2wgx s VAL 157 N -3.10 0.88 -0.04 3.52 1.01 0.85 -0.73 120.40 122.78 2wgx s VAL 157 Ca 0.30 -0.37 0.02 0.00 0.00 0.00 0.00 61.98 61.93 2wgx s VAL 157 Cb 0.05 -1.04 -0.03 0.00 0.00 0.00 0.00 36.38 35.36 2wgx s VAL 157 CO 0.12 0.19 -0.07 -0.60 0.00 0.00 0.00 175.10 174.74 2wgx s ARG 158 N 1.75 2.66 -0.05 2.72 3.52 0.12 -1.35 118.95 128.32 2wgx s ARG 158 Ca 0.03 -0.62 0.06 0.00 -0.13 0.00 0.00 55.73 55.07 2wgx s ARG 158 Cb -0.14 -2.55 -0.01 0.00 -1.56 0.00 0.00 34.95 30.69 2wgx s ARG 158 CO -0.07 0.64 -0.25 0.00 -0.81 0.00 0.00 175.30 174.81 2wgx s ALA 159 N -0.87 2.18 -0.02 6.12 0.00 -0.11 -0.73 121.76 128.33 2wgx s ALA 159 Ca 0.14 -1.06 -0.04 0.00 0.00 0.00 0.00 51.96 51.00 2wgx s ALA 159 Cb -0.11 -0.66 0.00 0.00 0.00 0.00 0.00 23.12 22.36 2wgx s ALA 159 CO 0.03 0.45 0.09 1.41 0.00 0.00 0.00 175.76 177.74 2wgx s MET 160 N -0.28 0.21 -0.06 0.00 0.00 -0.59 -2.03 119.30 116.55 2wgx s MET 160 Ca -0.00 -0.06 -0.03 0.00 0.00 0.00 0.00 55.69 55.60 2wgx s MET 160 Cb -0.13 0.09 -0.04 0.00 0.00 0.00 0.00 34.83 34.75 2wgx s MET 160 CO 0.03 -0.04 0.09 0.00 0.00 0.00 0.00 175.02 175.10 2wgx s ALA 161 N -0.41 3.64 0.08 4.11 0.00 -1.26 0.03 121.76 127.95 2wgx s ALA 161 Ca -0.05 -0.77 0.03 0.00 0.00 0.00 0.00 51.96 51.17 2wgx s ALA 161 Cb -0.03 -1.70 -0.03 0.00 0.00 0.00 0.00 23.12 21.35 2wgx s ALA 161 CO 0.00 0.65 -0.10 0.96 0.00 0.00 0.00 175.76 177.28 2wgx s ILE 162 N -1.08 0.85 0.32 0.00 -4.36 -0.14 -4.51 121.20 112.29 2wgx s ILE 162 Ca 0.19 -1.53 -0.28 0.00 -0.26 0.00 0.00 60.65 58.76 2wgx s ILE 162 Cb -0.12 -1.22 -0.10 0.00 1.25 0.00 0.00 42.46 42.27 2wgx s ILE 162 CO 0.09 -0.53 1.19 -0.31 0.24 0.00 0.00 174.94 175.62 2wgx s TYR 163 N -2.26 3.28 0.13 1.37 2.02 -1.26 -0.58 117.35 120.05 2wgx s TYR 163 Ca 0.02 1.56 -0.05 0.00 -0.37 0.00 0.00 57.07 58.23 2wgx s TYR 163 Cb -0.04 -3.46 -0.08 0.00 -0.40 0.00 0.00 41.96 37.98 2wgx s TYR 163 CO -0.00 -1.20 1.32 -0.22 -1.57 0.00 0.00 175.55 173.88 2wgx h LYS 164 N 3.44 0.47 -6.88 -0.62 3.64 -1.51 -3.37 116.57 111.74 2wgx h LYS 164 Ca -0.48 -0.47 -0.47 0.00 -1.27 0.00 0.00 60.65 57.96 2wgx h LYS 164 Cb 1.22 0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 33.15 2wgx h LYS 164 CO 0.66 1.11 0.36 -0.65 -2.27 0.00 0.00 179.45 178.66 2wgx s GLN 165 N -3.39 4.56 0.24 1.90 -0.21 -1.26 -4.88 119.66 116.62 2wgx s GLN 165 Ca -0.07 1.40 -0.07 0.00 0.02 0.00 0.00 55.36 56.64 2wgx s GLN 165 Cb 0.09 -2.84 0.41 0.00 1.00 0.00 0.00 33.01 31.67 2wgx s GLN 165 CO 0.87 0.25 1.65 1.03 -2.12 0.00 0.00 175.29 176.97 2wgx h SER 166 N 3.22 -0.24 0.52 5.90 0.87 -2.01 -0.51 113.55 121.31 2wgx h SER 166 Ca -0.47 0.17 0.00 0.00 -1.23 0.00 0.00 61.79 60.27 2wgx h SER 166 Cb 1.20 0.29 0.00 0.00 -0.44 0.00 0.00 62.40 63.45 2wgx h SER 166 CO 0.65 -0.13 0.00 0.00 -0.53 0.00 0.00 176.83 176.82 2wgx n GLN 167 N -5.28 0.37 -0.00 2.24 0.00 -1.26 -3.48 117.38 109.97 2wgx n GLN 167 Ca 0.13 0.03 0.02 0.00 0.00 0.00 0.00 57.00 57.17 2wgx n GLN 167 Cb 0.44 -1.50 -0.02 0.00 0.00 0.00 0.00 30.24 29.16 2wgx n GLN 167 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.06 177.78 2wgx n HIS 168 N -1.29 0.00 0.27 2.61 8.25 -0.32 -4.76 115.22 119.98 2wgx n HIS 168 Ca 0.13 0.00 0.13 0.00 -0.26 0.00 0.00 57.72 57.72 2wgx n HIS 168 Cb 0.22 -0.02 0.76 0.00 1.12 0.00 0.00 29.99 32.07 2wgx n HIS 168 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2wgx h MET 169 N 0.00 0.00 -0.00 -0.41 -0.00 -1.27 -0.81 114.93 112.43 2wgx h MET 169 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.70 2wgx h MET 169 Cb 0.10 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 31.70 2wgx h MET 169 CO 0.00 0.10 -0.02 0.25 -0.00 0.00 0.00 176.91 177.23 2wgx n THR 170 N -3.69 0.00 -3.23 -0.10 -2.24 -1.26 -4.58 114.28 99.17 2wgx n THR 170 Ca -0.02 -0.01 -0.39 0.00 -2.27 0.00 0.00 64.05 61.37 2wgx n THR 170 Cb 0.21 -0.43 -0.06 0.00 -2.10 0.00 0.00 70.33 67.95 2wgx n THR 170 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 2wgx s GLU 171 N -2.59 4.33 0.20 -0.78 2.12 -0.31 -5.01 118.70 116.65 2wgx s GLU 171 Ca 0.27 0.63 -0.32 0.00 0.36 0.00 0.00 54.97 55.92 2wgx s GLU 171 Cb 0.20 -3.39 -0.12 0.00 0.26 0.00 0.00 34.13 31.08 2wgx s GLU 171 CO 0.47 0.24 1.75 0.08 -0.54 0.00 0.00 175.26 177.26 2wgx s VAL 172 N 0.28 2.09 -0.18 3.70 1.01 -1.26 -4.60 120.40 121.43 2wgx s VAL 172 Ca 0.30 0.00 -0.29 0.00 0.00 0.00 0.00 61.98 61.99 2wgx s VAL 172 Cb -0.17 -3.00 -0.00 0.00 0.00 0.00 0.00 36.38 33.21 2wgx s VAL 172 CO 0.14 0.00 1.09 -0.69 0.00 0.00 0.00 175.10 175.64 2wgx s VAL 173 N 1.46 4.59 0.23 2.92 1.01 -1.26 -5.01 120.40 124.34 2wgx s VAL 173 Ca 0.76 1.90 -0.03 0.00 0.00 0.00 0.00 61.98 64.62 2wgx s VAL 173 Cb -0.49 -4.23 -0.03 0.00 0.00 0.00 0.00 36.38 31.63 2wgx s VAL 173 CO 0.33 -0.13 0.23 0.00 0.00 0.00 0.00 175.10 175.53 2wgx s ARG 174 N 2.99 1.36 0.57 2.72 1.70 -1.26 -4.74 118.95 122.29 2wgx s ARG 174 Ca 0.48 -1.60 -0.17 0.00 -0.47 0.00 0.00 55.73 53.97 2wgx s ARG 174 Cb -0.18 0.32 -0.04 0.00 -0.57 0.00 0.00 34.95 34.48 2wgx s ARG 174 CO 0.11 -0.49 1.07 1.03 -1.08 0.00 0.00 175.30 175.94 2wgx s ARG 175 N -4.01 3.36 0.95 3.89 0.52 -0.51 -4.35 118.95 118.81 2wgx s ARG 175 Ca 0.35 1.30 -0.12 0.00 -0.52 0.00 0.00 55.73 56.74 2wgx s ARG 175 Cb 0.05 -2.03 0.16 0.00 0.52 0.00 0.00 34.95 33.64 2wgx s ARG 175 CO 0.13 -0.79 1.09 0.00 0.02 0.00 0.00 175.30 175.76 2wgx h PRO 177 N -1.74 0.00 0.17 0.00 0.11 -1.76 -1.71 132.00 127.06 2wgx h PRO 177 Ca -0.52 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.58 2wgx h PRO 177 Cb 1.31 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.42 2wgx h PRO 177 CO 0.56 0.04 -0.08 1.25 -0.21 0.00 0.00 178.00 179.55 2wgx h HIS 178 N 0.00 -0.21 -0.02 0.65 -0.00 -1.91 -3.32 115.15 110.33 2wgx h HIS 178 Ca -0.00 -0.01 -0.08 0.00 -0.00 0.00 0.00 60.37 60.28 2wgx h HIS 178 Cb 0.07 0.07 -0.01 0.00 -0.00 0.00 0.00 27.41 27.54 2wgx h HIS 178 CO 0.00 0.21 -0.38 0.45 -0.00 0.00 0.00 177.93 178.21 2wgx h HIS 179 N -0.86 0.05 0.00 5.26 3.86 -1.87 -2.39 115.15 119.21 2wgx h HIS 179 Ca -0.02 -0.01 0.00 0.00 -1.16 0.00 0.00 60.37 59.17 2wgx h HIS 179 Cb 0.52 -0.01 0.00 0.00 1.06 0.00 0.00 27.41 28.98 2wgx h HIS 179 CO 0.08 0.42 0.00 1.05 0.86 0.00 0.00 177.93 180.34 2wgx h GLU 180 N 0.04 0.00 -0.36 2.45 4.11 -1.46 -2.80 114.58 116.56 2wgx h GLU 180 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 2wgx h GLU 180 Cb 0.69 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.94 2wgx h GLU 180 CO 0.05 0.00 0.00 0.54 0.07 0.00 0.00 179.01 179.67 2wgx n ARG 181 N -2.82 3.14 0.01 1.06 1.74 -0.91 -4.67 116.66 114.21 2wgx n ARG 181 Ca 0.00 -2.62 0.13 0.00 -0.77 0.00 0.00 57.85 54.59 2wgx n ARG 181 Cb 0.24 -1.70 0.42 0.00 -1.02 0.00 0.00 32.46 30.40 2wgx n ARG 181 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2wgx n SER 183 N -1.62 -4.85 -1.04 0.00 7.64 -1.26 -4.95 113.62 107.54 2wgx n SER 183 Ca 0.06 -0.31 0.08 0.00 1.01 0.00 0.00 58.87 59.70 2wgx n SER 183 Cb 0.35 -3.51 0.26 0.00 -1.01 0.00 0.00 64.21 60.30 2wgx n SER 183 CO 0.00 0.00 0.00 -0.90 -3.01 0.00 0.00 175.04 171.13 2wgx n ASP 184 N -1.40 3.97 -4.77 6.43 5.68 -1.26 -4.99 116.55 120.22 2wgx n ASP 184 Ca -0.02 -2.65 -0.40 0.00 -0.50 0.00 0.00 54.79 51.23 2wgx n ASP 184 Cb 0.55 -0.48 -0.02 0.00 -1.14 0.00 0.00 41.12 40.03 2wgx n ASP 184 CO 0.00 0.00 0.00 -0.55 -1.33 0.00 0.00 177.20 175.32 2wgx s SER 185 N -1.41 6.74 -0.02 -1.12 0.15 -1.26 -4.93 113.70 111.86 2wgx s SER 185 Ca 0.40 2.55 0.07 0.00 0.70 0.00 0.00 55.95 59.67 2wgx s SER 185 Cb 0.29 -2.64 0.23 0.00 -1.71 0.00 0.00 66.02 62.19 2wgx s SER 185 CO 0.14 -0.54 1.11 -0.90 1.20 0.00 0.00 173.24 174.25 2wgx n ASP 186 N 0.63 1.61 0.00 5.45 5.68 -1.26 -4.87 116.55 123.80 2wgx n ASP 186 Ca 0.01 -2.08 0.00 0.00 -0.50 0.00 0.00 54.79 52.22 2wgx n ASP 186 Cb 0.43 -0.26 0.00 0.00 -1.14 0.00 0.00 41.12 40.15 2wgx n ASP 186 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2wgx n GLY 187 N 0.71 3.20 0.24 6.12 0.00 -1.26 -4.79 105.19 109.40 2wgx n GLY 187 Ca 0.08 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.98 2wgx n GLY 187 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2wgx n LEU 188 N 0.00 1.78 -4.70 0.99 4.32 -1.26 -4.95 117.00 113.18 2wgx n LEU 188 Ca 0.00 0.30 -0.42 0.00 -0.02 0.00 0.00 56.01 55.87 2wgx n LEU 188 Cb 0.00 -0.69 -0.03 0.00 -1.62 0.00 0.00 43.42 41.09 2wgx n LEU 188 CO 0.00 -0.14 1.02 0.00 -1.22 0.00 0.00 177.39 177.05 2wgx s ALA 189 N -2.69 3.52 0.55 -1.18 0.00 -1.26 -4.82 121.76 115.88 2wgx s ALA 189 Ca -0.27 0.83 -0.21 0.00 0.00 0.00 0.00 51.96 52.31 2wgx s ALA 189 Cb 0.06 -3.54 -0.05 0.00 0.00 0.00 0.00 23.12 19.59 2wgx s ALA 189 CO 0.38 -0.74 1.32 -2.30 0.00 0.00 0.00 175.76 174.42 2wgx n PRO 190 N 4.86 1.60 0.33 0.00 -0.02 -1.26 -4.43 135.00 136.08 2wgx n PRO 190 Ca 0.11 0.59 0.20 0.00 -2.02 0.00 0.00 63.50 62.39 2wgx n PRO 190 Cb 0.45 -2.53 1.13 0.00 -0.02 0.00 0.00 33.50 32.52 2wgx n PRO 190 CO 0.00 0.00 0.00 -1.00 1.98 0.00 0.00 175.50 176.48 2wgx h PRO 191 N 1.33 0.00 0.00 0.52 0.13 -1.94 -1.81 132.00 130.22 2wgx h PRO 191 Ca -0.50 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.63 2wgx h PRO 191 Cb 1.31 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.44 2wgx h PRO 191 CO 0.56 0.00 0.00 1.96 -0.23 0.00 0.00 178.00 180.29 2wgx h GLN 192 N 0.00 0.00 -6.33 0.86 7.50 -1.89 -3.38 115.11 111.87 2wgx h GLN 192 Ca 0.00 0.00 -0.55 0.00 0.50 0.00 0.00 58.65 58.60 2wgx h GLN 192 Cb 0.01 0.00 -0.03 0.00 0.05 0.00 0.00 27.48 27.51 2wgx h GLN 192 CO -0.00 0.00 0.49 -1.01 -1.50 0.00 0.00 178.83 176.81 2wgx s HIS 193 N -3.18 3.56 0.07 2.96 3.76 -0.68 -1.42 115.29 120.35 2wgx s HIS 193 Ca 0.08 1.61 -0.19 0.00 -0.15 0.00 0.00 55.06 56.41 2wgx s HIS 193 Cb 0.07 -3.18 -0.11 0.00 1.11 0.00 0.00 32.58 30.48 2wgx s HIS 193 CO 0.64 -0.22 1.46 1.25 -0.85 0.00 0.00 174.74 177.02 2wgx h LEU 194 N 7.48 0.40 -9.13 0.89 5.85 -1.89 -3.44 115.31 115.46 2wgx h LEU 194 Ca -0.36 -0.36 -0.61 0.00 0.84 0.00 0.00 57.88 57.39 2wgx h LEU 194 Cb 1.18 -0.11 -0.13 0.00 0.37 0.00 0.00 40.66 41.98 2wgx h LEU 194 CO 0.81 0.67 -0.34 -0.63 -0.34 0.00 0.00 178.44 178.60 2wgx s ILE 195 N -4.77 5.28 0.22 4.05 1.01 -1.26 -0.89 121.20 124.84 2wgx s ILE 195 Ca -0.14 0.46 0.10 0.00 0.00 0.00 0.00 60.65 61.08 2wgx s ILE 195 Cb 0.07 -3.62 -0.04 0.00 0.01 0.00 0.00 42.46 38.87 2wgx s ILE 195 CO 0.75 0.30 -0.14 -0.13 0.00 0.00 0.00 174.94 175.72 2wgx s ARG 196 N 1.14 1.89 -0.19 2.79 0.52 -0.21 -4.72 118.95 120.19 2wgx s ARG 196 Ca 0.14 -1.48 -0.08 0.00 -0.52 0.00 0.00 55.73 53.79 2wgx s ARG 196 Cb -0.14 -1.99 -0.04 0.00 0.52 0.00 0.00 34.95 33.29 2wgx s ARG 196 CO 0.06 0.39 0.08 0.08 0.02 0.00 0.00 175.30 175.93 2wgx s VAL 197 N -2.01 4.95 -0.08 3.52 1.01 -1.26 -0.46 120.40 126.07 2wgx s VAL 197 Ca 0.26 0.02 -0.17 0.00 0.00 0.00 0.00 61.98 62.09 2wgx s VAL 197 Cb -0.07 -3.24 -0.05 0.00 0.00 0.00 0.00 36.38 33.02 2wgx s VAL 197 CO 0.15 0.46 0.47 -0.70 0.00 0.00 0.00 175.10 175.47 2wgx s GLU 198 N 0.35 4.25 -0.84 2.72 2.12 0.20 -4.54 118.70 122.96 2wgx s GLU 198 Ca 0.04 0.45 -0.04 0.00 0.36 0.00 0.00 54.97 55.79 2wgx s GLU 198 Cb -0.12 -3.38 0.00 0.00 0.26 0.00 0.00 34.13 30.89 2wgx s GLU 198 CO -0.00 0.29 0.72 0.41 -0.54 0.00 0.00 175.26 176.14 2wgx n GLY 199 N 2.89 -0.02 2.75 -1.50 0.00 -1.26 -4.56 105.19 103.49 2wgx n GLY 199 Ca -0.09 -0.09 -0.18 0.00 0.00 0.00 0.00 46.02 45.66 2wgx n GLY 199 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2wgx s ASN 200 N -3.41 1.64 0.00 1.61 3.84 -1.26 -5.01 114.94 112.35 2wgx s ASN 200 Ca 0.26 -0.58 0.15 0.00 0.21 0.00 0.00 52.86 52.90 2wgx s ASN 200 Cb -0.11 0.44 0.72 0.00 -0.55 0.00 0.00 41.25 41.75 2wgx s ASN 200 CO 0.47 -0.37 1.44 0.18 -2.79 0.00 0.00 177.10 176.03 2wgx n LEU 201 N 5.31 0.00 -0.90 3.21 4.77 -1.26 -1.77 117.00 126.36 2wgx n LEU 201 Ca -0.03 0.37 0.11 0.00 -0.03 0.00 0.00 56.01 56.42 2wgx n LEU 201 Cb 0.47 -0.37 0.28 0.00 -2.33 0.00 0.00 43.42 41.47 2wgx n LEU 201 CO 0.03 -0.18 0.73 0.54 -1.33 0.00 0.00 177.39 177.18 2wgx n ARG 202 N -1.37 2.17 -1.90 3.23 1.74 -1.26 -4.92 116.66 114.35 2wgx n ARG 202 Ca 0.06 -1.77 -0.41 0.00 -0.77 0.00 0.00 57.85 54.96 2wgx n ARG 202 Cb 0.14 -1.45 -0.02 0.00 -1.02 0.00 0.00 32.46 30.11 2wgx n ARG 202 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2wgx s ALA 203 N -1.57 3.70 -0.01 7.54 0.00 -0.73 -4.60 121.76 126.09 2wgx s ALA 203 Ca 0.36 1.44 0.08 0.00 0.00 0.00 0.00 51.96 53.83 2wgx s ALA 203 Cb 0.20 -3.60 -0.02 0.00 0.00 0.00 0.00 23.12 19.70 2wgx s ALA 203 CO 0.28 -0.85 -0.25 -1.21 0.00 0.00 0.00 175.76 173.73 2wgx s GLU 204 N -0.27 1.98 -0.16 0.00 2.02 -0.02 -4.96 118.70 117.29 2wgx s GLU 204 Ca 0.62 -0.93 -0.03 0.00 0.02 0.00 0.00 54.97 54.65 2wgx s GLU 204 Cb -0.45 -1.96 -0.02 0.00 0.10 0.00 0.00 34.13 31.80 2wgx s GLU 204 CO 0.44 0.53 -0.06 0.71 0.02 0.00 0.00 175.26 176.90 2wgx s TYR 205 N -0.63 2.96 -0.13 1.61 1.51 -1.26 -0.58 117.35 120.83 2wgx s TYR 205 Ca 0.10 -0.47 -0.00 0.00 -1.01 0.00 0.00 57.07 55.69 2wgx s TYR 205 Cb -0.10 -1.95 -0.01 0.00 -0.11 0.00 0.00 41.96 39.79 2wgx s TYR 205 CO -0.00 -0.15 -0.13 -1.17 -1.11 0.00 0.00 175.55 172.99 2wgx s LEU 206 N 0.51 2.71 -0.40 -1.29 2.96 -0.05 -4.99 118.68 118.13 2wgx s LEU 206 Ca -0.05 -0.33 -0.14 0.00 -0.22 0.00 0.00 54.13 53.39 2wgx s LEU 206 Cb -0.15 -1.61 0.02 0.00 0.50 0.00 0.00 46.19 44.96 2wgx s LEU 206 CO 0.03 0.17 0.29 -1.81 -1.32 0.00 0.00 176.35 173.71 2wgx s ASP 207 N 0.32 6.05 0.13 3.68 -0.00 -1.26 -1.81 116.67 123.78 2wgx s ASP 207 Ca -0.11 -0.92 -0.31 0.00 -0.00 0.00 0.00 52.55 51.22 2wgx s ASP 207 Cb -0.16 -2.14 -0.09 0.00 -0.00 0.00 0.00 42.92 40.53 2wgx s ASP 207 CO 0.06 -0.44 1.57 -0.62 -0.00 0.00 0.00 175.17 175.73 2wgx s ASP 208 N 1.66 6.62 0.52 0.27 -1.08 -0.31 -4.87 116.67 119.48 2wgx s ASP 208 Ca 0.05 2.54 0.30 0.00 -0.52 0.00 0.00 52.55 54.92 2wgx s ASP 208 Cb -0.19 -2.58 1.20 0.00 -1.46 0.00 0.00 42.92 39.89 2wgx s ASP 208 CO 0.09 -0.82 1.93 0.08 0.52 0.00 0.00 175.17 176.97 2wgx h ARG 209 N 7.20 0.00 0.01 4.34 0.11 -1.96 0.05 114.38 124.12 2wgx h ARG 209 Ca -0.42 0.00 -0.41 0.00 0.10 0.00 0.00 59.98 59.24 2wgx h ARG 209 Cb 1.20 0.00 -0.06 0.00 1.11 0.00 0.00 29.97 32.22 2wgx h ARG 209 CO 0.91 0.07 -2.36 0.09 0.10 0.00 0.00 179.97 178.78 2wgx n ASN 210 N -3.19 1.96 0.02 0.08 3.02 -1.26 -4.66 115.26 111.23 2wgx n ASN 210 Ca 0.01 0.20 0.11 0.00 -0.03 0.00 0.00 54.58 54.87 2wgx n ASN 210 Cb 0.35 -0.72 -0.03 0.00 -0.61 0.00 0.00 39.78 38.77 2wgx n ASN 210 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 2wgx n THR 211 N -3.94 0.13 -0.95 3.41 -2.24 -1.24 -4.96 114.28 104.49 2wgx n THR 211 Ca -0.48 -0.26 0.00 0.00 -2.27 0.00 0.00 64.05 61.04 2wgx n THR 211 Cb 0.91 0.27 0.00 0.00 -2.10 0.00 0.00 70.33 69.41 2wgx n THR 211 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 2wgx n PHE 212 N -1.96 0.00 -2.24 4.78 3.72 0.00 -4.94 117.46 116.83 2wgx n PHE 212 Ca 0.01 0.00 -0.33 0.00 -0.05 0.00 0.00 57.45 57.09 2wgx n PHE 212 Cb 0.44 -1.40 -0.01 0.00 -0.94 0.00 0.00 39.48 37.57 2wgx n PHE 212 CO 0.00 0.00 0.00 1.03 -0.05 0.00 0.00 176.76 177.74 2wgx s ARG 213 N -1.35 3.62 0.01 -1.08 0.52 -1.26 -4.54 118.95 114.87 2wgx s ARG 213 Ca 0.00 1.11 -0.01 0.00 -0.52 0.00 0.00 55.73 56.31 2wgx s ARG 213 Cb 0.00 -2.08 -0.04 0.00 0.52 0.00 0.00 34.95 33.35 2wgx s ARG 213 CO 0.00 -0.55 0.17 -1.01 0.02 0.00 0.00 175.30 173.93 2wgx s HIS 214 N -2.48 3.49 0.18 -0.53 3.76 -1.26 -1.17 115.29 117.28 2wgx s HIS 214 Ca 0.62 0.30 -0.14 0.00 -0.15 0.00 0.00 55.06 55.68 2wgx s HIS 214 Cb -0.13 -1.79 0.01 0.00 1.11 0.00 0.00 32.58 31.78 2wgx s HIS 214 CO 0.33 0.61 0.43 -1.54 -0.85 0.00 0.00 174.74 173.72 2wgx s SER 215 N -2.09 -0.14 -0.03 1.40 1.04 -0.75 -4.47 113.70 108.66 2wgx s SER 215 Ca 0.29 -0.63 0.04 0.00 0.48 0.00 0.00 55.95 56.13 2wgx s SER 215 Cb -0.13 0.52 -0.01 0.00 0.10 0.00 0.00 66.02 66.51 2wgx s SER 215 CO 0.21 -0.99 -0.15 0.54 0.98 0.00 0.00 173.24 173.83 2wgx s VAL 216 N -3.91 1.25 -0.01 5.02 0.11 -0.86 -0.87 120.40 121.13 2wgx s VAL 216 Ca 0.12 -0.64 0.02 0.00 -2.93 0.00 0.00 61.98 58.56 2wgx s VAL 216 Cb 0.01 -1.07 -0.00 0.00 -1.53 0.00 0.00 36.38 33.79 2wgx s VAL 216 CO -0.02 0.36 -0.08 0.54 -3.33 0.00 0.00 175.10 172.57 2wgx s VAL 217 N -0.08 0.65 0.20 2.04 0.11 0.26 -0.93 120.40 122.65 2wgx s VAL 217 Ca -0.00 -0.33 0.07 0.00 -2.93 0.00 0.00 61.98 58.78 2wgx s VAL 217 Cb -0.09 -0.56 -0.05 0.00 -1.53 0.00 0.00 36.38 34.15 2wgx s VAL 217 CO 0.01 0.19 -0.12 0.68 -3.33 0.00 0.00 175.10 172.53 2wgx s VAL 218 N -0.07 1.55 0.33 2.04 -7.23 -0.46 -0.84 120.40 115.72 2wgx s VAL 218 Ca 0.01 -2.16 -0.28 0.00 -1.81 0.00 0.00 61.98 57.74 2wgx s VAL 218 Cb -0.05 -2.05 -0.10 0.00 0.56 0.00 0.00 36.38 34.75 2wgx s VAL 218 CO -0.00 -0.59 1.23 -2.84 -0.31 0.00 0.00 175.10 172.58 2wgx s PRO 219 N -3.69 4.39 0.11 4.82 0.02 -1.26 -0.11 135.00 139.28 2wgx s PRO 219 Ca 0.22 2.04 -0.31 0.00 0.02 0.00 0.00 61.00 62.98 2wgx s PRO 219 Cb 0.01 -3.04 -0.07 0.00 0.02 0.00 0.00 34.50 31.42 2wgx s PRO 219 CO 0.06 -0.10 1.25 -0.47 -0.33 0.00 0.00 177.00 177.41 2wgx s TYR 220 N -1.19 3.38 -0.02 6.54 5.04 0.50 -4.76 117.35 126.84 2wgx s TYR 220 Ca 0.49 1.24 0.06 0.00 -2.44 0.00 0.00 57.07 56.42 2wgx s TYR 220 Cb -0.36 -3.50 -0.01 0.00 0.35 0.00 0.00 41.96 38.44 2wgx s TYR 220 CO 0.47 -1.57 -0.22 -1.21 -1.34 0.00 0.00 175.55 171.69 2wgx s GLU 221 N 0.68 1.88 0.89 4.97 0.41 -1.26 -4.76 118.70 121.51 2wgx s GLU 221 Ca 0.59 -0.78 -0.10 0.00 -0.41 0.00 0.00 54.97 54.26 2wgx s GLU 221 Cb -0.32 -1.76 0.13 0.00 -1.78 0.00 0.00 34.13 30.39 2wgx s GLU 221 CO 0.32 0.44 1.12 -2.14 -0.49 0.00 0.00 175.26 174.51 2wgx s PRO 222 N -0.42 1.25 0.49 0.39 0.02 -1.26 -4.77 135.00 130.71 2wgx s PRO 222 Ca 0.06 1.35 -0.23 0.00 0.02 0.00 0.00 61.00 62.19 2wgx s PRO 222 Cb -0.09 -1.77 -0.07 0.00 0.02 0.00 0.00 34.50 32.58 2wgx s PRO 222 CO -0.00 -2.40 1.30 -2.30 -0.33 0.00 0.00 177.00 173.27 2wgx n PRO 223 N -4.06 1.79 -1.21 5.54 -0.02 -1.26 -4.90 135.00 130.88 2wgx n PRO 223 Ca 0.10 0.65 -0.30 0.00 -2.02 0.00 0.00 63.50 61.93 2wgx n PRO 223 Cb 0.53 -2.47 0.12 0.00 -0.02 0.00 0.00 33.50 31.65 2wgx n PRO 223 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 2wgx s GLU 224 N -2.55 1.72 0.20 -0.52 2.02 -1.26 -4.90 118.70 113.40 2wgx s GLU 224 Ca 0.66 1.01 -0.33 0.00 0.02 0.00 0.00 54.97 56.34 2wgx s GLU 224 Cb -0.46 -1.85 -0.13 0.00 0.10 0.00 0.00 34.13 31.79 2wgx s GLU 224 CO 0.54 -1.97 1.55 0.28 0.02 0.00 0.00 175.26 175.67 2wgx n VAL 225 N -3.73 0.35 -1.23 2.63 0.31 -1.26 -1.65 118.33 113.75 2wgx n VAL 225 Ca 0.08 -0.09 0.00 0.00 -0.01 0.00 0.00 64.34 64.32 2wgx n VAL 225 Cb 0.54 -1.61 0.00 0.00 -0.91 0.00 0.00 33.84 31.87 2wgx n VAL 225 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2wgx n GLY 226 N 3.02 0.49 3.20 2.92 0.00 -1.26 -5.05 105.19 108.51 2wgx n GLY 226 Ca 0.15 -0.90 -0.12 0.00 0.00 0.00 0.00 46.02 45.15 2wgx n GLY 226 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2wgx s SER 227 N -2.88 -0.07 0.00 1.61 0.15 -0.66 -5.06 113.70 106.79 2wgx s SER 227 Ca 0.00 -0.17 0.11 0.00 0.70 0.00 0.00 55.95 56.60 2wgx s SER 227 Cb 0.00 0.29 -0.05 0.00 -1.71 0.00 0.00 66.02 64.56 2wgx s SER 227 CO 0.00 -0.50 0.59 0.47 1.20 0.00 0.00 173.24 175.00 2wgx n ASP 228 N 0.98 0.99 -4.17 5.45 8.00 -1.26 -4.56 116.55 121.98 2wgx n ASP 228 Ca -0.20 -1.00 -0.15 0.00 0.71 0.00 0.00 54.79 54.15 2wgx n ASP 228 Cb 0.57 0.68 -0.10 0.00 -0.02 0.00 0.00 41.12 42.25 2wgx n ASP 228 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2wgx s THR 230 N -3.92 4.22 -0.08 0.00 2.01 -0.85 -4.48 115.64 112.55 2wgx s THR 230 Ca 0.38 -0.36 0.05 0.00 0.31 0.00 0.00 61.69 62.07 2wgx s THR 230 Cb 0.07 -2.80 -0.01 0.00 0.01 0.00 0.00 72.50 69.77 2wgx s THR 230 CO 0.14 0.54 -0.23 -0.89 -0.69 0.00 0.00 174.62 173.49 2wgx s THR 231 N -0.93 2.15 -0.10 -0.82 2.01 -1.26 0.42 115.64 117.11 2wgx s THR 231 Ca 0.15 -1.01 -0.01 0.00 0.31 0.00 0.00 61.69 61.13 2wgx s THR 231 Cb -0.11 -1.81 -0.03 0.00 0.01 0.00 0.00 72.50 70.56 2wgx s THR 231 CO 0.04 0.56 -0.05 -0.63 -0.69 0.00 0.00 174.62 173.86 2wgx s ILE 232 N 0.10 3.83 -0.34 1.82 1.01 -0.03 -4.95 121.20 122.65 2wgx s ILE 232 Ca -0.11 -0.41 -0.14 0.00 0.00 0.00 0.00 60.65 59.98 2wgx s ILE 232 Cb -0.16 -2.61 -0.02 0.00 0.01 0.00 0.00 42.46 39.69 2wgx s ILE 232 CO 0.06 0.57 0.31 -1.00 0.00 0.00 0.00 174.94 174.89 2wgx s HIS 233 N -0.47 3.22 0.15 3.97 3.76 -1.26 -0.73 115.29 123.94 2wgx s HIS 233 Ca 0.07 -0.07 0.04 0.00 -0.15 0.00 0.00 55.06 54.95 2wgx s HIS 233 Cb -0.12 -2.59 -0.04 0.00 1.11 0.00 0.00 32.58 30.95 2wgx s HIS 233 CO 0.02 -0.39 0.20 0.71 -0.85 0.00 0.00 174.74 174.44 2wgx s TYR 234 N 1.90 3.31 -0.03 1.40 2.02 -0.03 -0.62 117.35 125.30 2wgx s TYR 234 Ca 0.10 0.05 0.05 0.00 -0.37 0.00 0.00 57.07 56.90 2wgx s TYR 234 Cb -0.17 -1.59 -0.01 0.00 -0.40 0.00 0.00 41.96 39.79 2wgx s TYR 234 CO 0.11 0.52 -0.18 -0.80 -1.57 0.00 0.00 175.55 173.63 2wgx s ASN 235 N -3.14 2.14 -0.15 2.29 0.02 0.40 -0.68 114.94 115.82 2wgx s ASN 235 Ca 0.33 -0.34 -0.02 0.00 -1.02 0.00 0.00 52.86 51.81 2wgx s ASN 235 Cb -0.11 -0.39 -0.02 0.00 0.02 0.00 0.00 41.25 40.76 2wgx s ASN 235 CO 0.26 0.19 -0.09 -0.36 0.02 0.00 0.00 177.10 177.13 2wgx s PHE 236 N -0.23 2.91 -1.08 2.20 0.40 -1.26 -1.04 117.98 119.88 2wgx s PHE 236 Ca 0.03 -0.55 0.16 0.00 -0.60 0.00 0.00 56.93 55.96 2wgx s PHE 236 Cb -0.09 -1.92 0.52 0.00 0.51 0.00 0.00 43.02 42.04 2wgx s PHE 236 CO 0.00 -0.19 1.44 -1.33 0.70 0.00 0.00 175.22 175.84 2wgx n MET 237 N 3.68 3.09 -3.99 0.44 2.81 -0.07 -0.65 117.12 122.43 2wgx n MET 237 Ca -0.18 -2.51 -0.09 0.00 -1.81 0.00 0.00 57.70 53.11 2wgx n MET 237 Cb 0.52 -1.58 -0.10 0.00 -0.71 0.00 0.00 33.22 31.35 2wgx n MET 237 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2wgx s TYR 239 N -2.17 2.67 0.54 0.00 2.02 -1.26 -4.74 117.35 114.41 2wgx s TYR 239 Ca -0.09 1.54 0.23 0.00 -0.37 0.00 0.00 57.07 58.38 2wgx s TYR 239 Cb -0.05 -3.27 1.40 0.00 -0.40 0.00 0.00 41.96 39.64 2wgx s TYR 239 CO -0.03 -1.58 2.06 0.77 -1.57 0.00 0.00 175.55 175.20 2wgx h SER 240 N 1.08 0.00 0.37 2.29 0.02 -1.52 -1.82 113.55 113.96 2wgx h SER 240 Ca -0.50 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.45 2wgx h SER 240 Cb 1.26 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.80 2wgx h SER 240 CO 0.57 0.00 -0.20 -1.54 -1.14 0.00 0.00 176.83 174.52 2wgx n SER 241 N -4.33 0.64 -4.67 3.07 3.41 -1.26 0.07 113.62 110.54 2wgx n SER 241 Ca 0.04 -0.58 -0.51 0.00 -0.26 0.00 0.00 58.87 57.55 2wgx n SER 241 Cb 0.39 0.01 -0.06 0.00 -0.26 0.00 0.00 64.21 64.29 2wgx n SER 241 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2wgx s MET 243 N 2.63 4.66 0.00 0.00 -1.94 -1.26 -1.05 119.30 122.34 2wgx s MET 243 Ca 0.90 1.76 0.00 0.00 -1.71 0.00 0.00 55.69 56.64 2wgx s MET 243 Cb -0.85 -3.21 0.00 0.00 2.01 0.00 0.00 34.83 32.78 2wgx s MET 243 CO 0.52 0.22 0.00 0.41 -0.01 0.00 0.00 175.02 176.17 2wgx n GLY 244 N 1.35 2.03 0.00 -0.03 0.00 -1.26 -4.38 105.19 102.90 2wgx n GLY 244 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.01 2wgx n GLY 244 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wgx n GLY 245 N -2.00 1.58 0.33 -0.02 0.00 -0.99 -4.39 105.19 99.71 2wgx n GLY 245 Ca 0.00 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.08 2wgx n GLY 245 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 2wgx h MET 246 N 0.00 0.52 -5.78 1.61 2.07 -1.75 -3.46 114.93 108.14 2wgx h MET 246 Ca 0.00 -0.03 -0.41 0.00 -2.07 0.00 0.00 59.70 57.18 2wgx h MET 246 Cb 0.00 -0.12 0.10 0.00 -1.87 0.00 0.00 31.60 29.71 2wgx h MET 246 CO 0.00 0.35 -0.68 -1.71 1.07 0.00 0.00 176.91 175.93 2wgx n ASN 247 N -4.47 -6.08 0.00 1.22 5.15 -0.21 -0.81 115.26 110.05 2wgx n ASN 247 Ca 0.06 -0.55 0.00 0.00 -0.60 0.00 0.00 54.58 53.49 2wgx n ASN 247 Cb 0.17 -4.81 0.00 0.00 -0.53 0.00 0.00 39.78 34.61 2wgx n ASN 247 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 2wgx n ARG 248 N -4.85 -0.16 -2.85 1.20 1.74 0.11 -4.97 116.66 106.88 2wgx n ARG 248 Ca 0.00 0.04 -0.41 0.00 -0.77 0.00 0.00 57.85 56.71 2wgx n ARG 248 Cb 0.56 -3.18 -0.04 0.00 -1.02 0.00 0.00 32.46 28.78 2wgx n ARG 248 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 2wgx s ARG 249 N -0.35 4.52 0.46 5.56 0.52 0.01 -4.97 118.95 124.70 2wgx s ARG 249 Ca 0.00 1.20 -0.24 0.00 -0.52 0.00 0.00 55.73 56.17 2wgx s ARG 249 Cb 0.00 -3.45 -0.07 0.00 0.52 0.00 0.00 34.95 31.95 2wgx s ARG 249 CO 0.00 0.03 1.27 -2.14 0.02 0.00 0.00 175.30 174.48 2wgx s PRO 250 N 0.82 3.68 0.20 3.54 0.02 -1.26 -4.93 135.00 137.06 2wgx s PRO 250 Ca 0.46 2.06 0.08 0.00 0.02 0.00 0.00 61.00 63.61 2wgx s PRO 250 Cb -0.20 -2.51 -0.05 0.00 0.02 0.00 0.00 34.50 31.76 2wgx s PRO 250 CO 0.24 -0.70 -0.15 0.96 -0.33 0.00 0.00 177.00 177.02 2wgx s ILE 251 N -1.36 1.76 -0.04 2.83 -4.36 -1.26 -1.32 121.20 117.45 2wgx s ILE 251 Ca 0.63 -2.14 0.06 0.00 -0.26 0.00 0.00 60.65 58.93 2wgx s ILE 251 Cb -0.36 -1.99 -0.02 0.00 1.25 0.00 0.00 42.46 41.34 2wgx s ILE 251 CO 0.44 -0.53 -0.21 -0.22 0.24 0.00 0.00 174.94 174.66 2wgx s LEU 252 N -3.17 2.30 -0.24 0.37 2.96 0.25 -2.54 118.68 118.63 2wgx s LEU 252 Ca 0.21 -0.38 -0.10 0.00 -0.22 0.00 0.00 54.13 53.64 2wgx s LEU 252 Cb -0.02 -1.43 -0.05 0.00 0.50 0.00 0.00 46.19 45.20 2wgx s LEU 252 CO 0.07 0.31 0.15 -0.63 -1.32 0.00 0.00 176.35 174.92 2wgx s ILE 253 N -0.53 5.25 -0.22 6.68 -1.09 0.70 -0.96 121.20 131.02 2wgx s ILE 253 Ca 0.07 0.14 -0.08 0.00 -2.23 0.00 0.00 60.65 58.55 2wgx s ILE 253 Cb -0.11 -3.44 -0.04 0.00 -1.58 0.00 0.00 42.46 37.29 2wgx s ILE 253 CO 0.01 0.35 0.09 -0.63 -1.23 0.00 0.00 174.94 173.53 2wgx s ILE 254 N 1.03 4.75 -0.24 2.92 1.01 0.10 -1.48 121.20 129.29 2wgx s ILE 254 Ca 0.07 -0.03 -0.06 0.00 0.00 0.00 0.00 60.65 60.63 2wgx s ILE 254 Cb -0.13 -3.20 -0.01 0.00 0.01 0.00 0.00 42.46 39.13 2wgx s ILE 254 CO 0.04 0.38 0.03 -0.63 0.00 0.00 0.00 174.94 174.75 2wgx s ILE 255 N 1.07 3.88 -0.12 2.92 -1.09 0.06 -1.54 121.20 126.38 2wgx s ILE 255 Ca 0.05 -0.38 -0.01 0.00 -2.23 0.00 0.00 60.65 58.09 2wgx s ILE 255 Cb -0.14 -2.82 -0.02 0.00 -1.58 0.00 0.00 42.46 37.90 2wgx s ILE 255 CO 0.04 0.34 -0.10 -0.89 -1.23 0.00 0.00 174.94 173.09 2wgx s THR 256 N 1.54 3.36 -0.12 2.92 2.01 0.09 -1.31 115.64 124.13 2wgx s THR 256 Ca 0.06 -0.56 -0.22 0.00 0.31 0.00 0.00 61.69 61.27 2wgx s THR 256 Cb -0.15 -2.41 -0.03 0.00 0.01 0.00 0.00 72.50 69.91 2wgx s THR 256 CO 0.01 0.53 0.66 -0.22 -0.69 0.00 0.00 174.62 174.91 2wgx s LEU 257 N 0.08 4.25 0.07 4.42 2.96 0.29 -0.71 118.68 130.05 2wgx s LEU 257 Ca -0.04 1.04 0.06 0.00 -0.22 0.00 0.00 54.13 54.98 2wgx s LEU 257 Cb -0.14 -2.99 -0.03 0.00 0.50 0.00 0.00 46.19 43.53 2wgx s LEU 257 CO 0.04 -0.16 -0.17 -1.61 -1.32 0.00 0.00 176.35 173.12 2wgx s GLU 258 N 1.18 1.05 0.92 1.98 2.02 0.09 -0.11 118.70 125.83 2wgx s GLU 258 Ca 0.34 -0.96 -0.16 0.00 0.02 0.00 0.00 54.97 54.21 2wgx s GLU 258 Cb -0.17 -1.16 0.22 0.00 0.10 0.00 0.00 34.13 33.13 2wgx s GLU 258 CO 0.14 0.28 1.05 -0.40 0.02 0.00 0.00 175.26 176.35 2wgx n ASP 259 N 1.49 -0.74 0.19 -0.19 5.68 -0.42 -0.60 116.55 121.97 2wgx n ASP 259 Ca -0.19 -1.27 0.14 0.00 -0.50 0.00 0.00 54.79 52.97 2wgx n ASP 259 Cb 0.54 -0.86 0.62 0.00 -1.14 0.00 0.00 41.12 40.27 2wgx n ASP 259 CO 0.00 0.00 0.00 0.77 -1.33 0.00 0.00 177.20 176.64 2wgx h SER 260 N -1.89 0.00 0.44 -1.12 4.64 -1.90 -0.92 113.55 112.80 2wgx h SER 260 Ca -0.36 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.96 2wgx h SER 260 Cb 1.03 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.12 2wgx h SER 260 CO 0.25 0.00 -0.46 -1.20 -0.87 0.00 0.00 176.83 174.55 2wgx n SER 261 N -2.53 0.60 0.00 4.97 7.64 -1.26 -4.95 113.62 118.09 2wgx n SER 261 Ca 0.01 -0.38 0.00 0.00 1.01 0.00 0.00 58.87 59.51 2wgx n SER 261 Cb 0.21 0.23 0.00 0.00 -1.01 0.00 0.00 64.21 63.64 2wgx n SER 261 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2wgx n GLY 262 N 1.47 0.74 3.78 0.23 0.00 -0.35 -5.07 105.19 105.98 2wgx n GLY 262 Ca 0.07 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.73 2wgx n GLY 262 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2wgx s ASN 263 N -2.53 6.20 0.10 1.61 0.01 -1.26 -4.73 114.94 114.33 2wgx s ASN 263 Ca 0.00 2.18 -0.31 0.00 -0.71 0.00 0.00 52.86 54.02 2wgx s ASN 263 Cb 0.00 -2.59 -0.08 0.00 0.41 0.00 0.00 41.25 38.99 2wgx s ASN 263 CO 0.00 -0.89 1.47 -0.22 -1.51 0.00 0.00 177.10 175.95 2wgx s LEU 264 N -3.19 4.36 -0.08 0.60 2.96 -1.26 -1.29 118.68 120.77 2wgx s LEU 264 Ca 0.65 2.38 0.08 0.00 -0.22 0.00 0.00 54.13 57.02 2wgx s LEU 264 Cb -0.25 -3.58 -0.12 0.00 0.50 0.00 0.00 46.19 42.75 2wgx s LEU 264 CO 0.30 -0.74 0.05 0.18 -1.32 0.00 0.00 176.35 174.82 2wgx n LEU 265 N 4.43 0.00 -3.54 -0.68 4.77 0.85 -4.85 117.00 117.97 2wgx n LEU 265 Ca 0.13 0.00 -0.07 0.00 -0.03 0.00 0.00 56.01 56.04 2wgx n LEU 265 Cb 0.41 0.19 -0.02 0.00 -2.33 0.00 0.00 43.42 41.68 2wgx n LEU 265 CO 0.60 0.19 0.83 -0.83 -1.33 0.00 0.00 177.39 176.85 2wgx s GLY 266 N -3.98 -0.39 -0.10 -0.72 0.00 -0.99 -4.12 107.32 97.03 2wgx s GLY 266 Ca -0.04 1.27 -0.15 0.00 0.00 0.00 0.00 44.72 45.80 2wgx s GLY 266 CO 0.37 0.42 0.37 -1.60 0.00 0.00 0.00 173.10 172.66 2wgx s ARG 267 N -2.82 0.55 0.27 2.90 3.52 0.11 -0.54 118.95 122.94 2wgx s ARG 267 Ca 0.07 0.28 -0.08 0.00 -0.13 0.00 0.00 55.73 55.87 2wgx s ARG 267 Cb -0.01 0.26 -0.00 0.00 -1.56 0.00 0.00 34.95 33.63 2wgx s ARG 267 CO -0.07 -0.11 0.44 0.34 -0.81 0.00 0.00 175.30 175.09 2wgx s ASP 268 N -0.36 0.24 0.14 -2.12 -1.08 -0.43 -1.27 116.67 111.79 2wgx s ASP 268 Ca -0.05 -1.16 -0.24 0.00 -0.52 0.00 0.00 52.55 50.58 2wgx s ASP 268 Cb -0.03 0.59 0.07 0.00 -1.46 0.00 0.00 42.92 42.09 2wgx s ASP 268 CO 0.02 -1.17 0.67 -0.94 0.52 0.00 0.00 175.17 174.27 2wgx s SER 269 N -3.10 -0.50 -0.02 -0.34 1.04 -1.26 -0.76 113.70 108.76 2wgx s SER 269 Ca 0.27 -0.05 -0.23 0.00 0.48 0.00 0.00 55.95 56.42 2wgx s SER 269 Cb 0.00 0.57 0.05 0.00 0.10 0.00 0.00 66.02 66.74 2wgx s SER 269 CO 0.13 -0.94 0.49 0.72 0.98 0.00 0.00 173.24 174.63 2wgx s PHE 270 N -3.64 -0.41 0.53 5.02 -0.71 -0.55 -4.98 117.98 113.23 2wgx s PHE 270 Ca 0.03 0.64 -0.18 0.00 -1.04 0.00 0.00 56.93 56.38 2wgx s PHE 270 Cb -0.01 0.26 -0.07 0.00 -1.21 0.00 0.00 43.02 41.99 2wgx s PHE 270 CO -0.10 -0.53 1.02 -1.21 -1.34 0.00 0.00 175.22 173.06 2wgx s GLU 271 N -1.51 3.72 -0.01 1.99 2.02 -0.21 -0.21 118.70 124.49 2wgx s GLU 271 Ca -0.11 1.17 0.02 0.00 0.02 0.00 0.00 54.97 56.08 2wgx s GLU 271 Cb -0.02 -2.09 -0.01 0.00 0.10 0.00 0.00 34.13 32.11 2wgx s GLU 271 CO 0.05 -0.48 -0.07 0.54 0.02 0.00 0.00 175.26 175.32 2wgx s VAL 272 N -2.34 0.58 -0.13 2.63 0.11 -1.05 -0.09 120.40 120.11 2wgx s VAL 272 Ca 0.63 -0.31 0.03 0.00 -2.93 0.00 0.00 61.98 59.40 2wgx s VAL 272 Cb -0.14 -0.49 0.01 0.00 -1.53 0.00 0.00 36.38 34.23 2wgx s VAL 272 CO 0.28 0.17 -0.22 -0.60 -3.33 0.00 0.00 175.10 171.40 2wgx s ARG 273 N -0.15 2.96 -0.27 1.54 3.52 0.13 -4.30 118.95 122.39 2wgx s ARG 273 Ca 0.02 -0.84 -0.09 0.00 -0.13 0.00 0.00 55.73 54.70 2wgx s ARG 273 Cb -0.03 -2.35 -0.04 0.00 -1.56 0.00 0.00 34.95 30.97 2wgx s ARG 273 CO -0.00 0.03 0.13 0.08 -0.81 0.00 0.00 175.30 174.73 2wgx s VAL 274 N 0.71 4.81 0.22 7.11 1.01 -1.26 -1.19 120.40 131.81 2wgx s VAL 274 Ca -0.10 -0.02 -0.14 0.00 0.00 0.00 0.00 61.98 61.71 2wgx s VAL 274 Cb -0.16 -3.29 0.01 0.00 0.00 0.00 0.00 36.38 32.94 2wgx s VAL 274 CO 0.01 0.28 0.48 0.00 0.00 0.00 0.00 175.10 175.87 2wgx h ALA 276 N 2.26 0.85 -2.69 0.00 0.00 -1.97 -3.33 119.26 114.38 2wgx h ALA 276 Ca -0.27 -0.33 -0.60 0.00 0.00 0.00 0.00 54.91 53.71 2wgx h ALA 276 Cb 1.25 -0.21 -0.40 0.00 0.00 0.00 0.00 17.79 18.44 2wgx h ALA 276 CO 0.37 0.66 -0.81 0.00 0.00 0.00 0.00 179.25 179.47 2wgx h PRO 278 N 5.84 1.13 -0.06 0.00 0.11 -1.79 -1.04 132.00 136.20 2wgx h PRO 278 Ca 0.17 -0.07 0.02 0.00 0.11 0.00 0.00 66.00 66.24 2wgx h PRO 278 Cb 0.87 -0.26 -0.03 0.00 0.11 0.00 0.00 31.00 31.70 2wgx h PRO 278 CO 0.48 0.75 -0.09 0.78 -0.21 0.00 0.00 178.00 179.71 2wgx h GLY 279 N 1.17 -0.05 0.95 -0.55 0.00 -1.78 0.11 103.07 102.92 2wgx h GLY 279 Ca 0.44 0.11 -0.06 0.00 0.00 0.00 0.00 47.33 47.82 2wgx h GLY 279 CO -0.18 -0.10 0.02 -0.09 0.00 0.00 0.00 176.54 176.19 2wgx h ARG 280 N -0.13 0.71 -0.36 4.80 2.43 -1.67 -2.04 114.38 118.12 2wgx h ARG 280 Ca 0.06 -0.22 -0.09 0.00 -0.81 0.00 0.00 59.98 58.91 2wgx h ARG 280 Cb 0.21 -0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 29.67 2wgx h ARG 280 CO -0.14 0.78 -0.17 -0.44 -1.51 0.00 0.00 179.97 178.50 2wgx h ASP 281 N 0.55 0.66 -0.23 -3.80 3.32 -0.98 -0.33 116.42 115.60 2wgx h ASP 281 Ca 0.12 -0.21 -0.03 0.00 0.02 0.00 0.00 57.03 56.93 2wgx h ASP 281 Cb 0.45 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.81 2wgx h ASP 281 CO 0.02 0.84 0.03 -0.09 -1.72 0.00 0.00 179.24 178.31 2wgx h ARG 282 N 0.59 0.39 -0.12 3.56 2.43 -0.67 -0.17 114.38 120.39 2wgx h ARG 282 Ca 0.10 -0.11 0.04 0.00 -0.81 0.00 0.00 59.98 59.19 2wgx h ARG 282 Cb 0.62 -0.04 -0.04 0.00 -0.42 0.00 0.00 29.97 30.09 2wgx h ARG 282 CO 0.04 0.54 -0.13 0.00 -1.51 0.00 0.00 179.97 178.91 2wgx h ARG 283 N 0.18 -0.16 -0.01 0.20 3.08 -1.11 -0.34 114.38 116.23 2wgx h ARG 283 Ca 0.07 0.01 0.02 0.00 0.07 0.00 0.00 59.98 60.15 2wgx h ARG 283 Cb 0.34 0.04 -0.03 0.00 0.08 0.00 0.00 29.97 30.40 2wgx h ARG 283 CO 0.01 -0.10 -0.13 1.15 -1.07 0.00 0.00 179.97 179.82 2wgx h THR 284 N -0.16 0.68 -0.22 2.04 2.02 -0.95 0.96 112.91 117.27 2wgx h THR 284 Ca 0.09 0.00 -0.07 0.00 0.77 0.00 0.00 66.41 67.19 2wgx h THR 284 Cb 0.29 0.68 -0.01 0.00 -1.74 0.00 0.00 68.15 67.36 2wgx h THR 284 CO -0.22 0.00 -0.18 -0.33 0.37 0.00 0.00 175.52 175.16 2wgx h GLU 285 N -0.21 0.39 -0.20 6.66 5.08 -0.81 0.81 114.58 126.29 2wgx h GLU 285 Ca 0.05 -0.12 -0.18 0.00 -1.00 0.00 0.00 59.36 58.11 2wgx h GLU 285 Cb 0.28 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.49 2wgx h GLU 285 CO -0.13 0.56 -0.57 0.93 -1.00 0.00 0.00 179.01 178.79 2wgx h GLU 286 N 0.35 0.74 -0.71 2.33 5.08 -0.85 -1.06 114.58 120.46 2wgx h GLU 286 Ca 0.06 -0.53 0.01 0.00 -1.00 0.00 0.00 59.36 57.91 2wgx h GLU 286 Cb 0.52 0.09 -0.04 0.00 0.50 0.00 0.00 28.75 29.82 2wgx h GLU 286 CO 0.03 1.15 0.47 1.49 -1.00 0.00 0.00 179.01 181.15 2wgx h GLU 287 N 0.46 0.92 -0.45 2.33 4.57 -0.36 -1.08 114.58 120.96 2wgx h GLU 287 Ca -0.02 -0.06 0.05 0.00 -1.18 0.00 0.00 59.36 58.16 2wgx h GLU 287 Cb 1.19 -0.21 -0.05 0.00 -0.16 0.00 0.00 28.75 29.53 2wgx h GLU 287 CO 0.12 0.61 0.18 -0.91 -1.18 0.00 0.00 179.01 177.83 2wgx h ASN 288 N 0.94 0.21 -0.69 1.04 2.35 -0.76 -2.20 115.58 116.48 2wgx h ASN 288 Ca 0.27 0.05 0.09 0.00 -0.55 0.00 0.00 56.30 56.15 2wgx h ASN 288 Cb -0.08 0.02 -0.07 0.00 0.05 0.00 0.00 38.32 38.24 2wgx h ASN 288 CO -0.07 0.15 0.34 0.25 -1.65 0.00 0.00 177.43 176.45 2wgx h LEU 289 N 0.36 0.43 0.32 1.61 6.46 0.00 -2.45 115.31 122.04 2wgx h LEU 289 Ca 0.21 0.06 -0.02 0.00 -0.12 0.00 0.00 57.88 58.02 2wgx h LEU 289 Cb 0.19 -0.01 0.00 0.00 -0.73 0.00 0.00 40.66 40.11 2wgx h LEU 289 CO -0.20 0.25 -0.15 -0.09 -0.62 0.00 0.00 178.44 177.63 2wgx h ARG 290 N 0.58 -0.41 0.00 1.25 2.43 -0.87 -3.51 114.38 113.85 2wgx h ARG 290 Ca 0.34 0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.54 2wgx h ARG 290 Cb 0.35 0.09 0.00 0.00 -0.42 0.00 0.00 29.97 30.00 2wgx h ARG 290 CO -0.27 -0.18 0.00 1.63 -1.51 0.00 0.00 179.97 179.64