#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wan s SER 113 N 0.00 0.17 -0.30 2.55 1.04 -1.26 -0.27 113.70 115.63 2wan s SER 113 Ca 0.00 -0.56 -0.29 0.00 0.48 0.00 0.00 55.95 55.58 2wan s SER 113 Cb 0.00 0.25 -0.01 0.00 0.10 0.00 0.00 66.02 66.37 2wan s SER 113 CO 0.00 -0.56 1.43 -0.69 0.98 0.00 0.00 173.24 174.40 2wan s VAL 114 N -2.90 3.94 -0.45 5.02 1.01 -0.11 -0.82 120.40 126.08 2wan s VAL 114 Ca -0.02 1.04 0.23 0.00 0.00 0.00 0.00 61.98 63.23 2wan s VAL 114 Cb 0.01 -4.01 0.02 0.00 0.00 0.00 0.00 36.38 32.40 2wan s VAL 114 CO -0.06 -0.47 1.18 0.77 0.00 0.00 0.00 175.10 176.52 2wan h SER 115 N 10.11 0.00 -4.67 3.32 4.64 -0.74 -3.40 113.55 122.82 2wan h SER 115 Ca -0.29 -0.12 -0.01 0.00 -0.47 0.00 0.00 61.79 60.90 2wan h SER 115 Cb 1.12 0.00 -0.20 0.00 -0.31 0.00 0.00 62.40 63.00 2wan h SER 115 CO 1.03 0.06 0.32 0.21 -0.87 0.00 0.00 176.83 177.59 2wan s ASN 116 N -4.78 -0.55 -0.16 4.97 2.47 -1.21 -5.00 114.94 110.68 2wan s ASN 116 Ca 0.03 0.60 -0.11 0.00 0.42 0.00 0.00 52.86 53.81 2wan s ASN 116 Cb 0.11 0.46 0.05 0.00 -1.45 0.00 0.00 41.25 40.42 2wan s ASN 116 CO 0.76 -0.51 0.39 0.00 -3.72 0.00 0.00 177.10 174.02 2wan s ALA 117 N -1.15 -0.99 -0.03 1.71 0.00 -1.25 -1.01 121.76 119.04 2wan s ALA 117 Ca -0.08 1.34 0.06 0.00 0.00 0.00 0.00 51.96 53.28 2wan s ALA 117 Cb -0.00 -0.80 -0.01 0.00 0.00 0.00 0.00 23.12 22.30 2wan s ALA 117 CO 0.07 -0.23 -0.22 0.71 0.00 0.00 0.00 175.76 176.09 2wan s TYR 118 N 0.93 2.01 -0.61 0.00 2.02 -0.42 -1.08 117.35 120.20 2wan s TYR 118 Ca -0.06 -0.45 -0.21 0.00 -0.37 0.00 0.00 57.07 55.98 2wan s TYR 118 Cb -0.06 -1.31 0.07 0.00 -0.40 0.00 0.00 41.96 40.26 2wan s TYR 118 CO -0.07 -0.09 0.86 -1.17 -1.57 0.00 0.00 175.55 173.51 2wan s LEU 119 N -0.37 4.67 0.00 -1.29 2.96 -0.36 -0.55 118.68 123.75 2wan s LEU 119 Ca 0.04 -1.02 0.20 0.00 -0.22 0.00 0.00 54.13 53.14 2wan s LEU 119 Cb -0.10 -2.44 -0.02 0.00 0.50 0.00 0.00 46.19 44.13 2wan s LEU 119 CO 0.00 -1.27 1.00 0.47 -1.32 0.00 0.00 176.35 175.23 2wan n ASP 120 N 7.15 1.85 -3.55 3.68 8.00 -0.34 -1.28 116.55 132.06 2wan n ASP 120 Ca -0.05 -1.42 -0.10 0.00 0.71 0.00 0.00 54.79 53.92 2wan n ASP 120 Cb 0.45 0.51 -0.03 0.00 -0.02 0.00 0.00 41.12 42.02 2wan n ASP 120 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2wan s ASP 121 N -2.32 0.21 0.32 -2.24 3.68 -1.16 -2.89 116.67 112.28 2wan s ASP 121 Ca 0.16 -1.11 0.06 0.00 2.13 0.00 0.00 52.55 53.79 2wan s ASP 121 Cb 0.16 0.68 0.71 0.00 -1.45 0.00 0.00 42.92 43.02 2wan s ASP 121 CO 0.53 -1.32 1.85 1.05 0.13 0.00 0.00 175.17 177.42 2wan h GLU 122 N 2.14 0.80 -0.01 4.34 4.11 -1.93 -3.02 114.58 121.00 2wan h GLU 122 Ca -0.27 -0.05 -0.07 0.00 0.07 0.00 0.00 59.36 59.04 2wan h GLU 122 Cb 1.25 -0.18 -0.15 0.00 0.50 0.00 0.00 28.75 30.17 2wan h GLU 122 CO 0.36 0.53 -0.70 1.63 0.07 0.00 0.00 179.01 180.90 2wan n LYS 123 N -4.59 1.06 -4.25 1.06 5.02 -1.26 -3.84 118.16 111.35 2wan n LYS 123 Ca 0.18 -2.86 -0.25 0.00 -2.02 0.00 0.00 58.31 53.36 2wan n LYS 123 Cb 0.43 -1.06 -0.17 0.00 -0.02 0.00 0.00 35.03 34.21 2wan n LYS 123 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 2wan s THR 124 N -2.12 0.98 -0.10 -0.18 2.01 -1.14 -0.28 115.64 114.81 2wan s THR 124 Ca 0.37 -0.34 0.02 0.00 0.31 0.00 0.00 61.69 62.05 2wan s THR 124 Cb 0.38 -0.95 -0.02 0.00 0.01 0.00 0.00 72.50 71.92 2wan s THR 124 CO -0.10 0.34 -0.16 -0.69 -0.69 0.00 0.00 174.62 173.31 2wan s VAL 125 N 1.12 2.78 -0.34 3.82 1.01 -0.20 -1.20 120.40 127.39 2wan s VAL 125 Ca -0.06 -0.78 -0.09 0.00 0.00 0.00 0.00 61.98 61.05 2wan s VAL 125 Cb -0.14 -2.12 0.02 0.00 0.00 0.00 0.00 36.38 34.14 2wan s VAL 125 CO -0.01 0.55 0.15 -0.22 0.00 0.00 0.00 175.10 175.56 2wan s LEU 126 N 0.01 4.34 -0.08 3.92 2.96 0.29 0.22 118.68 130.34 2wan s LEU 126 Ca -0.05 -0.89 0.05 0.00 -0.22 0.00 0.00 54.13 53.01 2wan s LEU 126 Cb -0.15 -1.95 -0.01 0.00 0.50 0.00 0.00 46.19 44.59 2wan s LEU 126 CO 0.05 -0.30 -0.25 0.00 -1.32 0.00 0.00 176.35 174.53 2wan s ALA 127 N 1.51 2.16 -0.16 5.97 0.00 0.12 -1.30 121.76 130.06 2wan s ALA 127 Ca 0.02 -1.01 -0.07 0.00 0.00 0.00 0.00 51.96 50.89 2wan s ALA 127 Cb -0.18 -0.73 -0.04 0.00 0.00 0.00 0.00 23.12 22.16 2wan s ALA 127 CO 0.05 0.36 0.09 0.21 0.00 0.00 0.00 175.76 176.47 2wan s LYS 128 N 0.05 3.80 0.02 0.00 2.47 -0.18 -0.76 119.74 125.15 2wan s LYS 128 Ca -0.10 -0.26 0.03 0.00 -1.56 0.00 0.00 55.97 54.07 2wan s LYS 128 Cb -0.16 -3.22 -0.04 0.00 -1.46 0.00 0.00 37.83 32.95 2wan s LYS 128 CO 0.06 0.45 -0.02 -0.51 0.16 0.00 0.00 175.35 175.49 2wan s LEU 129 N -0.11 3.38 0.23 5.43 1.43 0.40 0.01 118.68 129.45 2wan s LEU 129 Ca 0.08 -0.09 0.22 0.00 -1.03 0.00 0.00 54.13 53.32 2wan s LEU 129 Cb -0.12 -1.98 0.94 0.00 0.03 0.00 0.00 46.19 45.06 2wan s LEU 129 CO 0.01 0.26 1.67 -1.54 0.23 0.00 0.00 176.35 176.98 2wan n SER 130 N 1.29 0.57 -3.66 2.29 3.41 -0.00 -4.72 113.62 112.79 2wan n SER 130 Ca -0.14 0.65 -0.14 0.00 -0.26 0.00 0.00 58.87 58.98 2wan n SER 130 Cb 0.52 -0.77 -0.07 0.00 -0.26 0.00 0.00 64.21 63.64 2wan n SER 130 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2wan s MET 131 N -3.28 0.88 0.74 4.33 0.00 -1.26 -4.97 119.30 115.73 2wan s MET 131 Ca 0.04 -0.19 -0.11 0.00 0.00 0.00 0.00 55.69 55.42 2wan s MET 131 Cb 0.09 0.40 0.04 0.00 0.00 0.00 0.00 34.83 35.36 2wan s MET 131 CO 0.36 -0.28 1.09 -2.14 0.00 0.00 0.00 175.02 174.05 2wan s PRO 132 N -1.92 2.46 0.13 3.16 0.02 -1.26 -4.78 135.00 132.81 2wan s PRO 132 Ca -0.09 1.18 0.04 0.00 0.02 0.00 0.00 61.00 62.15 2wan s PRO 132 Cb -0.02 -1.92 -0.04 0.00 0.02 0.00 0.00 34.50 32.54 2wan s PRO 132 CO 0.02 -1.49 -0.09 0.00 -0.33 0.00 0.00 177.00 175.11 2wan s MET 133 N -4.76 0.99 -0.24 5.54 0.23 0.03 -4.92 119.30 116.16 2wan s MET 133 Ca 0.62 -1.41 -0.14 0.00 -1.03 0.00 0.00 55.69 53.73 2wan s MET 133 Cb -0.17 -0.50 -0.04 0.00 -1.53 0.00 0.00 34.83 32.58 2wan s MET 133 CO 0.53 0.05 0.30 0.99 -2.03 0.00 0.00 175.02 174.86 2wan s THR 134 N -3.39 5.25 0.42 3.16 2.01 -1.26 -1.40 115.64 120.42 2wan s THR 134 Ca 0.15 0.47 -0.24 0.00 0.31 0.00 0.00 61.69 62.38 2wan s THR 134 Cb 0.03 -3.64 -0.08 0.00 0.01 0.00 0.00 72.50 68.82 2wan s THR 134 CO -0.01 0.25 1.11 -0.76 -0.69 0.00 0.00 174.62 174.52 2wan s LEU 135 N 1.49 4.11 0.00 4.42 1.43 -0.43 -4.87 118.68 124.84 2wan s LEU 135 Ca 0.13 2.18 0.00 0.00 -1.03 0.00 0.00 54.13 55.41 2wan s LEU 135 Cb -0.15 -4.17 0.00 0.00 0.03 0.00 0.00 46.19 41.90 2wan s LEU 135 CO 0.08 -0.65 0.00 0.00 0.23 0.00 0.00 176.35 176.01 2wan n ALA 136 N -0.16 0.00 -1.35 4.21 0.00 -1.26 -0.70 120.51 121.25 2wan n ALA 136 Ca 0.05 0.00 -0.32 0.00 0.00 0.00 0.00 53.44 53.18 2wan n ALA 136 Cb 0.48 0.00 0.07 0.00 0.00 0.00 0.00 19.45 20.01 2wan n ALA 136 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2wan s ASP 137 N -0.07 4.71 0.26 0.00 1.11 -1.26 -3.89 116.67 117.53 2wan s ASP 137 Ca 0.00 1.92 0.00 0.00 0.18 0.00 0.00 52.55 54.65 2wan s ASP 137 Cb 0.00 -2.54 0.00 0.00 1.07 0.00 0.00 42.92 41.45 2wan s ASP 137 CO 0.00 -1.90 0.00 0.00 1.18 0.00 0.00 175.17 174.45 2wan n ALA 138 N -3.06 0.00 0.26 5.23 0.00 -1.26 -0.59 120.51 121.10 2wan n ALA 138 Ca 0.10 0.00 0.15 0.00 0.00 0.00 0.00 53.44 53.68 2wan n ALA 138 Cb 0.52 0.00 0.64 0.00 0.00 0.00 0.00 19.45 20.61 2wan n ALA 138 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2wan h ALA 139 N -0.13 1.04 -6.46 0.00 0.00 -1.79 -2.31 119.26 109.61 2wan h ALA 139 Ca 0.00 -0.08 -0.50 0.00 0.00 0.00 0.00 54.91 54.33 2wan h ALA 139 Cb 0.00 -0.01 -0.09 0.00 0.00 0.00 0.00 17.79 17.68 2wan h ALA 139 CO 0.00 0.11 -0.79 0.45 0.00 0.00 0.00 179.25 179.01 2wan n SER 140 N -3.25 -3.97 0.00 0.00 2.88 0.25 -1.37 113.62 108.17 2wan n SER 140 Ca 0.00 -0.87 0.00 0.00 -1.33 0.00 0.00 58.87 56.67 2wan n SER 140 Cb 0.33 -3.47 0.00 0.00 -0.75 0.00 0.00 64.21 60.32 2wan n SER 140 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2wan n GLY 141 N -1.60 0.80 3.78 0.46 0.00 -1.26 -4.77 105.19 102.59 2wan n GLY 141 Ca 0.03 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.65 2wan n GLY 141 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2wan s PHE 142 N -3.18 3.82 0.07 1.61 0.08 -0.47 -2.75 117.98 117.16 2wan s PHE 142 Ca 0.00 1.44 0.06 0.00 0.12 0.00 0.00 56.93 58.55 2wan s PHE 142 Cb 0.00 -2.68 -0.03 0.00 -0.57 0.00 0.00 43.02 39.75 2wan s PHE 142 CO 0.00 0.47 -0.16 0.95 -0.10 0.00 0.00 175.22 176.38 2wan s THR 143 N -0.81 1.32 -0.05 0.64 -4.23 0.28 -4.53 115.64 108.25 2wan s THR 143 Ca 0.34 -1.28 0.02 0.00 -1.18 0.00 0.00 61.69 59.59 2wan s THR 143 Cb -0.21 -1.21 0.01 0.00 1.34 0.00 0.00 72.50 72.43 2wan s THR 143 CO 0.22 -0.08 -0.10 -0.69 -0.54 0.00 0.00 174.62 173.43 2wan s VAL 144 N -1.09 0.95 -0.03 2.29 1.01 -1.24 -1.22 120.40 121.07 2wan s VAL 144 Ca 0.02 -0.39 0.04 0.00 0.00 0.00 0.00 61.98 61.66 2wan s VAL 144 Cb -0.09 -0.88 -0.01 0.00 0.00 0.00 0.00 36.38 35.40 2wan s VAL 144 CO 0.02 0.31 -0.15 -0.51 0.00 0.00 0.00 175.10 174.77 2wan s ILE 145 N 0.61 1.26 -0.67 2.22 2.07 -0.73 -0.72 121.20 125.24 2wan s ILE 145 Ca -0.12 -0.65 -0.25 0.00 -1.41 0.00 0.00 60.65 58.23 2wan s ILE 145 Cb -0.14 -1.07 0.05 0.00 0.13 0.00 0.00 42.46 41.43 2wan s ILE 145 CO 0.02 0.36 1.08 -0.62 -1.91 0.00 0.00 174.94 173.87 2wan s ASP 146 N -0.14 6.21 0.31 4.50 -1.08 0.54 -1.36 116.67 125.64 2wan s ASP 146 Ca 0.01 -0.65 0.25 0.00 -0.52 0.00 0.00 52.55 51.64 2wan s ASP 146 Cb -0.08 -2.48 1.09 0.00 -1.46 0.00 0.00 42.92 39.99 2wan s ASP 146 CO 0.01 -1.54 1.74 0.11 0.52 0.00 0.00 175.17 176.00 2wan h LYS 147 N 9.68 0.00 -0.10 4.34 1.57 -0.10 0.19 116.57 132.16 2wan h LYS 147 Ca -0.28 0.00 -0.07 0.00 -1.87 0.00 0.00 60.65 58.43 2wan h LYS 147 Cb 1.06 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.37 2wan h LYS 147 CO 1.20 0.00 -0.23 1.15 -0.57 0.00 0.00 179.45 181.00 2wan h THR 148 N 0.00 1.39 -0.00 -0.16 2.02 -1.91 -3.35 112.91 110.90 2wan h THR 148 Ca 0.00 -1.53 0.00 0.00 0.77 0.00 0.00 66.41 65.65 2wan h THR 148 Cb 0.31 2.13 0.00 0.00 -1.74 0.00 0.00 68.15 68.85 2wan h THR 148 CO 0.00 0.44 -0.76 0.35 0.37 0.00 0.00 175.52 175.92 2wan n THR 149 N -4.50 0.00 -0.37 3.16 -2.24 -1.10 -4.98 114.28 104.25 2wan n THR 149 Ca -0.07 -0.12 0.00 0.00 -2.27 0.00 0.00 64.05 61.59 2wan n THR 149 Cb 0.43 1.02 0.00 0.00 -2.10 0.00 0.00 70.33 69.69 2wan n THR 149 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2wan n GLY 150 N 1.39 2.15 3.71 3.38 0.00 0.66 -5.00 105.19 111.47 2wan n GLY 150 Ca 0.04 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.64 2wan n GLY 150 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2wan s GLU 151 N -0.04 4.28 0.10 1.61 2.12 -1.13 -4.79 118.70 120.85 2wan s GLU 151 Ca 0.00 2.13 -0.25 0.00 0.36 0.00 0.00 54.97 57.21 2wan s GLU 151 Cb 0.00 -3.34 -0.07 0.00 0.26 0.00 0.00 34.13 30.99 2wan s GLU 151 CO 0.00 -0.53 0.78 0.15 -0.54 0.00 0.00 175.26 175.12 2wan s LYS 152 N 1.54 4.53 -0.21 4.30 1.02 -1.26 -0.34 119.74 129.31 2wan s LYS 152 Ca 0.66 1.12 -0.02 0.00 0.02 0.00 0.00 55.97 57.76 2wan s LYS 152 Cb -0.37 -3.32 0.01 0.00 -0.52 0.00 0.00 37.83 33.62 2wan s LYS 152 CO 0.30 0.40 -0.09 0.42 -0.92 0.00 0.00 175.35 175.46 2wan s ILE 153 N -0.52 2.89 0.23 2.17 1.01 0.10 -4.95 121.20 122.14 2wan s ILE 153 Ca 0.38 -0.72 -0.30 0.00 0.00 0.00 0.00 60.65 60.00 2wan s ILE 153 Cb -0.22 -2.32 -0.10 0.00 0.01 0.00 0.00 42.46 39.83 2wan s ILE 153 CO 0.25 0.41 1.41 -2.84 0.00 0.00 0.00 174.94 174.17 2wan s PRO 154 N 1.40 4.30 -0.27 2.79 0.02 -1.26 -3.65 135.00 138.32 2wan s PRO 154 Ca 0.05 2.24 -0.26 0.00 0.02 0.00 0.00 61.00 63.04 2wan s PRO 154 Cb -0.14 -3.13 0.00 0.00 0.02 0.00 0.00 34.50 31.25 2wan s PRO 154 CO -0.06 -0.39 0.93 0.08 -0.33 0.00 0.00 177.00 177.23 2wan s VAL 155 N 0.09 4.72 -0.50 3.83 1.01 -1.26 -1.30 120.40 126.99 2wan s VAL 155 Ca 0.59 1.65 0.23 0.00 0.00 0.00 0.00 61.98 64.45 2wan s VAL 155 Cb -0.41 -4.24 -0.13 0.00 0.00 0.00 0.00 36.38 31.61 2wan s VAL 155 CO 0.41 -0.22 0.96 0.35 0.00 0.00 0.00 175.10 176.60 2wan n THR 156 N 5.45 0.21 -3.61 3.92 -2.24 0.23 -4.05 114.28 114.18 2wan n THR 156 Ca 0.08 -0.31 -0.13 0.00 -2.27 0.00 0.00 64.05 61.42 2wan n THR 156 Cb 0.47 0.13 -0.07 0.00 -2.10 0.00 0.00 70.33 68.76 2wan n THR 156 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 2wan s SER 157 N -4.17 -0.63 -0.17 3.42 0.15 -1.22 -4.50 113.70 106.59 2wan s SER 157 Ca 0.02 1.10 -0.04 0.00 0.70 0.00 0.00 55.95 57.73 2wan s SER 157 Cb 0.14 1.08 0.06 0.00 -1.71 0.00 0.00 66.02 65.58 2wan s SER 157 CO 0.81 -0.29 0.07 0.00 1.20 0.00 0.00 173.24 175.04 2wan s ALA 158 N -0.02 0.57 0.30 5.45 0.00 -0.87 -1.41 121.76 125.79 2wan s ALA 158 Ca -0.01 -0.37 0.10 0.00 0.00 0.00 0.00 51.96 51.67 2wan s ALA 158 Cb -0.04 -1.04 -0.06 0.00 0.00 0.00 0.00 23.12 21.99 2wan s ALA 158 CO 0.01 -1.11 -0.13 0.14 0.00 0.00 0.00 175.76 174.67 2wan s VAL 159 N 2.06 2.14 0.28 0.00 -7.23 -0.72 -4.75 120.40 112.18 2wan s VAL 159 Ca 0.01 -2.25 -0.29 0.00 -1.81 0.00 0.00 61.98 57.64 2wan s VAL 159 Cb -0.16 -2.43 -0.10 0.00 0.56 0.00 0.00 36.38 34.25 2wan s VAL 159 CO -0.08 -0.33 1.11 -0.55 -0.31 0.00 0.00 175.10 174.94 2wan s SER 160 N -3.51 7.24 0.01 4.85 0.15 -1.26 -0.06 113.70 121.12 2wan s SER 160 Ca 0.30 2.29 0.24 0.00 0.70 0.00 0.00 55.95 59.48 2wan s SER 160 Cb 0.00 -2.63 0.32 0.00 -1.71 0.00 0.00 66.02 62.00 2wan s SER 160 CO 0.14 -0.17 1.28 0.00 1.20 0.00 0.00 173.24 175.69 2wan n ALA 161 N 1.21 3.70 -1.73 5.45 0.00 -0.03 -4.68 120.51 124.43 2wan n ALA 161 Ca -0.01 -0.39 -0.42 0.00 0.00 0.00 0.00 53.44 52.62 2wan n ALA 161 Cb 0.45 -1.05 -0.03 0.00 0.00 0.00 0.00 19.45 18.82 2wan n ALA 161 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2wan n ASN 162 N -1.59 4.00 -4.77 0.00 3.02 -1.26 -4.97 115.26 109.68 2wan n ASN 162 Ca 0.05 1.08 -0.34 0.00 -0.03 0.00 0.00 54.58 55.34 2wan n ASN 162 Cb 0.35 -1.58 0.03 0.00 -0.61 0.00 0.00 39.78 37.97 2wan n ASN 162 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 2wan s PRO 163 N 0.84 3.00 -0.13 3.52 0.04 -1.26 -5.05 135.00 135.96 2wan s PRO 163 Ca 0.73 1.44 0.02 0.00 0.04 0.00 0.00 61.00 63.22 2wan s PRO 163 Cb -0.50 -1.97 0.02 0.00 0.04 0.00 0.00 34.50 32.08 2wan s PRO 163 CO 0.35 -1.10 -0.17 0.14 0.04 0.00 0.00 177.00 176.27 2wan s VAL 164 N -2.19 1.66 -0.43 -0.36 -7.23 -1.26 -5.09 120.40 105.51 2wan s VAL 164 Ca 0.68 -0.73 -0.07 0.00 -1.81 0.00 0.00 61.98 60.05 2wan s VAL 164 Cb -0.21 -1.51 0.10 0.00 0.56 0.00 0.00 36.38 35.32 2wan s VAL 164 CO 0.37 0.47 0.27 -0.89 -0.31 0.00 0.00 175.10 175.01 2wan s THR 165 N 1.05 3.94 -0.21 5.32 2.01 -1.26 -5.02 115.64 121.47 2wan s THR 165 Ca -0.04 -1.72 0.01 0.00 0.31 0.00 0.00 61.69 60.25 2wan s THR 165 Cb -0.15 -3.55 0.04 0.00 0.01 0.00 0.00 72.50 68.86 2wan s THR 165 CO -0.04 -0.65 -0.11 0.00 -0.69 0.00 0.00 174.62 173.14 2wan s ALA 166 N 1.32 2.10 -0.13 7.40 0.00 -1.26 -1.32 121.76 129.86 2wan s ALA 166 Ca 0.05 -1.28 -0.01 0.00 0.00 0.00 0.00 51.96 50.72 2wan s ALA 166 Cb -0.24 -1.32 -0.02 0.00 0.00 0.00 0.00 23.12 21.55 2wan s ALA 166 CO -0.01 -0.84 -0.12 0.08 0.00 0.00 0.00 175.76 174.87 2wan s VAL 167 N 1.35 3.15 -0.15 0.00 1.01 -0.19 -0.35 120.40 125.21 2wan s VAL 167 Ca -0.02 -0.63 -0.29 0.00 0.00 0.00 0.00 61.98 61.04 2wan s VAL 167 Cb -0.17 -2.33 -0.03 0.00 0.00 0.00 0.00 36.38 33.85 2wan s VAL 167 CO -0.08 0.52 1.48 -0.22 0.00 0.00 0.00 175.10 176.80 2wan s LEU 168 N 0.38 4.14 0.10 3.92 2.96 -0.49 -0.90 118.68 128.78 2wan s LEU 168 Ca -0.10 1.83 0.10 0.00 -0.22 0.00 0.00 54.13 55.74 2wan s LEU 168 Cb -0.16 -3.54 -0.04 0.00 0.50 0.00 0.00 46.19 42.96 2wan s LEU 168 CO 0.05 -0.96 -0.26 0.68 -1.32 0.00 0.00 176.35 174.55 2wan s VAL 169 N 4.14 2.14 -5.00 1.68 -7.23 -0.22 -4.80 120.40 111.11 2wan s VAL 169 Ca 0.65 -1.60 0.00 0.00 -1.81 0.00 0.00 61.98 59.22 2wan s VAL 169 Cb -0.26 -1.87 0.00 0.00 0.56 0.00 0.00 36.38 34.80 2wan s VAL 169 CO 0.24 0.16 0.00 0.61 -0.31 0.00 0.00 175.10 175.80 2wan n GLY 170 N 1.23 -0.26 0.63 2.32 0.00 -1.26 -0.38 105.19 107.46 2wan n GLY 170 Ca -0.18 -1.34 0.06 0.00 0.00 0.00 0.00 46.02 44.56 2wan n GLY 170 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2wan n ASP 171 N 0.74 1.83 -1.01 1.61 5.68 -0.94 -1.20 116.55 123.27 2wan n ASP 171 Ca 0.00 -1.98 0.12 0.00 -0.50 0.00 0.00 54.79 52.42 2wan n ASP 171 Cb 0.00 -0.22 0.14 0.00 -1.14 0.00 0.00 41.12 39.90 2wan n ASP 171 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2wan n LEU 172 N 0.50 3.15 -0.08 -2.12 -0.00 -1.26 -4.64 117.00 112.54 2wan n LEU 172 Ca 0.12 -1.21 -0.15 0.00 -0.00 0.00 0.00 56.01 54.77 2wan n LEU 172 Cb 0.29 -0.10 -0.04 0.00 -0.00 0.00 0.00 43.42 43.57 2wan n LEU 172 CO 0.08 0.60 0.45 1.56 -0.00 0.00 0.00 177.39 180.08 2wan h GLN 173 N 4.48 0.88 -0.33 1.47 4.20 -1.87 -2.64 115.11 121.30 2wan h GLN 173 Ca 0.00 -0.55 -0.04 0.00 0.06 0.00 0.00 58.65 58.12 2wan h GLN 173 Cb 0.97 0.06 -0.01 0.00 0.30 0.00 0.00 27.48 28.80 2wan h GLN 173 CO 0.00 1.19 0.06 1.96 -0.67 0.00 0.00 178.83 181.36 2wan h GLN 174 N 0.67 0.55 0.00 1.46 4.20 -1.79 0.30 115.11 120.51 2wan h GLN 174 Ca 0.02 -0.15 0.00 0.00 0.06 0.00 0.00 58.65 58.58 2wan h GLN 174 Cb 1.13 -0.07 0.00 0.00 0.30 0.00 0.00 27.48 28.84 2wan h GLN 174 CO 0.12 0.63 0.00 0.00 -0.67 0.00 0.00 178.83 178.91 2wan n ALA 175 N -2.34 1.06 -0.65 3.87 0.00 -1.18 -0.36 120.51 120.90 2wan n ALA 175 Ca -0.02 0.20 0.08 0.00 0.00 0.00 0.00 53.44 53.70 2wan n ALA 175 Cb 0.22 -1.32 0.25 0.00 0.00 0.00 0.00 19.45 18.59 2wan n ALA 175 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2wan n LEU 176 N -2.26 3.78 0.00 0.00 4.77 -0.92 -4.82 117.00 117.55 2wan n LEU 176 Ca -0.01 -2.57 0.00 0.00 -0.03 0.00 0.00 56.01 53.39 2wan n LEU 176 Cb 0.04 -0.45 0.00 0.00 -2.33 0.00 0.00 43.42 40.68 2wan n LEU 176 CO 0.10 0.71 0.00 0.61 -1.33 0.00 0.00 177.39 177.48 2wan n GLY 177 N 0.15 0.15 3.78 -0.72 0.00 0.51 -4.85 105.19 104.21 2wan n GLY 177 Ca 0.19 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.87 2wan n GLY 177 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wan s ALA 178 N -2.00 2.74 0.12 4.61 0.00 0.05 -4.95 121.76 122.32 2wan s ALA 178 Ca 0.00 0.71 -0.20 0.00 0.00 0.00 0.00 51.96 52.47 2wan s ALA 178 Cb 0.00 -3.31 -0.08 0.00 0.00 0.00 0.00 23.12 19.73 2wan s ALA 178 CO 0.00 -0.66 1.77 0.00 0.00 0.00 0.00 175.76 176.87 2wan h ALA 179 N 1.18 0.22 -3.12 0.00 0.00 -1.91 -3.35 119.26 112.29 2wan h ALA 179 Ca -0.49 -0.01 -0.37 0.00 0.00 0.00 0.00 54.91 54.03 2wan h ALA 179 Cb 1.24 -0.07 -0.20 0.00 0.00 0.00 0.00 17.79 18.76 2wan h ALA 179 CO 0.57 -0.29 -0.76 -0.80 0.00 0.00 0.00 179.25 177.97 2wan s ASN 180 N -5.35 1.56 0.72 0.00 0.01 -1.26 -4.87 114.94 105.75 2wan s ASN 180 Ca -0.13 -0.69 -0.11 0.00 -0.71 0.00 0.00 52.86 51.22 2wan s ASN 180 Cb 0.08 -0.03 0.02 0.00 0.41 0.00 0.00 41.25 41.74 2wan s ASN 180 CO 0.69 -0.15 1.07 0.20 -1.51 0.00 0.00 177.10 177.40 2wan s ASN 181 N -2.02 5.17 -1.32 -1.22 0.02 -1.26 -4.33 114.94 109.98 2wan s ASN 181 Ca 0.01 1.45 -0.09 0.00 -1.02 0.00 0.00 52.86 53.20 2wan s ASN 181 Cb -0.07 -2.28 0.00 0.00 0.02 0.00 0.00 41.25 38.91 2wan s ASN 181 CO 0.02 -1.55 0.53 0.79 0.02 0.00 0.00 177.10 176.90 2wan n TRP 182 N -3.18 -1.68 -3.81 2.20 7.02 -0.34 -4.94 117.44 112.70 2wan n TRP 182 Ca 0.07 0.60 -0.30 0.00 -1.02 0.00 0.00 57.50 56.85 2wan n TRP 182 Cb 0.55 -3.55 -0.15 0.00 -2.42 0.00 0.00 31.31 25.74 2wan n TRP 182 CO 0.00 0.00 0.00 0.45 -2.02 0.00 0.00 177.69 176.12 2wan s SER 183 N -4.05 4.23 0.54 -0.99 0.15 -1.26 -4.94 113.70 107.37 2wan s SER 183 Ca 0.17 -1.77 0.34 0.00 0.70 0.00 0.00 55.95 55.39 2wan s SER 183 Cb -0.07 -1.08 1.46 0.00 -1.71 0.00 0.00 66.02 64.63 2wan s SER 183 CO 0.89 -0.40 2.01 -0.65 1.20 0.00 0.00 173.24 176.28 2wan h PRO 184 N 7.96 0.00 -0.45 5.44 0.11 -1.90 -3.01 132.00 140.15 2wan h PRO 184 Ca -0.11 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.00 2wan h PRO 184 Cb 1.02 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.13 2wan h PRO 184 CO 0.48 0.00 0.00 -0.40 -0.21 0.00 0.00 178.00 177.87 2wan n ASP 185 N -3.01 3.33 -4.48 -2.05 5.75 -1.26 -4.08 116.55 110.76 2wan n ASP 185 Ca 0.00 -1.97 -0.43 0.00 -0.01 0.00 0.00 54.79 52.38 2wan n ASP 185 Cb 0.27 -0.29 -0.05 0.00 -1.03 0.00 0.00 41.12 40.02 2wan n ASP 185 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 2wan s ASP 186 N -1.36 6.26 0.00 -1.12 -1.08 -1.14 -4.91 116.67 113.33 2wan s ASP 186 Ca 0.40 -0.70 0.11 0.00 -0.52 0.00 0.00 52.55 51.84 2wan s ASP 186 Cb 0.22 -2.38 0.67 0.00 -1.46 0.00 0.00 42.92 39.97 2wan s ASP 186 CO 0.31 -1.17 1.27 0.47 0.52 0.00 0.00 175.17 176.57 2wan n ASP 187 N 7.08 0.00 -0.20 -0.34 8.00 -1.26 -3.12 116.55 126.71 2wan n ASP 187 Ca -0.02 -1.24 0.05 0.00 0.71 0.00 0.00 54.79 54.29 2wan n ASP 187 Cb 0.46 0.00 0.31 0.00 -0.02 0.00 0.00 41.12 41.88 2wan n ASP 187 CO 0.00 0.00 0.00 -0.74 -0.39 0.00 0.00 177.20 176.07 2wan h HIS 188 N 0.00 0.84 -0.54 1.24 2.76 -1.97 -2.46 115.15 115.02 2wan h HIS 188 Ca 0.00 0.02 -0.31 0.00 -2.20 0.00 0.00 60.37 57.88 2wan h HIS 188 Cb 0.00 -0.28 -0.19 0.00 1.55 0.00 0.00 27.41 28.49 2wan h HIS 188 CO 0.00 0.47 0.00 0.25 -1.30 0.00 0.00 177.93 177.35 2wan n THR 189 N -4.47 2.74 -2.23 6.26 -2.24 -1.18 -4.96 114.28 108.20 2wan n THR 189 Ca 0.10 -2.87 -0.42 0.00 -2.27 0.00 0.00 64.05 58.59 2wan n THR 189 Cb 0.17 -0.52 -0.03 0.00 -2.10 0.00 0.00 70.33 67.85 2wan n THR 189 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 2wan s LEU 190 N -3.36 4.38 0.34 3.22 2.96 -0.93 -1.40 118.68 123.89 2wan s LEU 190 Ca 0.49 2.28 -0.27 0.00 -0.22 0.00 0.00 54.13 56.41 2wan s LEU 190 Cb 0.43 -3.59 -0.09 0.00 0.50 0.00 0.00 46.19 43.44 2wan s LEU 190 CO 0.01 -0.60 1.08 -0.76 -1.32 0.00 0.00 176.35 174.77 2wan s LEU 191 N 0.89 4.34 -0.02 -0.68 1.02 0.52 -4.89 118.68 119.86 2wan s LEU 191 Ca 0.62 2.18 -0.06 0.00 0.02 0.00 0.00 54.13 56.89 2wan s LEU 191 Cb -0.35 -3.90 -0.05 0.00 0.02 0.00 0.00 46.19 41.91 2wan s LEU 191 CO 0.31 -0.35 0.24 -0.54 0.02 0.00 0.00 176.35 176.03 2wan s LYS 192 N -1.98 3.54 -0.17 1.70 1.02 0.49 -4.76 119.74 119.58 2wan s LYS 192 Ca 0.51 -0.11 -0.29 0.00 0.02 0.00 0.00 55.97 56.10 2wan s LYS 192 Cb -0.28 -3.11 -0.03 0.00 -0.52 0.00 0.00 37.83 33.89 2wan s LYS 192 CO 0.35 0.68 1.62 0.21 -0.92 0.00 0.00 175.35 177.29 2wan s LYS 193 N -1.65 3.91 -0.20 1.68 2.20 -1.26 -1.10 119.74 123.32 2wan s LYS 193 Ca 0.25 1.82 -0.17 0.00 -0.36 0.00 0.00 55.97 57.51 2wan s LYS 193 Cb -0.13 -4.02 -0.13 0.00 -1.51 0.00 0.00 37.83 32.05 2wan s LYS 193 CO 0.14 -1.16 -0.01 -0.89 -0.36 0.00 0.00 175.35 173.08 2wan n ILE 194 N 6.13 1.50 -4.36 5.43 2.08 0.87 -4.97 119.36 126.04 2wan n ILE 194 Ca 0.18 0.01 -0.20 0.00 0.56 0.00 0.00 62.75 63.30 2wan n ILE 194 Cb 0.44 -2.14 -0.09 0.00 -0.75 0.00 0.00 39.64 37.11 2wan n ILE 194 CO 0.00 0.00 0.00 0.54 0.56 0.00 0.00 176.55 177.65 2wan s ASN 195 N -6.55 1.84 0.54 4.38 2.20 -1.06 -4.99 114.94 111.31 2wan s ASN 195 Ca -0.26 -1.65 0.34 0.00 -0.94 0.00 0.00 52.86 50.34 2wan s ASN 195 Cb 0.06 0.48 1.83 0.00 -2.00 0.00 0.00 41.25 41.62 2wan s ASN 195 CO 0.46 -0.96 2.02 -0.65 -2.94 0.00 0.00 177.10 175.03 2wan h PRO 196 N 2.10 0.00 0.00 3.55 0.11 -1.97 -1.88 132.00 133.90 2wan h PRO 196 Ca -0.31 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.79 2wan h PRO 196 Cb 1.25 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.34 2wan h PRO 196 CO 0.47 0.00 -0.38 -1.71 -0.21 0.00 0.00 178.00 176.17 2wan n ASN 197 N -2.74 1.81 -3.44 -2.05 5.15 -1.26 -4.89 115.26 107.83 2wan n ASN 197 Ca -0.02 -3.49 -0.11 0.00 -0.60 0.00 0.00 54.58 50.36 2wan n ASN 197 Cb 0.13 -0.48 -0.09 0.00 -0.53 0.00 0.00 39.78 38.81 2wan n ASN 197 CO 0.00 0.00 0.00 -0.22 1.40 0.00 0.00 177.26 178.44 2wan s LEU 198 N -2.83 -0.52 -0.10 1.20 2.96 -0.71 -4.30 118.68 114.37 2wan s LEU 198 Ca 0.35 0.29 0.03 0.00 -0.22 0.00 0.00 54.13 54.58 2wan s LEU 198 Cb 0.33 1.00 -0.01 0.00 0.50 0.00 0.00 46.19 48.01 2wan s LEU 198 CO -0.04 -0.29 -0.20 -0.31 -1.32 0.00 0.00 176.35 174.19 2wan s TYR 199 N 2.51 2.64 0.04 5.38 2.02 -0.72 -0.09 117.35 129.13 2wan s TYR 199 Ca 0.09 -0.79 -0.00 0.00 -0.37 0.00 0.00 57.07 56.00 2wan s TYR 199 Cb -0.15 -1.73 -0.03 0.00 -0.40 0.00 0.00 41.96 39.65 2wan s TYR 199 CO -0.14 -0.27 -0.04 -0.65 -1.57 0.00 0.00 175.55 172.88 2wan s GLN 200 N 0.19 0.49 -0.02 -0.62 -0.21 -0.26 -0.38 119.66 118.86 2wan s GLN 200 Ca -0.12 -0.93 0.00 0.00 0.02 0.00 0.00 55.36 54.33 2wan s GLN 200 Cb -0.16 0.09 0.02 0.00 1.00 0.00 0.00 33.01 33.96 2wan s GLN 200 CO 0.06 -0.06 0.02 -1.17 -2.12 0.00 0.00 175.29 172.02 2wan s LEU 201 N -2.19 1.30 0.12 2.90 2.96 -0.42 -0.38 118.68 122.97 2wan s LEU 201 Ca -0.04 0.03 0.07 0.00 -0.22 0.00 0.00 54.13 53.97 2wan s LEU 201 Cb -0.01 -0.06 -0.04 0.00 0.50 0.00 0.00 46.19 46.58 2wan s LEU 201 CO -0.05 -0.10 -0.07 -0.44 -1.32 0.00 0.00 176.35 174.38 2wan s SER 202 N 0.81 4.54 -0.06 3.68 0.01 -1.26 -0.00 113.70 121.43 2wan s SER 202 Ca -0.07 -0.37 -0.30 0.00 1.31 0.00 0.00 55.95 56.52 2wan s SER 202 Cb -0.10 -0.91 0.11 0.00 0.21 0.00 0.00 66.02 65.33 2wan s SER 202 CO -0.02 0.16 0.96 -0.83 0.41 0.00 0.00 173.24 173.91 2wan s GLY 203 N -2.39 -0.41 -0.19 3.44 0.00 -0.79 -4.99 107.32 102.00 2wan s GLY 203 Ca 0.23 1.24 -0.13 0.00 0.00 0.00 0.00 44.72 46.05 2wan s GLY 203 CO 0.15 0.45 0.28 -1.59 0.00 0.00 0.00 173.10 172.39 2wan s THR 204 N -2.77 5.30 -0.09 0.90 2.01 -1.26 -0.68 115.64 119.05 2wan s THR 204 Ca 0.05 0.49 0.02 0.00 0.31 0.00 0.00 61.69 62.56 2wan s THR 204 Cb -0.01 -3.62 -0.02 0.00 0.01 0.00 0.00 72.50 68.86 2wan s THR 204 CO -0.07 0.35 -0.14 -0.76 -0.69 0.00 0.00 174.62 173.31 2wan s LEU 205 N 0.77 2.70 0.79 4.42 1.02 -0.68 -4.80 118.68 122.90 2wan s LEU 205 Ca 0.15 -0.27 -0.12 0.00 0.02 0.00 0.00 54.13 53.91 2wan s LEU 205 Cb -0.13 -1.57 0.07 0.00 0.02 0.00 0.00 46.19 44.58 2wan s LEU 205 CO 0.04 0.26 1.12 -2.84 0.02 0.00 0.00 176.35 174.96 2wan s PRO 206 N -0.20 1.96 0.47 1.29 0.02 -1.26 -2.10 135.00 135.17 2wan s PRO 206 Ca 0.00 1.39 -0.22 0.00 0.02 0.00 0.00 61.00 62.19 2wan s PRO 206 Cb -0.13 -1.85 -0.10 0.00 0.02 0.00 0.00 34.50 32.44 2wan s PRO 206 CO 0.03 -1.90 0.77 0.00 -0.33 0.00 0.00 177.00 175.57 2wan n ALA 207 N -3.47 -0.60 0.00 -1.55 0.00 -1.26 -4.79 120.51 108.83 2wan n ALA 207 Ca 0.11 0.14 0.00 0.00 0.00 0.00 0.00 53.44 53.68 2wan n ALA 207 Cb 0.52 -1.94 0.00 0.00 0.00 0.00 0.00 19.45 18.03 2wan n ALA 207 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wan n GLY 208 N 1.50 0.98 3.76 0.00 0.00 -0.11 -4.93 105.19 106.38 2wan n GLY 208 Ca 0.11 -1.94 -0.36 0.00 0.00 0.00 0.00 46.02 43.84 2wan n GLY 208 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2wan s THR 209 N -1.11 5.18 0.22 2.61 -4.23 -1.26 0.44 115.64 117.49 2wan s THR 209 Ca 0.00 0.10 0.03 0.00 -1.18 0.00 0.00 61.69 60.63 2wan s THR 209 Cb 0.00 -3.30 -0.05 0.00 1.34 0.00 0.00 72.50 70.49 2wan s THR 209 CO 0.00 0.53 0.01 -0.31 -0.54 0.00 0.00 174.62 174.32 2wan s TYR 210 N -0.30 1.45 0.01 3.99 2.02 0.23 -4.99 117.35 119.76 2wan s TYR 210 Ca 0.10 -0.99 0.04 0.00 -0.37 0.00 0.00 57.07 55.85 2wan s TYR 210 Cb -0.12 -0.84 -0.01 0.00 -0.40 0.00 0.00 41.96 40.59 2wan s TYR 210 CO 0.01 -0.14 -0.12 -0.65 -1.57 0.00 0.00 175.55 173.09 2wan s GLN 211 N -3.90 0.87 0.16 -0.62 -0.21 -1.26 -1.24 119.66 113.45 2wan s GLN 211 Ca 0.28 -0.55 -0.11 0.00 0.02 0.00 0.00 55.36 55.01 2wan s GLN 211 Cb 0.06 -0.84 0.00 0.00 1.00 0.00 0.00 33.01 33.23 2wan s GLN 211 CO 0.08 0.22 0.33 1.52 -2.12 0.00 0.00 175.29 175.32 2wan s TYR 212 N -0.55 0.25 0.32 0.91 -0.85 -0.31 -2.21 117.35 114.92 2wan s TYR 212 Ca 0.02 -0.62 0.03 0.00 -0.52 0.00 0.00 57.07 55.98 2wan s TYR 212 Cb -0.06 0.05 -0.02 0.00 0.38 0.00 0.00 41.96 42.31 2wan s TYR 212 CO 0.00 -0.75 0.34 0.15 -1.52 0.00 0.00 175.55 173.77 2wan s LYS 213 N -3.93 1.76 -0.22 -3.49 1.02 0.49 -0.57 119.74 114.79 2wan s LYS 213 Ca 0.14 -1.88 -0.02 0.00 0.02 0.00 0.00 55.97 54.24 2wan s LYS 213 Cb 0.02 0.37 0.01 0.00 -0.52 0.00 0.00 37.83 37.71 2wan s LYS 213 CO -0.02 -0.68 -0.10 0.42 -0.92 0.00 0.00 175.35 174.06 2wan s ILE 214 N -3.38 2.79 -0.12 2.17 -1.09 0.62 -1.05 121.20 121.14 2wan s ILE 214 Ca 0.37 -0.81 -0.06 0.00 -2.23 0.00 0.00 60.65 57.92 2wan s ILE 214 Cb 0.02 -2.29 -0.04 0.00 -1.58 0.00 0.00 42.46 38.57 2wan s ILE 214 CO 0.23 0.39 0.10 0.00 -1.23 0.00 0.00 174.94 174.43 2wan s ALA 215 N 1.37 3.70 0.03 9.38 0.00 -0.08 -0.49 121.76 135.66 2wan s ALA 215 Ca 0.04 -0.69 -0.01 0.00 0.00 0.00 0.00 51.96 51.30 2wan s ALA 215 Cb -0.15 -1.86 -0.04 0.00 0.00 0.00 0.00 23.12 21.08 2wan s ALA 215 CO -0.07 0.57 0.19 -0.51 0.00 0.00 0.00 175.76 175.93 2wan s LEU 216 N -0.85 4.32 -1.57 0.00 1.43 -0.34 -1.03 118.68 120.64 2wan s LEU 216 Ca 0.14 0.29 -0.01 0.00 -1.03 0.00 0.00 54.13 53.51 2wan s LEU 216 Cb -0.12 -2.75 0.00 0.00 0.03 0.00 0.00 46.19 43.36 2wan s LEU 216 CO 0.03 0.22 0.09 0.47 0.23 0.00 0.00 176.35 177.38 2wan n ASP 217 N 0.64 -5.39 -1.41 2.29 8.00 -0.43 -2.38 116.55 117.86 2wan n ASP 217 Ca -0.08 -0.01 -0.17 0.00 0.71 0.00 0.00 54.79 55.24 2wan n ASP 217 Cb 0.52 -4.49 -0.06 0.00 -0.02 0.00 0.00 41.12 37.07 2wan n ASP 217 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 2wan n HIS 218 N -3.92 -0.17 -4.24 1.24 8.25 -1.26 -4.99 115.22 110.14 2wan n HIS 218 Ca -0.20 0.00 -0.18 0.00 -0.26 0.00 0.00 57.72 57.08 2wan n HIS 218 Cb 0.66 -2.98 -0.08 0.00 1.12 0.00 0.00 29.99 28.71 2wan n HIS 218 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 2wan s SER 219 N -2.70 1.40 0.00 0.41 1.04 -1.00 -4.19 113.70 108.66 2wan s SER 219 Ca 0.00 -1.68 0.21 0.00 0.48 0.00 0.00 55.95 54.96 2wan s SER 219 Cb 0.00 0.56 0.53 0.00 0.10 0.00 0.00 66.02 67.21 2wan s SER 219 CO 0.00 -1.08 1.45 0.79 0.98 0.00 0.00 173.24 175.37 2wan n TRP 220 N -0.58 0.50 -0.17 5.02 7.02 -1.26 -4.07 117.44 123.90 2wan n TRP 220 Ca 0.06 -0.25 -0.02 0.00 -1.02 0.00 0.00 57.50 56.27 2wan n TRP 220 Cb 0.63 0.00 0.08 0.00 -2.42 0.00 0.00 31.31 29.59 2wan n TRP 220 CO 0.00 0.00 0.00 -0.97 -2.02 0.00 0.00 177.69 174.70 2wan h ASN 221 N 3.61 0.06 -3.25 -0.99 -0.73 -1.96 -3.39 115.58 108.93 2wan h ASN 221 Ca 0.00 0.09 -0.49 0.00 1.87 0.00 0.00 56.30 57.77 2wan h ASN 221 Cb 0.80 0.11 -0.38 0.00 0.27 0.00 0.00 38.32 39.12 2wan h ASN 221 CO 0.00 0.05 -0.78 -0.89 -0.37 0.00 0.00 177.43 175.45 2wan s THR 222 N -6.13 0.63 0.06 -3.57 2.01 -1.26 -5.10 115.64 102.28 2wan s THR 222 Ca -0.13 -0.19 0.02 0.00 0.31 0.00 0.00 61.69 61.70 2wan s THR 222 Cb 0.16 -0.83 -0.03 0.00 0.01 0.00 0.00 72.50 71.81 2wan s THR 222 CO 0.73 0.18 -0.07 -0.94 -0.69 0.00 0.00 174.62 173.82 2wan s SER 223 N 1.85 0.96 0.11 3.53 1.04 -1.26 -1.20 113.70 118.73 2wan s SER 223 Ca 0.03 -0.69 0.06 0.00 0.48 0.00 0.00 55.95 55.83 2wan s SER 223 Cb -0.14 0.05 -0.04 0.00 0.10 0.00 0.00 66.02 66.00 2wan s SER 223 CO -0.07 -0.28 -0.15 -0.31 0.98 0.00 0.00 173.24 173.40 2wan s TYR 224 N -2.09 1.44 0.00 5.02 2.02 0.35 -4.72 117.35 119.38 2wan s TYR 224 Ca -0.03 -0.50 0.00 0.00 -0.37 0.00 0.00 57.07 56.17 2wan s TYR 224 Cb -0.05 -0.77 0.00 0.00 -0.40 0.00 0.00 41.96 40.74 2wan s TYR 224 CO -0.01 0.14 0.00 -0.35 -1.57 0.00 0.00 175.55 173.76 2wan n PRO 225 N 0.80 2.39 -0.15 -1.71 -0.04 -1.26 -0.28 135.00 134.75 2wan n PRO 225 Ca -0.17 0.00 -0.01 0.00 -0.04 0.00 0.00 63.50 63.28 2wan n PRO 225 Cb 0.56 0.00 0.24 0.00 -0.04 0.00 0.00 33.50 34.26 2wan n PRO 225 CO 0.00 0.00 0.00 0.78 -0.04 0.00 0.00 175.50 176.24 2wan h GLY 226 N 0.00 0.92 -2.09 0.55 0.00 -1.97 -3.45 103.07 97.03 2wan h GLY 226 Ca 0.00 -0.43 -0.50 0.00 0.00 0.00 0.00 47.33 46.40 2wan h GLY 226 CO 0.00 0.41 -0.64 -1.31 0.00 0.00 0.00 176.54 175.00 2wan s ASN 227 N -6.50 2.74 0.40 0.19 0.01 -1.26 -5.12 114.94 105.40 2wan s ASN 227 Ca -0.10 -1.29 -0.27 0.00 -0.71 0.00 0.00 52.86 50.49 2wan s ASN 227 Cb 0.17 -0.16 -0.10 0.00 0.41 0.00 0.00 41.25 41.56 2wan s ASN 227 CO 0.78 -0.46 1.47 0.20 -1.51 0.00 0.00 177.10 177.58 2wan s ASN 228 N -3.49 6.20 -0.20 -1.22 0.02 -1.26 -4.91 114.94 110.07 2wan s ASN 228 Ca 0.33 3.01 -0.10 0.00 -1.02 0.00 0.00 52.86 55.07 2wan s ASN 228 Cb 0.06 -2.66 -0.05 0.00 0.02 0.00 0.00 41.25 38.62 2wan s ASN 228 CO 0.14 -0.97 0.15 -0.69 0.02 0.00 0.00 177.10 175.75 2wan s VAL 229 N -1.15 5.40 0.06 1.60 1.01 0.26 -4.91 120.40 122.68 2wan s VAL 229 Ca 0.55 0.22 -0.26 0.00 0.00 0.00 0.00 61.98 62.49 2wan s VAL 229 Cb -0.46 -3.49 -0.06 0.00 0.00 0.00 0.00 36.38 32.38 2wan s VAL 229 CO 0.61 0.42 0.81 -0.44 0.00 0.00 0.00 175.10 176.50 2wan s SER 230 N 0.44 7.28 -0.11 3.32 0.01 -1.26 -1.16 113.70 122.22 2wan s SER 230 Ca 0.09 1.53 -0.02 0.00 1.31 0.00 0.00 55.95 58.85 2wan s SER 230 Cb -0.11 -2.49 0.04 0.00 0.21 0.00 0.00 66.02 63.66 2wan s SER 230 CO -0.01 0.00 0.04 -0.22 0.41 0.00 0.00 173.24 173.46 2wan s LEU 231 N -0.08 0.57 -0.22 2.44 2.96 -0.38 -4.97 118.68 119.01 2wan s LEU 231 Ca 0.40 -0.30 -0.08 0.00 -0.22 0.00 0.00 54.13 53.93 2wan s LEU 231 Cb -0.21 -0.37 -0.04 0.00 0.50 0.00 0.00 46.19 46.07 2wan s LEU 231 CO 0.24 -0.26 0.08 0.42 -1.32 0.00 0.00 176.35 175.52 2wan s THR 232 N 2.02 4.70 -0.28 3.68 -4.23 -1.26 0.75 115.64 121.03 2wan s THR 232 Ca 0.03 -0.05 -0.11 0.00 -1.18 0.00 0.00 61.69 60.38 2wan s THR 232 Cb -0.14 -3.17 -0.05 0.00 1.34 0.00 0.00 72.50 70.49 2wan s THR 232 CO -0.06 0.39 0.18 -0.69 -0.54 0.00 0.00 174.62 173.90 2wan s VAL 233 N 1.00 5.27 1.17 2.29 1.01 0.17 -4.96 120.40 126.34 2wan s VAL 233 Ca 0.05 0.16 -0.16 0.00 0.00 0.00 0.00 61.98 62.03 2wan s VAL 233 Cb -0.14 -3.51 0.27 0.00 0.00 0.00 0.00 36.38 33.00 2wan s VAL 233 CO 0.03 0.26 1.05 -2.16 0.00 0.00 0.00 175.10 174.28 2wan s PRO 234 N 1.73 -0.92 0.02 2.72 0.04 -1.26 -0.94 135.00 136.40 2wan s PRO 234 Ca 0.07 0.40 -0.39 0.00 0.04 0.00 0.00 61.00 61.12 2wan s PRO 234 Cb -0.16 -1.59 -0.19 0.00 0.04 0.00 0.00 34.50 32.60 2wan s PRO 234 CO 0.10 -3.61 1.12 -1.91 0.04 0.00 0.00 177.00 172.75 2wan n GLU 235 N -4.77 0.24 0.00 4.56 4.07 -1.26 -2.12 120.64 121.35 2wan n GLU 235 Ca 0.07 0.09 0.00 0.00 -0.06 0.00 0.00 57.16 57.26 2wan n GLU 235 Cb 0.57 -1.61 0.00 0.00 -0.06 0.00 0.00 31.44 30.34 2wan n GLU 235 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2wan n GLY 236 N 1.71 2.04 0.00 8.31 0.00 -1.26 -4.91 105.19 111.08 2wan n GLY 236 Ca 0.20 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.22 2wan n GLY 236 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wan n GLY 237 N -2.00 -0.34 3.59 -0.02 0.00 -0.90 -4.80 105.19 100.73 2wan n GLY 237 Ca 0.00 -1.75 -0.15 0.00 0.00 0.00 0.00 46.02 44.13 2wan n GLY 237 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2wan s GLU 238 N -1.98 0.85 -0.07 1.61 2.12 -0.89 -4.82 118.70 115.52 2wan s GLU 238 Ca 0.00 0.86 -0.30 0.00 0.36 0.00 0.00 54.97 55.89 2wan s GLU 238 Cb 0.00 0.41 -0.03 0.00 0.26 0.00 0.00 34.13 34.78 2wan s GLU 238 CO 0.00 -0.13 1.12 0.21 -0.54 0.00 0.00 175.26 175.92 2wan s LYS 239 N 0.13 4.39 -0.04 4.30 2.20 -1.26 -1.69 119.74 127.77 2wan s LYS 239 Ca -0.02 1.56 0.07 0.00 -0.36 0.00 0.00 55.97 57.22 2wan s LYS 239 Cb -0.04 -3.54 -0.02 0.00 -1.51 0.00 0.00 37.83 32.72 2wan s LYS 239 CO 0.02 -0.38 -0.25 0.08 -0.36 0.00 0.00 175.35 174.47 2wan s VAL 240 N 2.05 2.13 -0.18 4.02 1.01 0.15 -4.95 120.40 124.63 2wan s VAL 240 Ca 0.53 -1.06 -0.07 0.00 0.00 0.00 0.00 61.98 61.38 2wan s VAL 240 Cb -0.22 -1.76 -0.04 0.00 0.00 0.00 0.00 36.38 34.36 2wan s VAL 240 CO 0.21 0.58 0.06 -0.89 0.00 0.00 0.00 175.10 175.05 2wan s THR 241 N -0.39 4.78 -0.11 3.92 2.01 -1.26 -1.88 115.64 122.70 2wan s THR 241 Ca 0.03 -0.04 -0.02 0.00 0.31 0.00 0.00 61.69 61.98 2wan s THR 241 Cb -0.12 -3.15 -0.03 0.00 0.01 0.00 0.00 72.50 69.21 2wan s THR 241 CO 0.01 0.47 -0.03 -0.36 -0.69 0.00 0.00 174.62 174.02 2wan s PHE 242 N 0.32 3.06 -0.03 4.92 0.08 1.00 -0.96 117.98 126.37 2wan s PHE 242 Ca 0.03 -0.02 0.04 0.00 0.12 0.00 0.00 56.93 57.10 2wan s PHE 242 Cb -0.12 -1.83 -0.00 0.00 -0.57 0.00 0.00 43.02 40.49 2wan s PHE 242 CO 0.00 0.26 -0.13 0.99 -0.10 0.00 0.00 175.22 176.24 2wan s THR 243 N -0.41 1.10 -0.08 0.64 2.01 0.24 -1.30 115.64 117.83 2wan s THR 243 Ca 0.07 -0.55 0.02 0.00 0.31 0.00 0.00 61.69 61.54 2wan s THR 243 Cb -0.12 -0.95 0.01 0.00 0.01 0.00 0.00 72.50 71.45 2wan s THR 243 CO 0.02 0.32 -0.14 -0.47 -0.69 0.00 0.00 174.62 173.67 2wan s TYR 244 N 0.04 1.70 -0.36 4.92 5.04 0.49 -1.38 117.35 127.80 2wan s TYR 244 Ca -0.02 -0.70 -0.08 0.00 -2.44 0.00 0.00 57.07 53.84 2wan s TYR 244 Cb -0.09 -1.23 0.04 0.00 0.35 0.00 0.00 41.96 41.03 2wan s TYR 244 CO 0.01 -0.36 0.15 0.42 -1.34 0.00 0.00 175.55 174.44 2wan s ILE 245 N 0.78 4.01 0.26 3.14 -1.09 -0.27 -1.76 121.20 126.27 2wan s ILE 245 Ca -0.12 -1.13 -0.02 0.00 -2.23 0.00 0.00 60.65 57.14 2wan s ILE 245 Cb -0.16 -3.30 0.26 0.00 -1.58 0.00 0.00 42.46 37.68 2wan s ILE 245 CO 0.02 -0.25 1.86 -0.65 -1.23 0.00 0.00 174.94 174.69 2wan h PRO 246 N 8.29 1.02 -0.81 2.79 0.11 -1.88 0.25 132.00 141.76 2wan h PRO 246 Ca -0.23 -0.06 0.05 0.00 0.11 0.00 0.00 66.00 65.87 2wan h PRO 246 Cb 1.09 -0.23 -0.05 0.00 0.11 0.00 0.00 31.00 31.92 2wan h PRO 246 CO 0.64 0.67 0.53 0.66 -0.21 0.00 0.00 178.00 180.30 2wan h SER 247 N 1.05 0.82 -0.00 -2.05 4.64 -1.90 -3.19 113.55 112.91 2wan h SER 247 Ca 0.43 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.75 2wan h SER 247 Cb 0.27 -0.18 0.00 0.00 -0.31 0.00 0.00 62.40 62.18 2wan h SER 247 CO -0.20 0.54 -0.12 0.35 -0.87 0.00 0.00 176.83 176.52 2wan n THR 248 N -4.47 0.00 -1.53 2.95 -2.24 -1.10 -4.52 114.28 103.37 2wan n THR 248 Ca 0.11 -0.44 -0.18 0.00 -2.27 0.00 0.00 64.05 61.27 2wan n THR 248 Cb 0.17 1.04 -0.08 0.00 -2.10 0.00 0.00 70.33 69.36 2wan n THR 248 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 2wan n ASN 249 N -0.58 -5.44 -4.77 3.42 5.03 0.86 -4.97 115.26 108.81 2wan n ASN 249 Ca 0.02 0.45 -0.38 0.00 0.87 0.00 0.00 54.58 55.54 2wan n ASN 249 Cb 0.09 -4.53 -0.03 0.00 -1.02 0.00 0.00 39.78 34.28 2wan n ASN 249 CO 0.00 0.00 0.00 -1.10 -1.83 0.00 0.00 177.26 174.33 2wan s GLN 250 N -3.53 4.17 -0.10 3.52 -0.21 -1.14 -4.78 119.66 117.60 2wan s GLN 250 Ca 0.00 1.70 0.02 0.00 0.02 0.00 0.00 55.36 57.10 2wan s GLN 250 Cb 0.00 -2.68 0.01 0.00 1.00 0.00 0.00 33.01 31.34 2wan s GLN 250 CO 0.00 -0.18 -0.14 0.08 -2.12 0.00 0.00 175.29 172.93 2wan s VAL 251 N -1.48 1.35 0.13 1.09 1.01 -1.26 -1.11 120.40 120.13 2wan s VAL 251 Ca 0.56 -0.56 0.05 0.00 0.00 0.00 0.00 61.98 62.03 2wan s VAL 251 Cb -0.27 -1.25 -0.04 0.00 0.00 0.00 0.00 36.38 34.82 2wan s VAL 251 CO 0.34 0.41 -0.13 -0.36 0.00 0.00 0.00 175.10 175.37 2wan s PHE 252 N 0.95 1.36 0.16 5.22 0.08 -0.48 -4.97 117.98 120.29 2wan s PHE 252 Ca -0.08 -0.62 0.05 0.00 0.12 0.00 0.00 56.93 56.41 2wan s PHE 252 Cb -0.15 -0.70 -0.04 0.00 -0.57 0.00 0.00 43.02 41.56 2wan s PHE 252 CO -0.00 0.13 -0.12 0.16 -0.10 0.00 0.00 175.22 175.30 2wan s ASP 253 N -2.71 2.03 0.00 1.36 -4.77 -1.26 -0.59 116.67 110.72 2wan s ASP 253 Ca 0.12 -1.00 0.25 0.00 -3.30 0.00 0.00 52.55 48.62 2wan s ASP 253 Cb -0.02 -0.05 1.06 0.00 -1.09 0.00 0.00 42.92 42.81 2wan s ASP 253 CO 0.02 -0.27 1.79 -1.54 0.70 0.00 0.00 175.17 175.88 2wan n SER 254 N -0.19 0.00 -0.10 2.11 3.41 -0.14 -1.22 113.62 117.49 2wan n SER 254 Ca -0.10 0.50 -0.20 0.00 -0.26 0.00 0.00 58.87 58.81 2wan n SER 254 Cb 0.60 -0.50 -0.11 0.00 -0.26 0.00 0.00 64.21 63.94 2wan n SER 254 CO 0.00 0.00 0.00 0.58 -0.16 0.00 0.00 175.04 175.46 2wan h VAL 255 N 0.00 1.03 0.00 -3.33 2.07 -1.91 -3.17 116.25 110.93 2wan h VAL 255 Ca 0.00 -2.16 -0.09 0.00 0.82 0.00 0.00 66.70 65.27 2wan h VAL 255 Cb 0.43 2.33 -0.01 0.00 -1.52 0.00 0.00 31.29 32.51 2wan h VAL 255 CO 0.00 0.35 -0.45 0.78 0.02 0.00 0.00 177.57 178.27 2wan h ASN 256 N -1.00 0.00 -2.56 0.57 2.35 -1.93 -3.38 115.58 109.63 2wan h ASN 256 Ca -0.27 0.00 -0.59 0.00 -0.55 0.00 0.00 56.30 54.89 2wan h ASN 256 Cb 1.21 0.00 -0.39 0.00 0.05 0.00 0.00 38.32 39.19 2wan h ASN 256 CO -0.17 0.45 -0.90 -1.00 -1.65 0.00 0.00 177.43 174.16 2wan s HIS 257 N -3.64 1.24 0.07 1.19 3.76 -0.36 -5.01 115.29 112.54 2wan s HIS 257 Ca -0.00 -2.22 -0.36 0.00 -0.15 0.00 0.00 55.06 52.33 2wan s HIS 257 Cb 0.12 -1.12 -0.19 0.00 1.11 0.00 0.00 32.58 32.50 2wan s HIS 257 CO 0.71 -0.80 1.54 -1.35 -0.85 0.00 0.00 174.74 173.99 2wan h PRO 258 N 6.07 -1.12 -1.76 8.40 0.11 -1.73 -3.28 132.00 138.68 2wan h PRO 258 Ca 0.18 0.08 -0.59 0.00 0.11 0.00 0.00 66.00 65.78 2wan h PRO 258 Cb 0.92 0.26 -0.42 0.00 0.11 0.00 0.00 31.00 31.86 2wan h PRO 258 CO 0.38 -0.75 -0.71 -1.71 -0.21 0.00 0.00 178.00 175.00 2wan n ASN 259 N -5.48 4.62 -4.77 -2.05 2.85 -1.26 -4.87 115.26 104.30 2wan n ASN 259 Ca -0.14 -3.70 -0.40 0.00 -0.11 0.00 0.00 54.58 50.23 2wan n ASN 259 Cb 0.49 -0.49 -0.01 0.00 1.24 0.00 0.00 39.78 41.01 2wan n ASN 259 CO 0.00 0.00 0.00 -1.58 -2.11 0.00 0.00 177.26 173.57 2wan s GLN 260 N -3.52 4.05 0.13 1.20 -0.44 -1.24 -5.00 119.66 114.85 2wan s GLN 260 Ca 0.48 2.15 -0.28 0.00 -2.50 0.00 0.00 55.36 55.22 2wan s GLN 260 Cb 0.36 -2.82 -0.07 0.00 -1.64 0.00 0.00 33.01 28.85 2wan s GLN 260 CO -0.17 -0.42 0.87 0.00 0.50 0.00 0.00 175.29 176.07 2wan s ALA 261 N -1.24 3.33 -0.10 1.58 0.00 -1.26 -5.07 121.76 119.00 2wan s ALA 261 Ca 0.55 0.47 0.03 0.00 0.00 0.00 0.00 51.96 53.02 2wan s ALA 261 Cb -0.38 -3.13 -0.01 0.00 0.00 0.00 0.00 23.12 19.60 2wan s ALA 261 CO 0.49 0.11 -0.20 -0.06 0.00 0.00 0.00 175.76 176.09 2wan s PHE 262 N -0.48 2.62 0.58 0.00 0.08 -1.26 -5.12 117.98 114.41 2wan s PHE 262 Ca 0.41 -0.84 -0.17 0.00 0.12 0.00 0.00 56.93 56.46 2wan s PHE 262 Cb -0.23 -1.73 -0.04 0.00 -0.57 0.00 0.00 43.02 40.45 2wan s PHE 262 CO 0.28 -0.30 1.08 -1.25 -0.10 0.00 0.00 175.22 174.93 2wan s PRO 263 N 0.21 3.28 -0.23 0.24 0.04 -1.26 -4.98 135.00 132.31 2wan s PRO 263 Ca -0.13 1.35 0.11 0.00 0.04 0.00 0.00 61.00 62.36 2wan s PRO 263 Cb -0.16 -2.02 0.44 0.00 0.04 0.00 0.00 34.50 32.80 2wan s PRO 263 CO 0.07 -0.86 1.20 0.25 0.04 0.00 0.00 177.00 177.70 2wan n THR 264 N -1.82 2.19 -4.18 1.26 -2.24 -1.26 -4.77 114.28 103.46 2wan n THR 264 Ca 0.10 -3.49 -0.17 0.00 -2.27 0.00 0.00 64.05 58.22 2wan n THR 264 Cb 0.52 -0.46 -0.12 0.00 -2.10 0.00 0.00 70.33 68.17 2wan n THR 264 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 2wan s SER 265 N -3.33 1.26 0.00 3.42 0.15 -1.26 -5.04 113.70 108.90 2wan s SER 265 Ca 0.42 -0.49 0.19 0.00 0.70 0.00 0.00 55.95 56.77 2wan s SER 265 Cb 0.38 -0.04 0.53 0.00 -1.71 0.00 0.00 66.02 65.19 2wan s SER 265 CO -0.03 -0.08 1.43 -1.20 1.20 0.00 0.00 173.24 174.56 2wan n SER 266 N 1.70 2.62 -4.61 5.45 7.64 -1.26 -4.79 113.62 120.38 2wan n SER 266 Ca -0.20 -1.92 -0.49 0.00 1.01 0.00 0.00 58.87 57.27 2wan n SER 266 Cb 0.55 -0.26 -0.04 0.00 -1.01 0.00 0.00 64.21 63.45 2wan n SER 266 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2wan n ALA 267 N 0.94 -0.31 0.00 -0.43 0.00 -1.25 -1.83 120.51 117.62 2wan n ALA 267 Ca 0.17 0.47 0.00 0.00 0.00 0.00 0.00 53.44 54.08 2wan n ALA 267 Cb 0.45 -2.11 0.00 0.00 0.00 0.00 0.00 19.45 17.78 2wan n ALA 267 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wan n GLY 268 N 2.33 2.95 3.70 0.00 0.00 0.13 -4.90 105.19 109.40 2wan n GLY 268 Ca 0.16 -0.73 -0.44 0.00 0.00 0.00 0.00 46.02 45.01 2wan n GLY 268 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2wan n VAL 269 N 0.00 0.29 -3.86 1.61 0.31 -0.76 -4.63 118.33 111.29 2wan n VAL 269 Ca 0.00 -0.07 -0.36 0.00 -0.01 0.00 0.00 64.34 63.90 2wan n VAL 269 Cb 0.00 -1.75 -0.07 0.00 -0.91 0.00 0.00 33.84 31.11 2wan n VAL 269 CO 0.00 0.00 0.00 -1.10 -1.32 0.00 0.00 176.83 174.41 2wan s GLN 270 N 0.60 3.77 -0.08 5.55 -0.21 -1.26 -1.32 119.66 126.71 2wan s GLN 270 Ca 0.74 -0.20 -0.30 0.00 0.02 0.00 0.00 55.36 55.62 2wan s GLN 270 Cb -0.59 -3.26 0.10 0.00 1.00 0.00 0.00 33.01 30.26 2wan s GLN 270 CO 0.39 0.54 0.84 -0.08 -2.12 0.00 0.00 175.29 174.86 2wan s THR 271 N -0.34 0.00 -0.48 -0.19 -1.32 -0.49 -4.96 115.64 107.86 2wan s THR 271 Ca 0.11 0.00 0.10 0.00 -1.21 0.00 0.00 61.69 60.69 2wan s THR 271 Cb -0.12 -1.00 0.26 0.00 -1.51 0.00 0.00 72.50 70.14 2wan s THR 271 CO 0.01 0.00 1.21 -0.46 -2.21 0.00 0.00 174.62 173.17 2wan n ASN 272 N 0.59 2.80 -3.51 8.08 6.94 -1.26 -0.79 115.26 128.11 2wan n ASN 272 Ca -0.14 -2.28 -0.18 0.00 -0.02 0.00 0.00 54.58 51.96 2wan n ASN 272 Cb 0.59 -0.25 -0.13 0.00 -2.36 0.00 0.00 39.78 37.63 2wan n ASN 272 CO 0.00 0.00 0.00 -0.22 -1.03 0.00 0.00 177.26 176.01 2wan s LEU 273 N -1.50 -0.09 -0.04 -4.53 2.96 -1.26 -0.45 118.68 113.77 2wan s LEU 273 Ca 0.21 -0.19 0.06 0.00 -0.22 0.00 0.00 54.13 53.99 2wan s LEU 273 Cb 0.14 0.36 -0.02 0.00 0.50 0.00 0.00 46.19 47.17 2wan s LEU 273 CO 0.09 -0.32 -0.21 -0.69 -1.32 0.00 0.00 176.35 173.91 2wan s VAL 274 N 2.32 2.51 -0.31 1.68 1.01 0.06 -0.85 120.40 126.83 2wan s VAL 274 Ca 0.06 -0.93 -0.10 0.00 0.00 0.00 0.00 61.98 61.01 2wan s VAL 274 Cb -0.15 -1.93 -0.02 0.00 0.00 0.00 0.00 36.38 34.27 2wan s VAL 274 CO -0.12 0.58 0.17 -1.58 0.00 0.00 0.00 175.10 174.16 2wan s GLN 275 N -0.58 3.47 -0.14 2.72 0.74 0.92 -0.70 119.66 126.09 2wan s GLN 275 Ca 0.08 -0.64 -0.05 0.00 0.05 0.00 0.00 55.36 54.80 2wan s GLN 275 Cb -0.11 -3.62 -0.04 0.00 1.10 0.00 0.00 33.01 30.35 2wan s GLN 275 CO 0.00 -0.38 0.06 -0.51 -0.55 0.00 0.00 175.29 173.91 2wan s LEU 276 N 1.66 3.84 -0.15 3.68 1.43 0.13 -1.76 118.68 127.51 2wan s LEU 276 Ca 0.05 0.18 -0.07 0.00 -1.03 0.00 0.00 54.13 53.26 2wan s LEU 276 Cb -0.17 -1.93 -0.04 0.00 0.03 0.00 0.00 46.19 44.08 2wan s LEU 276 CO 0.08 0.29 0.08 -0.89 0.23 0.00 0.00 176.35 176.14 2wan s THR 277 N -0.34 5.01 0.12 5.49 2.01 -0.50 -1.04 115.64 126.40 2wan s THR 277 Ca 0.09 0.04 0.04 0.00 0.31 0.00 0.00 61.69 62.16 2wan s THR 277 Cb -0.12 -3.22 -0.04 0.00 0.01 0.00 0.00 72.50 69.13 2wan s THR 277 CO 0.02 0.52 0.11 -0.76 -0.69 0.00 0.00 174.62 173.82 2wan s LEU 278 N -0.18 3.83 0.23 4.42 1.43 0.61 -0.60 118.68 128.42 2wan s LEU 278 Ca 0.09 -0.05 0.01 0.00 -1.03 0.00 0.00 54.13 53.15 2wan s LEU 278 Cb -0.12 -2.48 0.25 0.00 0.03 0.00 0.00 46.19 43.88 2wan s LEU 278 CO 0.01 0.12 1.59 0.00 0.23 0.00 0.00 176.35 178.30 2wan h ALA 279 N 2.87 0.87 -2.38 4.21 0.00 -1.53 -3.46 119.26 119.85 2wan h ALA 279 Ca -0.47 -0.47 -0.25 0.00 0.00 0.00 0.00 54.91 53.72 2wan h ALA 279 Cb 1.18 -0.09 -0.16 0.00 0.00 0.00 0.00 17.79 18.72 2wan h ALA 279 CO 0.65 0.66 -0.71 -1.54 0.00 0.00 0.00 179.25 178.31 2wan s SER 280 N -6.88 1.22 -0.34 0.00 1.04 -1.26 -5.06 113.70 102.40 2wan s SER 280 Ca -0.06 -0.94 -0.29 0.00 0.48 0.00 0.00 55.95 55.15 2wan s SER 280 Cb 0.12 0.07 0.02 0.00 0.10 0.00 0.00 66.02 66.33 2wan s SER 280 CO 0.81 -0.40 1.06 0.00 0.98 0.00 0.00 173.24 175.69 2wan s ALA 281 N -3.23 3.44 0.79 5.32 0.00 -1.26 -4.80 121.76 122.03 2wan s ALA 281 Ca 0.09 -0.16 -0.11 0.00 0.00 0.00 0.00 51.96 51.79 2wan s ALA 281 Cb 0.03 -3.68 0.07 0.00 0.00 0.00 0.00 23.12 19.54 2wan s ALA 281 CO -0.03 -1.59 1.10 -2.14 0.00 0.00 0.00 175.76 173.10 2wan s PRO 282 N 3.72 2.05 -0.30 0.00 0.02 -1.25 -4.98 135.00 134.26 2wan s PRO 282 Ca 0.45 1.26 -0.29 0.00 0.02 0.00 0.00 61.00 62.44 2wan s PRO 282 Cb -0.12 -1.87 0.01 0.00 0.02 0.00 0.00 34.50 32.55 2wan s PRO 282 CO 0.18 -1.82 1.09 0.34 -0.33 0.00 0.00 177.00 176.46 2wan s ASP 283 N -3.19 6.95 0.01 2.53 -1.08 -1.26 -4.93 116.67 115.70 2wan s ASP 283 Ca 0.63 1.14 0.10 0.00 -0.52 0.00 0.00 52.55 53.89 2wan s ASP 283 Cb -0.19 -2.54 0.42 0.00 -1.46 0.00 0.00 42.92 39.15 2wan s ASP 283 CO 0.55 -0.85 1.31 1.33 0.52 0.00 0.00 175.17 178.03 2wan n VAL 284 N 5.78 1.35 1.18 1.11 0.24 -1.26 -1.38 118.33 125.35 2wan n VAL 284 Ca 0.12 0.35 0.13 0.00 -2.04 0.00 0.00 64.34 62.89 2wan n VAL 284 Cb 0.47 -1.19 0.33 0.00 -1.47 0.00 0.00 33.84 31.97 2wan n VAL 284 CO 0.00 0.00 0.00 0.35 -2.14 0.00 0.00 176.83 175.04 2wan n THR 285 N -1.53 0.00 -2.75 3.34 -2.24 -1.26 -4.56 114.28 105.28 2wan n THR 285 Ca 0.02 -0.11 -0.21 0.00 -2.27 0.00 0.00 64.05 61.48 2wan n THR 285 Cb 0.11 0.41 0.03 0.00 -2.10 0.00 0.00 70.33 68.78 2wan n THR 285 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 2wan s HIS 286 N -2.60 2.95 -0.65 4.78 3.76 -0.48 -4.60 115.29 118.45 2wan s HIS 286 Ca 0.21 0.03 -0.23 0.00 -0.15 0.00 0.00 55.06 54.92 2wan s HIS 286 Cb 0.19 -2.62 0.06 0.00 1.11 0.00 0.00 32.58 31.32 2wan s HIS 286 CO 0.56 -0.72 0.98 1.21 -0.85 0.00 0.00 174.74 175.92 2wan s ASN 287 N -4.37 6.19 -0.10 1.40 2.47 -1.26 -5.00 114.94 114.27 2wan s ASN 287 Ca 0.55 -0.88 -0.03 0.00 0.42 0.00 0.00 52.86 52.93 2wan s ASN 287 Cb -0.10 -2.43 -0.03 0.00 -1.45 0.00 0.00 41.25 37.23 2wan s ASN 287 CO 0.38 -1.45 0.00 -0.76 -3.72 0.00 0.00 177.10 171.56 2wan s LEU 288 N 4.17 3.57 0.05 3.21 1.43 -1.26 0.63 118.68 130.48 2wan s LEU 288 Ca 0.24 0.11 0.05 0.00 -1.03 0.00 0.00 54.13 53.49 2wan s LEU 288 Cb -0.16 -1.83 -0.02 0.00 0.03 0.00 0.00 46.19 44.21 2wan s LEU 288 CO 0.12 0.34 -0.13 -1.81 0.23 0.00 0.00 176.35 175.09 2wan s ASP 289 N -0.63 1.57 0.02 2.29 -0.00 -0.47 -0.65 116.67 118.81 2wan s ASP 289 Ca 0.10 -0.52 0.06 0.00 -0.00 0.00 0.00 52.55 52.19 2wan s ASP 289 Cb -0.12 -0.07 -0.02 0.00 -0.00 0.00 0.00 42.92 42.71 2wan s ASP 289 CO 0.02 -0.03 -0.17 0.54 -0.00 0.00 0.00 175.17 175.53 2wan s VAL 290 N -1.04 1.37 0.14 -1.27 0.11 -0.10 -1.77 120.40 117.84 2wan s VAL 290 Ca -0.01 -0.97 -0.07 0.00 -2.93 0.00 0.00 61.98 58.00 2wan s VAL 290 Cb -0.09 -1.19 -0.02 0.00 -1.53 0.00 0.00 36.38 33.56 2wan s VAL 290 CO 0.02 0.19 0.20 0.00 -3.33 0.00 0.00 175.10 172.18 2wan s ALA 291 N -0.68 0.17 0.05 1.54 0.00 -0.36 -1.00 121.76 121.48 2wan s ALA 291 Ca 0.05 -0.98 -0.01 0.00 0.00 0.00 0.00 51.96 51.03 2wan s ALA 291 Cb -0.08 0.75 -0.04 0.00 0.00 0.00 0.00 23.12 23.76 2wan s ALA 291 CO 0.01 -0.57 -0.03 0.00 0.00 0.00 0.00 175.76 175.17 2wan s ALA 292 N -3.96 0.51 -0.04 0.00 0.00 -1.25 -0.56 121.76 116.47 2wan s ALA 292 Ca 0.16 -1.21 -0.34 0.00 0.00 0.00 0.00 51.96 50.57 2wan s ALA 292 Cb 0.05 0.27 -0.12 0.00 0.00 0.00 0.00 23.12 23.32 2wan s ALA 292 CO -0.02 -0.37 1.83 -0.25 0.00 0.00 0.00 175.76 176.95 2wan n ASP 293 N 0.12 3.43 0.00 0.00 8.00 -1.11 -1.08 116.55 125.91 2wan n ASP 293 Ca -0.14 0.99 0.00 0.00 0.71 0.00 0.00 54.79 56.35 2wan n ASP 293 Cb 0.61 -1.39 0.00 0.00 -0.02 0.00 0.00 41.12 40.32 2wan n ASP 293 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2wan n GLY 294 N 4.24 1.26 3.31 0.44 0.00 -1.26 -5.03 105.19 108.15 2wan n GLY 294 Ca 0.21 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.91 2wan n GLY 294 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2wan s TYR 295 N -3.24 2.73 0.31 1.61 1.51 -0.24 -4.72 117.35 115.31 2wan s TYR 295 Ca 0.00 -0.83 -0.30 0.00 -1.01 0.00 0.00 57.07 54.94 2wan s TYR 295 Cb 0.00 -1.81 -0.12 0.00 -0.11 0.00 0.00 41.96 39.92 2wan s TYR 295 CO 0.00 -0.31 1.51 1.17 -1.11 0.00 0.00 175.55 176.81 2wan n LYS 296 N 3.60 2.53 -1.23 -0.62 4.81 0.62 -3.95 118.16 123.93 2wan n LYS 296 Ca -0.19 0.90 -0.31 0.00 -0.87 0.00 0.00 58.31 57.84 2wan n LYS 296 Cb 0.53 -2.63 0.10 0.00 0.02 0.00 0.00 35.03 33.05 2wan n LYS 296 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2wan s ALA 297 N -0.37 2.13 -0.00 3.14 0.00 -1.26 -0.94 121.76 124.45 2wan s ALA 297 Ca 0.61 0.39 -0.05 0.00 0.00 0.00 0.00 51.96 52.92 2wan s ALA 297 Cb -0.52 -3.32 -0.00 0.00 0.00 0.00 0.00 23.12 19.27 2wan s ALA 297 CO 0.54 -1.90 0.09 -1.58 0.00 0.00 0.00 175.76 172.90 2wan s HIS 298 N -2.74 0.07 0.53 0.00 2.46 -0.17 -4.74 115.29 110.70 2wan s HIS 298 Ca 0.64 -0.15 -0.22 0.00 0.47 0.00 0.00 55.06 55.79 2wan s HIS 298 Cb -0.19 -0.07 -0.05 0.00 -0.13 0.00 0.00 32.58 32.14 2wan s HIS 298 CO 0.54 -0.21 1.37 -1.71 -2.47 0.00 0.00 174.74 172.25 2wan n ASN 299 N 1.82 2.77 -4.41 9.88 5.15 -1.26 -0.92 115.26 128.28 2wan n ASN 299 Ca -0.21 1.00 -0.40 0.00 -0.60 0.00 0.00 54.58 54.36 2wan n ASN 299 Cb 0.56 -1.58 -0.11 0.00 -0.53 0.00 0.00 39.78 38.12 2wan n ASN 299 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 2wan s ILE 300 N -1.28 4.70 -0.12 -1.44 1.01 0.18 -3.94 121.20 120.31 2wan s ILE 300 Ca 0.70 -0.70 -0.18 0.00 0.00 0.00 0.00 60.65 60.47 2wan s ILE 300 Cb -0.42 -3.56 -0.04 0.00 0.01 0.00 0.00 42.46 38.45 2wan s ILE 300 CO 0.50 -0.16 0.48 -0.22 0.00 0.00 0.00 174.94 175.54 2wan s LEU 301 N 1.59 4.27 0.18 2.97 2.96 -0.24 -4.59 118.68 125.82 2wan s LEU 301 Ca 0.03 0.81 -0.32 0.00 -0.22 0.00 0.00 54.13 54.44 2wan s LEU 301 Cb -0.19 -2.70 -0.11 0.00 0.50 0.00 0.00 46.19 43.69 2wan s LEU 301 CO 0.07 -0.01 1.67 -2.84 -1.32 0.00 0.00 176.35 173.92 2wan s PRO 302 N 0.70 4.16 0.00 0.98 0.02 -1.26 -1.22 135.00 138.37 2wan s PRO 302 Ca 0.26 2.51 0.00 0.00 0.02 0.00 0.00 61.00 63.79 2wan s PRO 302 Cb -0.15 -3.14 0.00 0.00 0.02 0.00 0.00 34.50 31.23 2wan s PRO 302 CO 0.10 -0.70 0.00 -2.13 -0.33 0.00 0.00 177.00 173.94 2wan n ARG 303 N 4.11 0.00 0.00 5.54 0.63 -0.40 -4.83 116.66 121.71 2wan n ARG 303 Ca 0.15 0.00 0.11 0.00 -0.92 0.00 0.00 57.85 57.19 2wan n ARG 303 Cb 0.37 0.00 0.47 0.00 0.45 0.00 0.00 32.46 33.75 2wan n ARG 303 CO 0.00 0.00 0.00 0.09 -2.51 0.00 0.00 177.63 175.21 2wan n ASN 304 N 0.00 0.00 -0.01 6.15 3.02 -1.13 -1.62 115.26 121.67 2wan n ASN 304 Ca 0.00 0.48 0.11 0.00 -0.03 0.00 0.00 54.58 55.14 2wan n ASN 304 Cb 0.00 -0.49 0.54 0.00 -0.61 0.00 0.00 39.78 39.21 2wan n ASN 304 CO 0.00 0.00 0.00 1.62 -2.62 0.00 0.00 177.26 176.26 2wan h VAL 305 N 0.00 0.92 0.00 2.41 3.04 -1.27 -1.83 116.25 119.52 2wan h VAL 305 Ca 0.00 -0.11 0.00 0.00 -1.01 0.00 0.00 66.70 65.58 2wan h VAL 305 Cb 0.37 0.58 0.00 0.00 -2.01 0.00 0.00 31.29 30.23 2wan h VAL 305 CO 0.00 0.06 0.00 0.18 -1.01 0.00 0.00 177.57 176.80 2wan n LEU 306 N -4.47 0.15 0.28 3.16 4.77 -0.64 -2.15 117.00 118.09 2wan n LEU 306 Ca 0.07 0.53 0.15 0.00 -0.03 0.00 0.00 56.01 56.73 2wan n LEU 306 Cb 0.31 -0.51 0.79 0.00 -2.33 0.00 0.00 43.42 41.69 2wan n LEU 306 CO 0.35 -0.26 1.01 0.78 -1.33 0.00 0.00 177.39 177.93 2wan h ASN 307 N 0.00 0.00 -4.02 -1.43 2.35 -1.51 -3.43 115.58 107.53 2wan h ASN 307 Ca 0.00 0.00 -0.54 0.00 -0.55 0.00 0.00 56.30 55.21 2wan h ASN 307 Cb 0.33 0.00 0.11 0.00 0.05 0.00 0.00 38.32 38.81 2wan h ASN 307 CO 0.00 0.09 0.58 -0.76 -1.65 0.00 0.00 177.43 175.68 2wan s LEU 308 N -6.93 3.94 0.53 1.61 1.43 -0.91 -4.86 118.68 113.49 2wan s LEU 308 Ca -0.02 2.64 0.33 0.00 -1.03 0.00 0.00 54.13 56.04 2wan s LEU 308 Cb 0.12 -4.22 1.50 0.00 0.03 0.00 0.00 46.19 43.63 2wan s LEU 308 CO 0.55 -1.31 1.85 -0.65 0.23 0.00 0.00 176.35 177.02 2wan h PRO 309 N 1.77 0.02 0.00 1.29 0.11 -1.91 -0.72 132.00 132.56 2wan h PRO 309 Ca -0.50 -0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.59 2wan h PRO 309 Cb 1.28 -0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.38 2wan h PRO 309 CO 0.59 0.01 -0.07 0.07 -0.21 0.00 0.00 178.00 178.38 2wan h ARG 310 N 0.02 0.00 -0.46 1.05 0.11 -1.94 -1.76 114.38 111.40 2wan h ARG 310 Ca 0.49 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.57 2wan h ARG 310 Cb 1.94 0.00 0.00 0.00 1.11 0.00 0.00 29.97 33.02 2wan h ARG 310 CO -0.02 0.07 0.00 0.66 0.10 0.00 0.00 179.97 180.79 2wan n TYR 311 N -3.45 1.13 -3.49 4.08 4.01 -0.28 -4.18 117.16 114.98 2wan n TYR 311 Ca -0.02 -0.67 -0.42 0.00 -0.16 0.00 0.00 57.90 56.63 2wan n TYR 311 Cb 0.21 -0.23 -0.09 0.00 -0.31 0.00 0.00 39.34 38.92 2wan n TYR 311 CO 0.00 0.00 0.00 0.34 -0.46 0.00 0.00 176.86 176.74 2wan s ASP 312 N -1.23 5.93 -0.26 7.72 3.68 -0.66 -4.74 116.67 127.10 2wan s ASP 312 Ca 0.42 -1.30 -0.13 0.00 2.13 0.00 0.00 52.55 53.68 2wan s ASP 312 Cb 0.29 -2.10 -0.04 0.00 -1.45 0.00 0.00 42.92 39.62 2wan s ASP 312 CO 0.17 -0.56 0.29 -0.47 0.13 0.00 0.00 175.17 174.73 2wan s TYR 313 N 1.56 3.27 -1.67 -5.34 5.04 -1.26 -4.88 117.35 114.08 2wan s TYR 313 Ca 0.03 0.32 0.15 0.00 -2.44 0.00 0.00 57.07 55.14 2wan s TYR 313 Cb -0.23 -2.46 0.24 0.00 0.35 0.00 0.00 41.96 39.87 2wan s TYR 313 CO 0.06 -0.13 1.13 -1.13 -1.34 0.00 0.00 175.55 174.13 2wan n SER 314 N 4.97 2.67 -4.69 4.32 3.41 -1.26 -5.01 113.62 118.03 2wan n SER 314 Ca -0.11 -1.78 -0.30 0.00 -0.26 0.00 0.00 58.87 56.41 2wan n SER 314 Cb 0.51 -0.13 0.15 0.00 -0.26 0.00 0.00 64.21 64.49 2wan n SER 314 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2wan s GLY 315 N -1.17 1.65 -0.15 5.00 0.00 -1.26 -4.96 107.32 106.43 2wan s GLY 315 Ca 0.23 0.24 0.16 0.00 0.00 0.00 0.00 44.72 45.35 2wan s GLY 315 CO 0.20 0.69 1.60 1.16 0.00 0.00 0.00 173.10 176.75 2wan n ASN 316 N -4.04 4.74 -0.65 1.64 0.23 -1.26 -4.54 115.26 111.38 2wan n ASN 316 Ca 0.09 -2.65 0.08 0.00 -0.53 0.00 0.00 54.58 51.56 2wan n ASN 316 Cb 0.53 -0.58 0.20 0.00 -2.08 0.00 0.00 39.78 37.86 2wan n ASN 316 CO 0.00 0.00 0.00 -0.90 -0.93 0.00 0.00 177.26 175.43 2wan n ASP 317 N 0.64 3.33 -4.77 0.53 5.75 -1.26 -5.01 116.55 115.76 2wan n ASP 317 Ca 0.24 -2.77 -0.41 0.00 -0.01 0.00 0.00 54.79 51.84 2wan n ASP 317 Cb 0.94 -0.43 -0.01 0.00 -1.03 0.00 0.00 41.12 40.59 2wan n ASP 317 CO 0.00 0.00 0.00 -0.76 -0.11 0.00 0.00 177.20 176.33 2wan s LEU 318 N -2.37 4.33 0.00 -2.12 1.43 -1.26 -4.36 118.68 114.34 2wan s LEU 318 Ca 0.34 2.99 0.00 0.00 -1.03 0.00 0.00 54.13 56.43 2wan s LEU 318 Cb 0.27 -3.66 0.00 0.00 0.03 0.00 0.00 46.19 42.83 2wan s LEU 318 CO 0.09 -0.86 0.00 0.61 0.23 0.00 0.00 176.35 176.42 2wan n GLY 319 N 1.03 0.16 3.52 -3.19 0.00 -0.26 -4.91 105.19 101.54 2wan n GLY 319 Ca 0.03 -1.87 -0.32 0.00 0.00 0.00 0.00 46.02 43.86 2wan n GLY 319 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2wan s ASN 320 N -4.00 4.25 -0.28 1.61 4.22 -1.26 -1.30 114.94 118.18 2wan s ASN 320 Ca 0.00 -0.21 0.02 0.00 -2.14 0.00 0.00 52.86 50.53 2wan s ASN 320 Cb 0.00 -0.91 0.07 0.00 1.28 0.00 0.00 41.25 41.69 2wan s ASN 320 CO 0.00 0.31 -0.04 -0.69 -2.04 0.00 0.00 177.10 174.64 2wan s VAL 321 N -0.87 1.92 0.02 3.54 1.01 0.30 -4.97 120.40 121.34 2wan s VAL 321 Ca 0.14 -1.69 -0.22 0.00 0.00 0.00 0.00 61.98 60.22 2wan s VAL 321 Cb -0.11 -2.20 -0.06 0.00 0.00 0.00 0.00 36.38 34.01 2wan s VAL 321 CO 0.04 -0.25 0.64 -0.47 0.00 0.00 0.00 175.10 175.06 2wan s TYR 322 N 1.17 3.71 0.14 5.22 5.04 -1.26 -1.91 117.35 129.46 2wan s TYR 322 Ca -0.01 1.28 -0.00 0.00 -2.44 0.00 0.00 57.07 55.89 2wan s TYR 322 Cb -0.19 -2.65 -0.04 0.00 0.35 0.00 0.00 41.96 39.42 2wan s TYR 322 CO -0.08 0.36 0.04 -1.54 -1.34 0.00 0.00 175.55 172.99 2wan s SER 323 N -0.26 0.52 0.30 4.32 1.04 -0.36 -5.01 113.70 114.25 2wan s SER 323 Ca 0.33 -1.20 0.01 0.00 0.48 0.00 0.00 55.95 55.57 2wan s SER 323 Cb -0.19 0.25 0.54 0.00 0.10 0.00 0.00 66.02 66.73 2wan s SER 323 CO 0.19 -0.69 1.91 0.50 0.98 0.00 0.00 173.24 176.13 2wan h LYS 324 N 2.83 0.98 0.00 4.02 3.64 -1.98 -3.07 116.57 122.99 2wan h LYS 324 Ca -0.35 -0.06 -0.12 0.00 -1.27 0.00 0.00 60.65 58.84 2wan h LYS 324 Cb 1.20 -0.22 -0.02 0.00 -0.41 0.00 0.00 32.23 32.78 2wan h LYS 324 CO 0.60 0.65 -0.87 -0.44 -2.27 0.00 0.00 179.45 177.12 2wan h ASP 325 N 1.01 0.00 -4.34 4.20 3.32 -1.97 -3.25 116.42 115.39 2wan h ASP 325 Ca 0.39 0.00 0.09 0.00 0.02 0.00 0.00 57.03 57.53 2wan h ASP 325 Cb 0.23 0.00 -0.20 0.00 0.22 0.00 0.00 39.33 39.57 2wan h ASP 325 CO -0.15 0.51 0.52 0.00 -1.72 0.00 0.00 179.24 178.40 2wan s ALA 326 N -2.96 -1.89 -0.07 3.45 0.00 -1.09 -0.39 121.76 118.80 2wan s ALA 326 Ca 0.01 1.39 0.05 0.00 0.00 0.00 0.00 51.96 53.42 2wan s ALA 326 Cb 0.08 -0.29 -0.01 0.00 0.00 0.00 0.00 23.12 22.90 2wan s ALA 326 CO 0.77 -0.44 -0.24 0.99 0.00 0.00 0.00 175.76 176.84 2wan s THR 327 N -1.79 2.00 -0.05 0.00 2.01 -0.46 -1.23 115.64 116.13 2wan s THR 327 Ca 0.00 -1.02 -0.01 0.00 0.31 0.00 0.00 61.69 60.97 2wan s THR 327 Cb -0.01 -1.71 -0.04 0.00 0.01 0.00 0.00 72.50 70.76 2wan s THR 327 CO -0.01 0.55 0.02 -0.44 -0.69 0.00 0.00 174.62 174.05 2wan s SER 328 N 0.04 5.34 0.03 3.53 0.01 -0.80 -0.87 113.70 120.98 2wan s SER 328 Ca -0.09 0.12 0.08 0.00 1.31 0.00 0.00 55.95 57.36 2wan s SER 328 Cb -0.15 -1.49 -0.02 0.00 0.21 0.00 0.00 66.02 64.57 2wan s SER 328 CO 0.06 0.33 -0.22 -0.36 0.41 0.00 0.00 173.24 173.45 2wan s PHE 329 N -1.01 1.97 -0.16 2.43 0.40 0.66 -0.54 117.98 121.74 2wan s PHE 329 Ca 0.17 -0.38 -0.10 0.00 -0.60 0.00 0.00 56.93 56.02 2wan s PHE 329 Cb -0.12 -1.20 0.05 0.00 0.51 0.00 0.00 43.02 42.26 2wan s PHE 329 CO 0.07 0.06 0.39 0.50 0.70 0.00 0.00 175.22 176.94 2wan s ARG 330 N -1.00 0.39 0.00 0.44 3.52 -0.42 -1.43 118.95 120.46 2wan s ARG 330 Ca 0.09 0.69 0.01 0.00 -0.13 0.00 0.00 55.73 56.39 2wan s ARG 330 Cb -0.09 0.04 -0.01 0.00 -1.56 0.00 0.00 34.95 33.33 2wan s ARG 330 CO 0.01 -0.13 -0.03 0.54 -0.81 0.00 0.00 175.30 174.88 2wan s VAL 331 N 1.04 0.20 -0.36 7.11 0.11 -0.50 -1.10 120.40 126.90 2wan s VAL 331 Ca -0.07 -0.25 -0.21 0.00 -2.93 0.00 0.00 61.98 58.53 2wan s VAL 331 Cb -0.07 -0.20 0.00 0.00 -1.53 0.00 0.00 36.38 34.58 2wan s VAL 331 CO -0.08 -0.03 0.65 0.86 -3.33 0.00 0.00 175.10 173.17 2wan s TRP 332 N -0.28 3.14 -0.43 1.54 -0.00 -1.26 -0.42 118.94 121.22 2wan s TRP 332 Ca -0.01 0.34 0.07 0.00 -0.00 0.00 0.00 56.10 56.50 2wan s TRP 332 Cb -0.02 -3.18 0.24 0.00 -0.00 0.00 0.00 33.47 30.51 2wan s TRP 332 CO -0.00 -0.65 0.65 0.00 -0.00 0.00 0.00 176.95 176.95 2wan n ALA 333 N 6.10 0.88 0.35 5.86 0.00 -0.12 -4.77 120.51 128.80 2wan n ALA 333 Ca -0.01 -2.56 0.13 0.00 0.00 0.00 0.00 53.44 51.01 2wan n ALA 333 Cb 0.48 -1.03 0.57 0.00 0.00 0.00 0.00 19.45 19.48 2wan n ALA 333 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 2wan h PRO 334 N 4.14 0.00 -0.01 0.00 0.13 -1.83 -2.41 132.00 132.02 2wan h PRO 334 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 2wan h PRO 334 Cb 0.95 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.08 2wan h PRO 334 CO 0.39 0.00 -0.34 0.25 -0.23 0.00 0.00 178.00 178.07 2wan n THR 335 N -2.47 0.00 -2.25 1.56 -2.24 -1.26 -4.46 114.28 103.17 2wan n THR 335 Ca 0.01 -0.33 -0.39 0.00 -2.27 0.00 0.00 64.05 61.08 2wan n THR 335 Cb 0.23 1.22 -0.02 0.00 -2.10 0.00 0.00 70.33 69.66 2wan n THR 335 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2wan s ALA 336 N -1.99 3.20 -0.12 6.98 0.00 -0.91 -4.30 121.76 124.62 2wan s ALA 336 Ca 0.15 1.02 0.16 0.00 0.00 0.00 0.00 51.96 53.29 2wan s ALA 336 Cb 0.14 -3.40 -0.09 0.00 0.00 0.00 0.00 23.12 19.76 2wan s ALA 336 CO 0.43 -0.57 0.98 0.66 0.00 0.00 0.00 175.76 177.25 2wan h SER 337 N 2.73 0.00 -4.12 0.00 4.64 -1.13 -3.46 113.55 112.21 2wan h SER 337 Ca -0.49 0.00 -0.10 0.00 -0.47 0.00 0.00 61.79 60.73 2wan h SER 337 Cb 1.24 0.00 -0.23 0.00 -0.31 0.00 0.00 62.40 63.10 2wan h SER 337 CO 0.63 0.58 -0.16 0.21 -0.87 0.00 0.00 176.83 177.22 2wan s ASN 338 N -5.97 -0.46 -0.07 4.97 2.47 -1.20 -5.03 114.94 109.65 2wan s ASN 338 Ca -0.01 0.82 0.01 0.00 0.42 0.00 0.00 52.86 54.09 2wan s ASN 338 Cb 0.08 0.85 0.02 0.00 -1.45 0.00 0.00 41.25 40.75 2wan s ASN 338 CO 0.80 -0.23 -0.07 -0.69 -3.72 0.00 0.00 177.10 173.19 2wan s VAL 339 N -0.05 0.81 0.11 -5.21 1.01 -1.26 -0.90 120.40 114.91 2wan s VAL 339 Ca -0.02 -0.25 0.09 0.00 0.00 0.00 0.00 61.98 61.79 2wan s VAL 339 Cb -0.03 -0.81 -0.04 0.00 0.00 0.00 0.00 36.38 35.50 2wan s VAL 339 CO 0.02 0.30 -0.17 -1.10 0.00 0.00 0.00 175.10 174.14 2wan s GLN 340 N 1.08 1.84 -0.18 2.72 -0.21 0.07 -1.78 119.66 123.19 2wan s GLN 340 Ca -0.08 -1.15 -0.17 0.00 0.02 0.00 0.00 55.36 53.98 2wan s GLN 340 Cb -0.14 -2.14 -0.04 0.00 1.00 0.00 0.00 33.01 31.69 2wan s GLN 340 CO -0.01 0.49 0.44 -1.17 -2.12 0.00 0.00 175.29 172.92 2wan s LEU 341 N -2.12 4.19 -0.26 2.90 2.96 0.60 -0.34 118.68 126.60 2wan s LEU 341 Ca 0.18 0.62 -0.07 0.00 -0.22 0.00 0.00 54.13 54.65 2wan s LEU 341 Cb -0.11 -2.59 -0.01 0.00 0.50 0.00 0.00 46.19 43.98 2wan s LEU 341 CO 0.10 -0.07 0.07 -0.76 -1.32 0.00 0.00 176.35 174.37 2wan s LEU 342 N 1.15 3.54 -0.11 -0.68 1.43 0.17 -0.78 118.68 123.41 2wan s LEU 342 Ca 0.22 -0.38 -0.02 0.00 -1.03 0.00 0.00 54.13 52.91 2wan s LEU 342 Cb -0.15 -1.90 -0.03 0.00 0.03 0.00 0.00 46.19 44.14 2wan s LEU 342 CO 0.09 -0.09 -0.03 -0.76 0.23 0.00 0.00 176.35 175.79 2wan s LEU 343 N 1.57 3.36 -0.08 1.79 1.43 0.32 -1.16 118.68 125.91 2wan s LEU 343 Ca 0.05 -0.00 0.02 0.00 -1.03 0.00 0.00 54.13 53.16 2wan s LEU 343 Cb -0.16 -1.78 0.02 0.00 0.03 0.00 0.00 46.19 44.30 2wan s LEU 343 CO 0.03 0.29 -0.12 -0.31 0.23 0.00 0.00 176.35 176.46 2wan s TYR 344 N -0.34 1.58 -1.30 0.29 2.02 0.29 -0.67 117.35 119.22 2wan s TYR 344 Ca 0.06 -0.66 0.08 0.00 -0.37 0.00 0.00 57.07 56.17 2wan s TYR 344 Cb -0.12 -1.18 0.31 0.00 -0.40 0.00 0.00 41.96 40.57 2wan s TYR 344 CO 0.02 -0.37 1.12 0.27 -1.57 0.00 0.00 175.55 175.02 2wan n ASN 345 N 4.13 2.38 -3.72 2.29 0.23 -1.26 -0.86 115.26 118.46 2wan n ASN 345 Ca -0.20 -2.21 -0.10 0.00 -0.53 0.00 0.00 54.58 51.54 2wan n ASN 345 Cb 0.51 -0.41 -0.05 0.00 -2.08 0.00 0.00 39.78 37.75 2wan n ASN 345 CO 0.00 0.00 0.00 -0.94 -0.93 0.00 0.00 177.26 175.39 2wan s SER 346 N -0.64 -0.11 0.26 0.53 1.04 -1.26 -4.98 113.70 108.54 2wan s SER 346 Ca 0.22 -0.44 0.05 0.00 0.48 0.00 0.00 55.95 56.26 2wan s SER 346 Cb 0.14 0.43 0.34 0.00 0.10 0.00 0.00 66.02 67.03 2wan s SER 346 CO 0.10 -0.81 1.62 -0.08 0.98 0.00 0.00 173.24 175.05 2wan h GLU 347 N 2.50 0.26 0.00 4.02 4.81 -1.93 -3.38 114.58 120.86 2wan h GLU 347 Ca -0.34 -0.15 0.00 0.00 -0.13 0.00 0.00 59.36 58.74 2wan h GLU 347 Cb 1.24 0.01 0.00 0.00 0.63 0.00 0.00 28.75 30.63 2wan h GLU 347 CO 0.50 0.71 -0.23 1.63 -0.73 0.00 0.00 179.01 180.89 2wan n LYS 348 N -3.95 4.47 -1.64 1.92 5.02 -1.26 -4.93 118.16 117.78 2wan n LYS 348 Ca -0.02 0.00 -0.29 0.00 -2.02 0.00 0.00 58.31 55.98 2wan n LYS 348 Cb 0.55 -0.55 0.15 0.00 -0.02 0.00 0.00 35.03 35.15 2wan n LYS 348 CO 0.00 0.00 0.00 0.20 -0.52 0.00 0.00 177.40 177.08 2wan s GLY 349 N -1.05 1.62 0.91 0.72 0.00 -1.26 -5.03 107.32 103.22 2wan s GLY 349 Ca 0.00 -0.72 -0.11 0.00 0.00 0.00 0.00 44.72 43.89 2wan s GLY 349 CO 0.00 -0.10 1.09 -1.35 0.00 0.00 0.00 173.10 172.74 2wan s SER 350 N -4.30 3.27 0.08 1.64 1.04 -1.26 -4.88 113.70 109.30 2wan s SER 350 Ca 0.66 1.55 -0.37 0.00 0.48 0.00 0.00 55.95 58.27 2wan s SER 350 Cb -0.11 -2.21 -0.16 0.00 0.10 0.00 0.00 66.02 63.63 2wan s SER 350 CO 0.53 -2.78 1.37 -0.38 0.98 0.00 0.00 173.24 172.96 2wan n ILE 351 N -3.98 0.01 -0.06 -1.02 5.41 -1.26 -4.75 119.36 113.71 2wan n ILE 351 Ca 0.07 -0.00 -0.22 0.00 1.00 0.00 0.00 62.75 63.60 2wan n ILE 351 Cb 0.55 -0.88 -0.13 0.00 -0.71 0.00 0.00 39.64 38.47 2wan n ILE 351 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 176.55 177.29 2wan h THR 352 N 3.39 0.86 -3.16 1.39 2.02 -1.25 -3.48 112.91 112.67 2wan h THR 352 Ca -0.47 -2.25 -0.20 0.00 0.77 0.00 0.00 66.41 64.25 2wan h THR 352 Cb 1.33 2.38 -0.29 0.00 -1.74 0.00 0.00 68.15 69.83 2wan h THR 352 CO 0.79 0.53 -0.51 -0.75 0.37 0.00 0.00 175.52 175.95 2wan s LYS 353 N -2.43 0.19 -0.18 6.66 2.20 -0.79 -5.02 119.74 120.37 2wan s LYS 353 Ca -0.26 0.40 -0.01 0.00 -0.36 0.00 0.00 55.97 55.74 2wan s LYS 353 Cb 0.06 -0.05 -0.00 0.00 -1.51 0.00 0.00 37.83 36.33 2wan s LYS 353 CO 0.66 -0.11 -0.12 -1.14 -0.36 0.00 0.00 175.35 174.29 2wan s GLN 354 N 0.81 3.27 -0.02 4.03 0.74 -1.26 -0.52 119.66 126.70 2wan s GLN 354 Ca -0.06 -0.71 0.05 0.00 0.05 0.00 0.00 55.36 54.69 2wan s GLN 354 Cb -0.07 -2.76 -0.01 0.00 1.10 0.00 0.00 33.01 31.27 2wan s GLN 354 CO -0.05 -0.06 -0.16 -0.51 -0.55 0.00 0.00 175.29 173.96 2wan s LEU 355 N 1.05 1.97 0.13 3.68 1.43 0.04 -4.98 118.68 122.00 2wan s LEU 355 Ca -0.00 -0.30 -0.31 0.00 -1.03 0.00 0.00 54.13 52.49 2wan s LEU 355 Cb -0.15 -0.85 -0.08 0.00 0.03 0.00 0.00 46.19 45.14 2wan s LEU 355 CO -0.03 0.17 1.36 -1.61 0.23 0.00 0.00 176.35 176.48 2wan s GLU 356 N -0.20 4.34 0.60 1.70 0.41 -1.26 -0.29 118.70 124.00 2wan s GLU 356 Ca 0.02 2.05 -0.03 0.00 -0.41 0.00 0.00 54.97 56.60 2wan s GLU 356 Cb -0.08 -3.24 0.03 0.00 -1.78 0.00 0.00 34.13 29.06 2wan s GLU 356 CO 0.00 -0.39 0.87 -1.64 -0.49 0.00 0.00 175.26 173.62 2wan s MET 357 N 0.85 2.60 -0.15 1.61 -1.94 -0.74 -4.85 119.30 116.67 2wan s MET 357 Ca 0.63 -0.36 -0.02 0.00 -1.71 0.00 0.00 55.69 54.22 2wan s MET 357 Cb -0.36 -2.33 -0.02 0.00 2.01 0.00 0.00 34.83 34.12 2wan s MET 357 CO 0.32 -0.83 -0.07 -0.65 -0.01 0.00 0.00 175.02 173.78 2wan s GLN 358 N -4.96 3.54 0.10 2.03 -0.21 -0.05 -4.82 119.66 115.29 2wan s GLN 358 Ca 0.56 -0.59 -0.34 0.00 0.02 0.00 0.00 55.36 55.01 2wan s GLN 358 Cb -0.10 -2.82 -0.14 0.00 1.00 0.00 0.00 33.01 30.94 2wan s GLN 358 CO 0.42 0.19 1.60 1.63 -2.12 0.00 0.00 175.29 177.02 2wan n LYS 359 N 3.64 2.00 0.00 2.91 5.02 -1.26 -0.78 118.16 129.69 2wan n LYS 359 Ca -0.18 0.72 0.00 0.00 -2.02 0.00 0.00 58.31 56.84 2wan n LYS 359 Cb 0.52 -2.49 0.00 0.00 -0.02 0.00 0.00 35.03 33.05 2wan n LYS 359 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 2wan n SER 360 N 3.90 0.57 -4.69 4.39 2.88 0.72 -4.88 113.62 116.51 2wan n SER 360 Ca 0.18 0.00 -0.44 0.00 -1.33 0.00 0.00 58.87 57.28 2wan n SER 360 Cb 0.27 0.00 -0.03 0.00 -0.75 0.00 0.00 64.21 63.70 2wan n SER 360 CO 0.00 0.00 0.00 0.47 -1.23 0.00 0.00 175.04 174.28 2wan n ASP 361 N 0.00 3.37 -3.70 -3.46 8.00 -1.26 -3.88 116.55 115.61 2wan n ASP 361 Ca 0.00 1.09 -0.24 0.00 0.71 0.00 0.00 54.79 56.35 2wan n ASP 361 Cb 0.00 -1.49 0.05 0.00 -0.02 0.00 0.00 41.12 39.67 2wan n ASP 361 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 2wan n ASN 362 N 3.24 -3.84 0.00 -2.24 5.03 -1.26 -1.54 115.26 114.65 2wan n ASN 362 Ca 0.15 -0.70 0.00 0.00 0.87 0.00 0.00 54.58 54.90 2wan n ASN 362 Cb 0.32 -4.42 0.00 0.00 -1.02 0.00 0.00 39.78 34.66 2wan n ASN 362 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2wan n GLY 363 N -1.66 0.79 3.90 7.41 0.00 -1.25 -4.25 105.19 110.14 2wan n GLY 363 Ca -0.11 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.63 2wan n GLY 363 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2wan s THR 364 N -3.02 4.86 -0.01 2.61 -4.23 -0.59 -0.95 115.64 114.31 2wan s THR 364 Ca 0.00 0.37 0.07 0.00 -1.18 0.00 0.00 61.69 60.95 2wan s THR 364 Cb 0.00 -3.84 -0.02 0.00 1.34 0.00 0.00 72.50 69.99 2wan s THR 364 CO 0.00 -0.81 -0.23 0.26 -0.54 0.00 0.00 174.62 173.30 2wan s TRP 365 N -2.71 2.07 0.10 3.99 0.52 0.44 -0.20 118.94 123.16 2wan s TRP 365 Ca 0.49 -0.39 0.02 0.00 0.02 0.00 0.00 56.10 56.24 2wan s TRP 365 Cb -0.10 -1.32 -0.04 0.00 -1.15 0.00 0.00 33.47 30.85 2wan s TRP 365 CO 0.43 -0.02 -0.07 -1.59 0.02 0.00 0.00 176.95 175.72 2wan s LYS 366 N -0.62 0.85 -0.28 4.98 -2.85 0.04 -1.40 119.74 120.45 2wan s LYS 366 Ca 0.09 -1.32 -0.20 0.00 -1.00 0.00 0.00 55.97 53.55 2wan s LYS 366 Cb -0.09 -0.27 0.09 0.00 -2.06 0.00 0.00 37.83 35.51 2wan s LYS 366 CO -0.01 -0.00 0.79 -1.17 0.10 0.00 0.00 175.35 175.06 2wan s LEU 367 N -2.97 -0.76 -0.20 2.77 2.96 -0.51 -0.87 118.68 119.10 2wan s LEU 367 Ca 0.11 1.31 -0.09 0.00 -0.22 0.00 0.00 54.13 55.23 2wan s LEU 367 Cb 0.04 2.25 -0.05 0.00 0.50 0.00 0.00 46.19 48.93 2wan s LEU 367 CO -0.04 -0.21 0.11 -1.58 -1.32 0.00 0.00 176.35 173.31 2wan s GLN 368 N 1.03 4.11 -0.23 1.98 0.74 -1.26 -0.24 119.66 125.79 2wan s GLN 368 Ca -0.05 -0.27 -0.02 0.00 0.05 0.00 0.00 55.36 55.08 2wan s GLN 368 Cb -0.05 -3.37 0.01 0.00 1.10 0.00 0.00 33.01 30.71 2wan s GLN 368 CO -0.11 0.26 -0.08 0.08 -0.55 0.00 0.00 175.29 174.89 2wan s VAL 369 N 0.45 2.87 0.44 1.34 1.01 -0.04 -5.00 120.40 121.47 2wan s VAL 369 Ca 0.06 -0.84 -0.24 0.00 0.00 0.00 0.00 61.98 60.97 2wan s VAL 369 Cb -0.12 -2.36 -0.08 0.00 0.00 0.00 0.00 36.38 33.82 2wan s VAL 369 CO -0.01 0.34 1.17 -0.44 0.00 0.00 0.00 175.10 176.16 2wan s SER 370 N 1.37 6.28 0.00 3.32 0.01 -1.26 -1.35 113.70 122.06 2wan s SER 370 Ca 0.03 2.32 0.00 0.00 1.31 0.00 0.00 55.95 59.61 2wan s SER 370 Cb -0.15 -2.61 0.00 0.00 0.21 0.00 0.00 66.02 63.47 2wan s SER 370 CO -0.06 -0.84 0.00 0.61 0.41 0.00 0.00 173.24 173.36 2wan n GLY 371 N 0.49 1.39 3.42 3.44 0.00 0.48 -4.90 105.19 109.51 2wan n GLY 371 Ca 0.06 -2.15 -0.44 0.00 0.00 0.00 0.00 46.02 43.50 2wan n GLY 371 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2wan s ASN 372 N 0.00 6.17 -0.21 1.61 3.84 -1.23 -2.67 114.94 122.46 2wan s ASN 372 Ca 0.00 -1.12 0.14 0.00 0.21 0.00 0.00 52.86 52.09 2wan s ASN 372 Cb 0.00 -2.22 0.77 0.00 -0.55 0.00 0.00 41.25 39.25 2wan s ASN 372 CO 0.00 -0.70 1.67 0.18 -2.79 0.00 0.00 177.10 175.46 2wan n LEU 373 N 5.52 5.37 -4.69 3.21 4.77 -1.26 -4.98 117.00 124.94 2wan n LEU 373 Ca -0.10 -2.72 -0.45 0.00 -0.03 0.00 0.00 56.01 52.71 2wan n LEU 373 Cb 0.45 -0.66 -0.04 0.00 -2.33 0.00 0.00 43.42 40.84 2wan n LEU 373 CO 0.49 0.63 1.23 1.21 -1.33 0.00 0.00 177.39 179.61 2wan n GLU 374 N 0.66 2.35 -1.04 3.23 2.13 -1.26 -1.60 120.64 125.10 2wan n GLU 374 Ca 0.26 0.84 -0.01 0.00 0.66 0.00 0.00 57.16 58.91 2wan n GLU 374 Cb 1.11 -2.62 -0.01 0.00 0.27 0.00 0.00 31.44 30.19 2wan n GLU 374 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 2wan n ASN 375 N 3.35 -4.25 -4.87 4.31 3.02 0.43 -5.02 115.26 112.22 2wan n ASN 375 Ca 0.16 0.04 -0.30 0.00 -0.03 0.00 0.00 54.58 54.44 2wan n ASN 375 Cb 0.31 -1.87 0.00 0.00 -0.61 0.00 0.00 39.78 37.61 2wan n ASN 375 CO 0.00 0.00 0.00 0.26 -2.62 0.00 0.00 177.26 174.90 2wan s TRP 376 N -1.69 3.59 0.18 3.10 0.52 -0.63 -4.85 118.94 119.16 2wan s TRP 376 Ca 0.00 1.20 0.09 0.00 0.02 0.00 0.00 56.10 57.41 2wan s TRP 376 Cb 0.00 -2.63 -0.04 0.00 -1.15 0.00 0.00 33.47 29.65 2wan s TRP 376 CO 0.00 -0.55 -0.09 0.71 0.02 0.00 0.00 176.95 177.04 2wan s TYR 377 N -3.00 2.64 0.13 -1.98 1.51 -0.04 -0.73 117.35 115.89 2wan s TYR 377 Ca 0.54 -0.22 -0.16 0.00 -1.01 0.00 0.00 57.07 56.22 2wan s TYR 377 Cb -0.11 -1.29 0.03 0.00 -0.11 0.00 0.00 41.96 40.49 2wan s TYR 377 CO 0.49 0.51 0.40 1.52 -1.11 0.00 0.00 175.55 177.36 2wan s TYR 378 N -1.72 -0.15 0.04 2.71 1.13 0.25 -0.55 117.35 119.06 2wan s TYR 378 Ca 0.25 -0.17 -0.01 0.00 -1.41 0.00 0.00 57.07 55.73 2wan s TYR 378 Cb -0.09 0.24 -0.03 0.00 -1.10 0.00 0.00 41.96 40.99 2wan s TYR 378 CO 0.15 -0.72 -0.02 -0.51 -2.51 0.00 0.00 175.55 171.94 2wan s LEU 379 N -2.82 2.37 -0.09 -3.49 1.43 -0.31 -1.01 118.68 114.77 2wan s LEU 379 Ca 0.04 -0.82 -0.12 0.00 -1.03 0.00 0.00 54.13 52.20 2wan s LEU 379 Cb 0.02 0.19 -0.05 0.00 0.03 0.00 0.00 46.19 46.38 2wan s LEU 379 CO -0.11 -0.50 0.29 -0.31 0.23 0.00 0.00 176.35 175.95 2wan s TYR 380 N -3.10 3.61 -0.30 0.29 2.02 -0.24 -0.65 117.35 118.96 2wan s TYR 380 Ca -0.01 0.73 -0.07 0.00 -0.37 0.00 0.00 57.07 57.36 2wan s TYR 380 Cb 0.02 -2.21 0.01 0.00 -0.40 0.00 0.00 41.96 39.39 2wan s TYR 380 CO -0.07 0.54 0.09 -1.14 -1.57 0.00 0.00 175.55 173.40 2wan s GLN 381 N -0.56 3.03 -0.17 -0.62 0.74 0.54 -0.49 119.66 122.13 2wan s GLN 381 Ca 0.19 -0.90 0.01 0.00 0.05 0.00 0.00 55.36 54.70 2wan s GLN 381 Cb -0.14 -3.39 0.01 0.00 1.10 0.00 0.00 33.01 30.59 2wan s GLN 381 CO 0.08 -0.48 -0.18 0.08 -0.55 0.00 0.00 175.29 174.24 2wan s VAL 382 N 1.49 2.35 -0.32 1.34 1.01 0.49 -0.75 120.40 126.01 2wan s VAL 382 Ca 0.02 -0.86 -0.12 0.00 0.00 0.00 0.00 61.98 61.02 2wan s VAL 382 Cb -0.17 -1.99 -0.02 0.00 0.00 0.00 0.00 36.38 34.19 2wan s VAL 382 CO 0.03 0.52 0.21 -0.89 0.00 0.00 0.00 175.10 174.97 2wan s THR 383 N 1.09 5.15 0.00 3.92 2.01 -0.08 -1.75 115.64 125.98 2wan s THR 383 Ca -0.00 -0.18 0.00 0.00 0.31 0.00 0.00 61.69 61.82 2wan s THR 383 Cb -0.14 -3.60 0.00 0.00 0.01 0.00 0.00 72.50 68.77 2wan s THR 383 CO -0.06 0.06 0.00 0.52 -0.69 0.00 0.00 174.62 174.45 2wan n VAL 384 N 5.07 0.00 0.00 3.82 0.31 -0.77 -0.63 118.33 126.13 2wan n VAL 384 Ca -0.13 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.20 2wan n VAL 384 Cb 0.50 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.43 2wan n VAL 384 CO 0.00 0.00 0.00 -3.20 -1.32 0.00 0.00 176.83 172.31 2wan n ASN 385 N 0.00 0.00 0.00 4.52 5.15 -1.26 -2.08 115.26 121.59 2wan n ASN 385 Ca 0.00 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 53.98 2wan n ASN 385 Cb 0.00 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.25 2wan n ASN 385 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2wan n GLY 386 N 0.00 2.16 3.99 8.20 0.00 -1.26 -5.01 105.19 113.27 2wan n GLY 386 Ca 0.00 -0.57 -0.20 0.00 0.00 0.00 0.00 46.02 45.25 2wan n GLY 386 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2wan s THR 387 N 0.00 2.65 -0.16 2.61 -4.23 -0.88 -5.06 115.64 110.56 2wan s THR 387 Ca 0.00 -0.75 -0.03 0.00 -1.18 0.00 0.00 61.69 59.72 2wan s THR 387 Cb 0.00 -2.89 -0.02 0.00 1.34 0.00 0.00 72.50 70.92 2wan s THR 387 CO 0.00 0.00 -0.05 -0.89 -0.54 0.00 0.00 174.62 173.14 2wan s THR 388 N -2.71 3.73 0.20 3.99 2.01 -1.26 -1.85 115.64 119.75 2wan s THR 388 Ca 0.58 -0.41 0.01 0.00 0.31 0.00 0.00 61.69 62.18 2wan s THR 388 Cb -0.09 -2.64 -0.05 0.00 0.01 0.00 0.00 72.50 69.73 2wan s THR 388 CO 0.38 0.49 0.04 -1.10 -0.69 0.00 0.00 174.62 173.73 2wan s GLN 389 N 0.48 1.19 0.11 4.92 -0.21 -0.72 -4.97 119.66 120.47 2wan s GLN 389 Ca -0.04 -1.60 0.04 0.00 0.02 0.00 0.00 55.36 53.79 2wan s GLN 389 Cb -0.14 -0.21 -0.04 0.00 1.00 0.00 0.00 33.01 33.62 2wan s GLN 389 CO 0.03 -0.20 0.07 0.95 -2.12 0.00 0.00 175.29 174.02 2wan s THR 390 N -3.73 4.33 -0.02 -0.19 -4.23 -1.26 -0.37 115.64 110.16 2wan s THR 390 Ca 0.28 -0.96 -0.07 0.00 -1.18 0.00 0.00 61.69 59.77 2wan s THR 390 Cb 0.07 -3.12 0.01 0.00 1.34 0.00 0.00 72.50 70.79 2wan s THR 390 CO 0.07 0.04 0.15 0.00 -0.54 0.00 0.00 174.62 174.34 2wan s ALA 391 N -1.50 -0.36 0.19 3.99 0.00 0.36 -4.98 121.76 119.47 2wan s ALA 391 Ca 0.29 0.11 -0.30 0.00 0.00 0.00 0.00 51.96 52.06 2wan s ALA 391 Cb -0.11 -0.04 -0.08 0.00 0.00 0.00 0.00 23.12 22.88 2wan s ALA 391 CO 0.21 -0.16 1.11 0.08 0.00 0.00 0.00 175.76 177.01 2wan s VAL 392 N -0.79 3.78 -0.13 0.00 1.01 -1.26 -1.08 120.40 121.93 2wan s VAL 392 Ca -0.09 1.57 -0.36 0.00 0.00 0.00 0.00 61.98 63.10 2wan s VAL 392 Cb -0.05 -4.00 -0.13 0.00 0.00 0.00 0.00 36.38 32.20 2wan s VAL 392 CO 0.01 0.28 1.84 -0.67 0.00 0.00 0.00 175.10 176.56 2wan n ASP 393 N 2.22 3.17 0.29 3.32 -0.08 -1.26 -4.84 116.55 119.36 2wan n ASP 393 Ca 0.02 1.00 0.19 0.00 -1.51 0.00 0.00 54.79 54.49 2wan n ASP 393 Cb 0.46 -1.31 0.98 0.00 2.34 0.00 0.00 41.12 43.58 2wan n ASP 393 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 2wan h PRO 394 N 8.61 0.00 -0.29 -0.67 0.11 -1.94 -0.85 132.00 136.97 2wan h PRO 394 Ca -0.48 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.63 2wan h PRO 394 Cb 1.28 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.39 2wan h PRO 394 CO 0.95 0.00 0.00 0.66 -0.21 0.00 0.00 178.00 179.40 2wan n TYR 395 N -3.39 0.37 -1.72 0.65 4.02 -1.26 -4.61 117.16 111.22 2wan n TYR 395 Ca -0.01 -0.19 -0.40 0.00 -0.01 0.00 0.00 57.90 57.29 2wan n TYR 395 Cb 0.21 0.00 0.02 0.00 -0.02 0.00 0.00 39.34 39.55 2wan n TYR 395 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2wan n ALA 396 N 0.88 1.53 0.84 -0.72 0.00 -0.33 -4.71 120.51 118.00 2wan n ALA 396 Ca 0.17 0.25 0.09 0.00 0.00 0.00 0.00 53.44 53.95 2wan n ALA 396 Cb 0.45 -2.31 -0.11 0.00 0.00 0.00 0.00 19.45 17.48 2wan n ALA 396 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2wan n ARG 397 N -0.10 0.61 -3.78 0.00 5.12 -1.26 -4.37 116.66 112.88 2wan n ARG 397 Ca 0.06 -0.01 -0.10 0.00 -1.93 0.00 0.00 57.85 55.87 2wan n ARG 397 Cb 0.40 -1.42 -0.04 0.00 -1.16 0.00 0.00 32.46 30.24 2wan n ARG 397 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 2wan s ALA 398 N -2.87 -0.75 0.13 7.54 0.00 -1.26 -4.59 121.76 119.96 2wan s ALA 398 Ca 0.06 -0.35 -0.06 0.00 0.00 0.00 0.00 51.96 51.62 2wan s ALA 398 Cb 0.14 0.85 -0.02 0.00 0.00 0.00 0.00 23.12 24.09 2wan s ALA 398 CO 0.80 -0.77 0.16 0.96 0.00 0.00 0.00 175.76 176.91 2wan s ILE 399 N -3.89 0.11 0.93 0.00 -4.36 -1.26 -0.85 121.20 111.87 2wan s ILE 399 Ca 0.11 -1.55 -0.12 0.00 -0.26 0.00 0.00 60.65 58.82 2wan s ILE 399 Cb -0.00 -1.77 0.15 0.00 1.25 0.00 0.00 42.46 42.09 2wan s ILE 399 CO -0.02 -0.50 1.09 -0.94 0.24 0.00 0.00 174.94 174.81 2wan s SER 400 N -2.97 3.20 0.16 4.36 1.04 -0.28 -4.48 113.70 114.72 2wan s SER 400 Ca 0.16 1.38 -0.34 0.00 0.48 0.00 0.00 55.95 57.63 2wan s SER 400 Cb 0.05 -2.06 -0.14 0.00 0.10 0.00 0.00 66.02 63.97 2wan s SER 400 CO -0.03 -2.80 1.49 0.52 0.98 0.00 0.00 173.24 173.41 2wan n VAL 401 N -3.98 0.15 -1.16 5.02 0.31 -1.26 -1.03 118.33 116.38 2wan n VAL 401 Ca 0.06 -0.04 -0.06 0.00 -0.01 0.00 0.00 64.34 64.30 2wan n VAL 401 Cb 0.56 -1.35 -0.02 0.00 -0.91 0.00 0.00 33.84 32.11 2wan n VAL 401 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 2wan n ASN 402 N 3.02 -5.07 -3.69 4.52 5.03 -1.26 -3.77 115.26 114.04 2wan n ASN 402 Ca 0.17 0.14 -0.25 0.00 0.87 0.00 0.00 54.58 55.51 2wan n ASN 402 Cb 0.27 -3.06 0.06 0.00 -1.02 0.00 0.00 39.78 36.03 2wan n ASN 402 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2wan n ALA 403 N 1.10 -1.49 0.21 5.41 0.00 -0.20 -4.87 120.51 120.68 2wan n ALA 403 Ca -0.06 0.21 0.07 0.00 0.00 0.00 0.00 53.44 53.66 2wan n ALA 403 Cb 0.42 -4.34 0.46 0.00 0.00 0.00 0.00 19.45 15.99 2wan n ALA 403 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.50 179.29 2wan h THR 404 N -2.30 0.84 -3.25 0.00 1.35 -1.75 -3.46 112.91 104.34 2wan h THR 404 Ca -0.58 -1.14 -0.10 0.00 -0.55 0.00 0.00 66.41 64.04 2wan h THR 404 Cb 1.37 1.69 -0.18 0.00 -1.73 0.00 0.00 68.15 69.30 2wan h THR 404 CO 0.59 0.28 -0.26 -0.13 -0.25 0.00 0.00 175.52 175.75 2wan s ARG 405 N -3.91 0.77 0.56 4.72 0.52 -1.26 -4.86 118.95 115.50 2wan s ARG 405 Ca -0.01 -0.44 -0.13 0.00 -0.52 0.00 0.00 55.73 54.63 2wan s ARG 405 Cb 0.12 0.34 -0.06 0.00 0.52 0.00 0.00 34.95 35.87 2wan s ARG 405 CO 0.66 -0.24 0.99 0.20 0.02 0.00 0.00 175.30 176.93 2wan s GLY 406 N -1.90 1.83 -0.07 -3.53 0.00 -0.18 -1.13 107.32 102.34 2wan s GLY 406 Ca -0.07 0.00 0.03 0.00 0.00 0.00 0.00 44.72 44.68 2wan s GLY 406 CO -0.02 0.27 -0.15 -0.29 0.00 0.00 0.00 173.10 172.91 2wan s MET 407 N -4.66 2.00 -0.14 2.90 1.75 -0.03 -0.59 119.30 120.54 2wan s MET 407 Ca 0.56 -0.53 -0.23 0.00 -1.25 0.00 0.00 55.69 54.24 2wan s MET 407 Cb -0.10 -1.61 -0.03 0.00 2.84 0.00 0.00 34.83 35.93 2wan s MET 407 CO 0.44 0.08 0.70 0.42 -0.65 0.00 0.00 175.02 176.01 2wan s ILE 408 N 0.54 5.00 0.05 10.11 1.01 0.09 -3.98 121.20 134.02 2wan s ILE 408 Ca -0.15 1.39 0.01 0.00 0.00 0.00 0.00 60.65 61.90 2wan s ILE 408 Cb -0.16 -4.03 -0.03 0.00 0.01 0.00 0.00 42.46 38.25 2wan s ILE 408 CO 0.05 0.15 -0.05 0.68 0.00 0.00 0.00 174.94 175.77 2wan s VAL 409 N 1.49 0.37 -0.65 2.92 -7.23 -1.26 -0.43 120.40 115.61 2wan s VAL 409 Ca 0.35 -1.46 -0.24 0.00 -1.81 0.00 0.00 61.98 58.82 2wan s VAL 409 Cb -0.17 -1.04 0.06 0.00 0.56 0.00 0.00 36.38 35.79 2wan s VAL 409 CO 0.14 -0.71 1.03 -0.62 -0.31 0.00 0.00 175.10 174.62 2wan s ASP 410 N -2.29 6.21 0.35 4.85 -1.08 -1.26 -4.80 116.67 118.64 2wan s ASP 410 Ca -0.01 -0.73 0.03 0.00 -0.52 0.00 0.00 52.55 51.31 2wan s ASP 410 Cb -0.01 -2.45 0.62 0.00 -1.46 0.00 0.00 42.92 39.62 2wan s ASP 410 CO -0.04 -1.48 1.98 -0.07 0.52 0.00 0.00 175.17 176.07 2wan h LEU 411 N 11.63 0.68 -0.73 -1.34 3.38 -1.99 -2.51 115.31 124.43 2wan h LEU 411 Ca -0.28 -0.04 0.07 0.00 0.09 0.00 0.00 57.88 57.71 2wan h LEU 411 Cb 1.07 -0.17 -0.06 0.00 0.09 0.00 0.00 40.66 41.58 2wan h LEU 411 CO 1.18 0.54 0.41 0.50 0.09 0.00 0.00 178.44 181.17 2wan h LYS 412 N 0.77 0.72 0.00 1.13 1.63 -1.99 -1.27 116.57 117.57 2wan h LYS 412 Ca 0.20 -0.04 -0.00 0.00 -0.85 0.00 0.00 60.65 59.96 2wan h LYS 412 Cb 0.01 -0.16 -0.00 0.00 -0.60 0.00 0.00 32.23 31.48 2wan h LYS 412 CO -0.03 0.48 -0.00 0.00 -3.45 0.00 0.00 179.45 176.44 2wan h ALA 413 N 1.38 1.01 0.00 5.00 0.00 -1.88 -2.02 119.26 122.75 2wan h ALA 413 Ca 0.33 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.24 2wan h ALA 413 Cb 0.23 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.02 2wan h ALA 413 CO -0.20 0.00 0.00 0.25 0.00 0.00 0.00 179.25 179.30 2wan n THR 414 N -3.10 0.45 -2.07 0.00 -2.24 -0.48 -4.88 114.28 101.97 2wan n THR 414 Ca -0.01 -0.22 -0.41 0.00 -2.27 0.00 0.00 64.05 61.14 2wan n THR 414 Cb 0.19 -0.57 -0.03 0.00 -2.10 0.00 0.00 70.33 67.82 2wan n THR 414 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 2wan s ASP 415 N -4.16 6.72 0.79 3.42 1.01 -0.76 -4.09 116.67 119.60 2wan s ASP 415 Ca 0.11 2.57 -0.11 0.00 0.71 0.00 0.00 52.55 55.83 2wan s ASP 415 Cb 0.14 -2.61 0.07 0.00 1.01 0.00 0.00 42.92 41.52 2wan s ASP 415 CO 0.58 -0.67 1.09 -2.16 0.21 0.00 0.00 175.17 174.22 2wan s PRO 416 N 0.01 2.10 0.35 8.23 0.04 -1.26 -4.96 135.00 139.50 2wan s PRO 416 Ca 0.60 0.81 -0.28 0.00 0.04 0.00 0.00 61.00 62.17 2wan s PRO 416 Cb -0.40 -1.91 -0.12 0.00 0.04 0.00 0.00 34.50 32.11 2wan s PRO 416 CO 0.39 -1.65 1.43 0.00 0.04 0.00 0.00 177.00 177.22 2wan n ALA 417 N -3.48 1.98 -0.26 8.56 0.00 -1.26 -2.41 120.51 123.64 2wan n ALA 417 Ca 0.07 0.36 0.00 0.00 0.00 0.00 0.00 53.44 53.87 2wan n ALA 417 Cb 0.55 -2.36 0.00 0.00 0.00 0.00 0.00 19.45 17.64 2wan n ALA 417 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wan n GLY 418 N 0.89 1.51 0.37 0.00 0.00 -1.26 -4.93 105.19 101.77 2wan n GLY 418 Ca 0.04 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.18 2wan n GLY 418 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 173.32 173.07 2wan h TRP 419 N 0.00 0.64 0.00 1.61 2.91 -1.85 -0.25 115.95 119.01 2wan h TRP 419 Ca 0.00 0.02 0.00 0.00 1.13 0.00 0.00 58.89 60.04 2wan h TRP 419 Cb 0.00 -0.20 0.00 0.00 -0.51 0.00 0.00 29.16 28.45 2wan h TRP 419 CO 0.00 0.27 0.00 1.96 -1.03 0.00 0.00 178.44 179.64 2wan h GLN 420 N 0.57 0.00 -0.02 2.65 1.08 -1.92 -1.93 115.11 115.54 2wan h GLN 420 Ca 0.37 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.57 2wan h GLN 420 Cb 0.63 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.06 2wan h GLN 420 CO -0.13 0.00 -0.00 0.41 -0.95 0.00 0.00 178.83 178.16 2wan n GLY 421 N -0.63 0.43 3.74 3.46 0.00 -0.11 -4.97 105.19 107.11 2wan n GLY 421 Ca -0.00 -0.55 -0.41 0.00 0.00 0.00 0.00 46.02 45.05 2wan n GLY 421 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2wan s ASP 422 N -2.00 6.63 -0.13 1.61 2.15 -0.73 -5.02 116.67 119.19 2wan s ASP 422 Ca 0.34 2.66 0.01 0.00 0.43 0.00 0.00 52.55 55.99 2wan s ASP 422 Cb 0.21 -2.62 -0.01 0.00 -0.30 0.00 0.00 42.92 40.20 2wan s ASP 422 CO 0.32 -0.73 -0.17 -2.28 -0.17 0.00 0.00 175.17 172.14 2wan s HIS 423 N 0.22 2.73 0.60 -5.34 5.65 -1.26 -5.11 115.29 112.78 2wan s HIS 423 Ca 0.61 -0.83 -0.19 0.00 0.25 0.00 0.00 55.06 54.90 2wan s HIS 423 Cb -0.42 -1.81 -0.04 0.00 -1.18 0.00 0.00 32.58 29.12 2wan s HIS 423 CO 0.41 -0.32 1.05 -0.85 -0.65 0.00 0.00 174.74 174.38 2wan n GLU 424 N 3.61 1.01 -3.73 2.88 0.00 -1.26 -4.87 120.64 118.28 2wan n GLU 424 Ca -0.19 0.39 -0.29 0.00 0.00 0.00 0.00 57.16 57.08 2wan n GLU 424 Cb 0.53 -2.25 -0.10 0.00 0.00 0.00 0.00 31.44 29.61 2wan n GLU 424 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.13 178.17 2wan n GLN 425 N -1.11 2.14 -3.89 3.44 1.13 -1.26 -5.02 117.38 112.81 2wan n GLN 425 Ca 0.14 -4.55 -0.30 0.00 -1.94 0.00 0.00 57.00 50.35 2wan n GLN 425 Cb 0.47 -2.29 -0.16 0.00 0.11 0.00 0.00 30.24 28.37 2wan n GLN 425 CO 0.00 0.00 0.00 0.95 -1.44 0.00 0.00 177.06 176.57 2wan s THR 426 N -1.79 1.27 1.01 5.09 -4.23 -1.26 -4.52 115.64 111.21 2wan s THR 426 Ca 0.30 -1.05 -0.17 0.00 -1.18 0.00 0.00 61.69 59.59 2wan s THR 426 Cb 0.01 -1.60 0.22 0.00 1.34 0.00 0.00 72.50 72.47 2wan s THR 426 CO -0.12 -0.13 1.29 -2.16 -0.54 0.00 0.00 174.62 172.97 2wan s PRO 427 N 1.51 0.25 0.38 3.99 0.04 -1.26 -4.82 135.00 135.10 2wan s PRO 427 Ca -0.05 -0.37 0.07 0.00 0.04 0.00 0.00 61.00 60.70 2wan s PRO 427 Cb -0.18 -1.80 0.77 0.00 0.04 0.00 0.00 34.50 33.33 2wan s PRO 427 CO -0.07 -2.68 1.96 0.00 0.04 0.00 0.00 177.00 176.26 2wan h ALA 428 N -1.83 1.55 -2.66 8.56 0.00 -1.97 -3.41 119.26 119.50 2wan h ALA 428 Ca -0.44 -0.13 -0.13 0.00 0.00 0.00 0.00 54.91 54.20 2wan h ALA 428 Cb 1.24 -0.13 -0.21 0.00 0.00 0.00 0.00 17.79 18.69 2wan h ALA 428 CO 0.36 0.34 -0.34 1.21 0.00 0.00 0.00 179.25 180.82 2wan s ASN 429 N -6.77 -0.16 0.55 0.00 3.84 -1.26 -4.86 114.94 106.28 2wan s ASN 429 Ca -0.07 0.11 0.25 0.00 0.21 0.00 0.00 52.86 53.36 2wan s ASN 429 Cb 0.16 0.34 1.45 0.00 -0.55 0.00 0.00 41.25 42.65 2wan s ASN 429 CO 0.74 -0.37 2.04 -0.65 -2.79 0.00 0.00 177.10 176.08 2wan h PRO 430 N 4.29 0.00 0.00 0.43 0.11 -1.90 -1.31 132.00 133.62 2wan h PRO 430 Ca -0.29 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.82 2wan h PRO 430 Cb 1.18 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.29 2wan h PRO 430 CO 0.39 0.00 0.00 1.33 -0.21 0.00 0.00 178.00 179.51 2wan n VAL 431 N -4.21 1.40 1.52 3.15 0.24 -1.26 -1.48 118.33 117.69 2wan n VAL 431 Ca 0.05 0.35 0.14 0.00 -2.04 0.00 0.00 64.34 62.84 2wan n VAL 431 Cb 0.45 -1.23 0.57 0.00 -1.47 0.00 0.00 33.84 32.16 2wan n VAL 431 CO 0.00 0.00 0.00 0.47 -2.14 0.00 0.00 176.83 175.16 2wan n ASP 432 N -1.46 1.12 -4.88 -1.34 8.00 -0.49 -4.80 116.55 112.70 2wan n ASP 432 Ca 0.02 -1.25 -0.34 0.00 0.71 0.00 0.00 54.79 53.93 2wan n ASP 432 Cb 0.08 0.01 -0.05 0.00 -0.02 0.00 0.00 41.12 41.14 2wan n ASP 432 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 2wan s GLU 433 N -2.12 3.67 -0.27 -1.24 2.02 -0.55 -4.96 118.70 115.24 2wan s GLU 433 Ca 0.36 0.03 0.03 0.00 0.02 0.00 0.00 54.97 55.42 2wan s GLU 433 Cb 0.21 -3.02 0.07 0.00 0.10 0.00 0.00 34.13 31.49 2wan s GLU 433 CO 0.38 0.59 -0.07 0.08 0.02 0.00 0.00 175.26 176.26 2wan s VAL 434 N -1.39 2.10 -0.12 2.63 1.01 -1.26 -3.97 120.40 119.40 2wan s VAL 434 Ca 0.32 -1.74 -0.15 0.00 0.00 0.00 0.00 61.98 60.41 2wan s VAL 434 Cb -0.13 -2.30 -0.05 0.00 0.00 0.00 0.00 36.38 33.90 2wan s VAL 434 CO 0.18 -0.17 0.37 -0.63 0.00 0.00 0.00 175.10 174.85 2wan s ILE 435 N 1.10 5.23 -0.26 2.22 1.01 -0.62 -1.68 121.20 128.20 2wan s ILE 435 Ca -0.04 0.72 0.03 0.00 0.00 0.00 0.00 60.65 61.36 2wan s ILE 435 Cb -0.20 -3.70 0.06 0.00 0.01 0.00 0.00 42.46 38.64 2wan s ILE 435 CO -0.06 0.40 -0.08 -0.47 0.00 0.00 0.00 174.94 174.73 2wan s TYR 436 N 0.24 3.12 -0.01 3.97 6.14 0.09 -0.75 117.35 130.15 2wan s TYR 436 Ca 0.21 -2.27 -0.30 0.00 0.64 0.00 0.00 57.07 55.34 2wan s TYR 436 Cb -0.14 -1.96 -0.03 0.00 0.42 0.00 0.00 41.96 40.25 2wan s TYR 436 CO 0.07 -0.87 1.05 -2.00 0.64 0.00 0.00 175.55 174.45 2wan s GLU 437 N 1.15 4.49 -0.08 4.97 2.12 -0.39 -1.03 118.70 129.92 2wan s GLU 437 Ca -0.06 1.50 -0.08 0.00 0.36 0.00 0.00 54.97 56.70 2wan s GLU 437 Cb -0.20 -3.46 0.02 0.00 0.26 0.00 0.00 34.13 30.75 2wan s GLU 437 CO -0.06 -0.18 0.22 0.00 -0.54 0.00 0.00 175.26 174.71 2wan s ALA 438 N 1.32 -0.54 -0.04 6.30 0.00 -0.10 -0.09 121.76 128.61 2wan s ALA 438 Ca 0.53 0.62 -0.18 0.00 0.00 0.00 0.00 51.96 52.93 2wan s ALA 438 Cb -0.22 -0.36 -0.05 0.00 0.00 0.00 0.00 23.12 22.48 2wan s ALA 438 CO 0.26 -0.10 0.50 -1.58 0.00 0.00 0.00 175.76 174.84 2wan s HIS 439 N 0.13 3.65 0.26 0.00 2.46 -1.26 -1.25 115.29 119.28 2wan s HIS 439 Ca -0.00 1.04 -0.03 0.00 0.47 0.00 0.00 55.06 56.54 2wan s HIS 439 Cb -0.02 -2.50 0.38 0.00 -0.13 0.00 0.00 32.58 30.32 2wan s HIS 439 CO 0.00 0.38 1.89 0.28 -2.47 0.00 0.00 174.74 174.82 2wan h VAL 440 N 4.18 1.12 -0.03 0.89 2.07 -1.93 -1.81 116.25 120.75 2wan h VAL 440 Ca -0.46 -0.42 -0.02 0.00 0.82 0.00 0.00 66.70 66.63 2wan h VAL 440 Cb 1.20 -0.20 -0.00 0.00 -1.52 0.00 0.00 31.29 30.77 2wan h VAL 440 CO 0.69 0.22 -0.04 -0.09 0.02 0.00 0.00 177.57 178.37 2wan h ARG 441 N 1.21 0.07 -0.98 1.57 2.43 -1.93 -3.29 114.38 113.46 2wan h ARG 441 Ca 0.42 -0.05 0.13 0.00 -0.81 0.00 0.00 59.98 59.68 2wan h ARG 441 Cb 0.11 0.01 -0.08 0.00 -0.42 0.00 0.00 29.97 29.58 2wan h ARG 441 CO -0.16 0.61 0.62 -0.44 -1.51 0.00 0.00 179.97 179.09 2wan h ASP 442 N -0.45 0.87 -0.93 -3.80 3.32 -1.79 -2.06 116.42 111.58 2wan h ASP 442 Ca 0.00 0.05 0.14 0.00 0.02 0.00 0.00 57.03 57.25 2wan h ASP 442 Cb 0.60 -0.12 -0.08 0.00 0.22 0.00 0.00 39.33 39.96 2wan h ASP 442 CO 0.01 0.44 0.59 0.15 -1.72 0.00 0.00 179.24 178.72 2wan h PHE 443 N 0.92 0.91 0.00 4.55 3.57 -1.40 0.55 116.94 126.04 2wan h PHE 443 Ca 0.50 0.03 0.00 0.00 3.53 0.00 0.00 57.97 62.02 2wan h PHE 443 Cb 0.57 -0.29 0.00 0.00 2.79 0.00 0.00 35.95 39.02 2wan h PHE 443 CO -0.00 0.33 0.00 -1.13 -2.23 0.00 0.00 178.31 175.27 2wan n SER 444 N -4.59 0.22 0.20 0.41 3.41 -1.05 -4.68 113.62 107.54 2wan n SER 444 Ca 0.18 -0.99 0.05 0.00 -0.26 0.00 0.00 58.87 57.86 2wan n SER 444 Cb 0.46 0.00 0.42 0.00 -0.26 0.00 0.00 64.21 64.84 2wan n SER 444 CO 0.00 0.00 0.00 -0.29 -0.16 0.00 0.00 175.04 174.59 2wan h ILE 445 N 0.76 1.09 -3.61 -1.33 6.09 -1.49 -3.35 117.51 115.67 2wan h ILE 445 Ca 0.00 -1.15 -0.53 0.00 -1.37 0.00 0.00 64.86 61.81 2wan h ILE 445 Cb 0.38 1.64 0.09 0.00 0.47 0.00 0.00 36.82 39.40 2wan h ILE 445 CO 0.00 0.31 0.84 -0.62 -3.07 0.00 0.00 178.15 175.61 2wan s ASP 446 N -6.75 6.36 0.61 2.19 -1.08 -1.26 -4.81 116.67 111.93 2wan s ASP 446 Ca -0.02 3.00 0.29 0.00 -0.52 0.00 0.00 52.55 55.30 2wan s ASP 446 Cb 0.14 -2.65 1.57 0.00 -1.46 0.00 0.00 42.92 40.51 2wan s ASP 446 CO 0.70 -0.90 1.94 0.00 0.52 0.00 0.00 175.17 177.43 2wan h ALA 447 N 4.01 1.83 -0.28 3.66 0.00 -1.94 -1.21 119.26 125.32 2wan h ALA 447 Ca -0.49 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.41 2wan h ALA 447 Cb 1.23 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.04 2wan h ALA 447 CO 0.72 -0.51 0.00 0.27 0.00 0.00 0.00 179.25 179.73 2wan n ASN 448 N -3.46 1.90 0.22 0.00 0.23 -1.26 -4.46 115.26 108.43 2wan n ASN 448 Ca 0.04 -1.86 0.14 0.00 -0.53 0.00 0.00 54.58 52.36 2wan n ASN 448 Cb 0.51 -0.18 0.36 0.00 -2.08 0.00 0.00 39.78 38.38 2wan n ASN 448 CO 0.00 0.00 0.00 0.77 -0.93 0.00 0.00 177.26 177.10 2wan h SER 449 N 2.28 0.00 0.00 0.53 4.64 -1.50 -3.38 113.55 116.13 2wan h SER 449 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2wan h SER 449 Cb 0.51 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.60 2wan h SER 449 CO 0.00 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.57 2wan n GLY 450 N 0.78 1.39 3.85 -0.77 0.00 -1.24 -4.61 105.19 104.59 2wan n GLY 450 Ca 0.03 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.68 2wan n GLY 450 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2wan s MET 451 N -0.13 3.74 0.01 1.61 -1.94 -1.26 -4.40 119.30 116.93 2wan s MET 451 Ca 0.00 0.18 -0.19 0.00 -1.71 0.00 0.00 55.69 53.98 2wan s MET 451 Cb 0.00 -3.22 -0.27 0.00 2.01 0.00 0.00 34.83 33.35 2wan s MET 451 CO 0.00 0.71 1.05 0.87 -0.01 0.00 0.00 175.02 177.64 2wan h LYS 452 N 4.89 0.46 -3.34 2.03 1.57 -1.93 -3.37 116.57 116.87 2wan h LYS 452 Ca -0.53 -0.58 -0.73 0.00 -1.87 0.00 0.00 60.65 56.94 2wan h LYS 452 Cb 1.22 0.19 -0.08 0.00 0.08 0.00 0.00 32.23 33.64 2wan h LYS 452 CO 0.61 1.23 2.74 0.09 -0.57 0.00 0.00 179.45 183.54 2wan n ASN 453 N -4.06 6.10 -4.69 0.86 3.02 -1.26 -4.95 115.26 110.28 2wan n ASN 453 Ca -0.12 -2.95 -0.42 0.00 -0.03 0.00 0.00 54.58 51.06 2wan n ASN 453 Cb 0.81 -1.51 -0.03 0.00 -0.61 0.00 0.00 39.78 38.43 2wan n ASN 453 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 2wan s LYS 454 N 1.09 4.21 0.00 3.52 1.02 -1.26 -2.01 119.74 126.31 2wan s LYS 454 Ca 0.50 2.27 0.00 0.00 0.02 0.00 0.00 55.97 58.77 2wan s LYS 454 Cb 0.14 -3.56 0.00 0.00 -0.52 0.00 0.00 37.83 33.89 2wan s LYS 454 CO -0.05 -0.70 0.00 0.41 -0.92 0.00 0.00 175.35 174.09 2wan n GLY 455 N 3.92 0.48 3.42 -3.33 0.00 -1.26 -4.82 105.19 103.60 2wan n GLY 455 Ca 0.15 -0.33 -0.25 0.00 0.00 0.00 0.00 46.02 45.60 2wan n GLY 455 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2wan s LYS 456 N -0.62 1.51 0.28 1.61 -0.14 -0.85 -4.10 119.74 117.43 2wan s LYS 456 Ca 0.00 -1.57 0.02 0.00 -1.36 0.00 0.00 55.97 53.05 2wan s LYS 456 Cb 0.00 -1.70 0.67 0.00 -1.68 0.00 0.00 37.83 35.12 2wan s LYS 456 CO 0.00 0.35 1.70 1.88 -0.76 0.00 0.00 175.35 178.51 2wan h TYR 457 N 2.93 0.58 0.00 3.18 0.05 -1.30 -2.01 116.97 120.41 2wan h TYR 457 Ca -0.43 0.04 0.00 0.00 0.05 0.00 0.00 58.73 58.39 2wan h TYR 457 Cb 1.22 -0.12 0.00 0.00 1.01 0.00 0.00 36.73 38.84 2wan h TYR 457 CO 0.72 -0.04 0.00 -0.07 -1.05 0.00 0.00 178.16 177.72 2wan h LEU 458 N 0.39 0.00 -1.79 3.88 3.38 -1.81 -2.04 115.31 117.31 2wan h LEU 458 Ca 0.53 0.00 0.13 0.00 0.09 0.00 0.00 57.88 58.63 2wan h LEU 458 Cb 0.97 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.69 2wan h LEU 458 CO -0.52 0.00 0.41 0.00 0.09 0.00 0.00 178.44 178.42 2wan h ALA 459 N 2.03 2.26 0.00 1.53 0.00 -1.47 -0.72 119.26 122.89 2wan h ALA 459 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2wan h ALA 459 Cb 0.27 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.04 2wan h ALA 459 CO 0.00 -0.42 0.00 1.19 0.00 0.00 0.00 179.25 180.02 2wan n PHE 460 N -4.43 0.00 1.00 0.00 3.01 -0.77 -2.62 117.46 113.65 2wan n PHE 460 Ca 0.11 0.00 0.11 0.00 1.01 0.00 0.00 57.45 58.68 2wan n PHE 460 Cb 0.51 -0.21 0.01 0.00 -0.01 0.00 0.00 39.48 39.79 2wan n PHE 460 CO 0.00 0.00 0.00 0.25 1.01 0.00 0.00 176.76 178.02 2wan n THR 461 N -1.21 0.00 -3.03 4.37 -2.24 -0.28 -4.63 114.28 107.27 2wan n THR 461 Ca 0.11 -0.29 -0.42 0.00 -2.27 0.00 0.00 64.05 61.17 2wan n THR 461 Cb 0.13 1.29 -0.06 0.00 -2.10 0.00 0.00 70.33 69.59 2wan n THR 461 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 2wan s GLU 462 N -2.41 3.77 0.29 -0.78 2.02 -1.08 -5.05 118.70 115.46 2wan s GLU 462 Ca 0.20 0.25 -0.08 0.00 0.02 0.00 0.00 54.97 55.36 2wan s GLU 462 Cb 0.18 -3.79 -0.06 0.00 0.10 0.00 0.00 34.13 30.56 2wan s GLU 462 CO 0.53 -0.75 0.59 -1.01 0.02 0.00 0.00 175.26 174.65 2wan s HIS 463 N 2.88 3.45 -0.33 1.61 3.76 -1.26 -4.44 115.29 120.96 2wan s HIS 463 Ca 0.28 0.81 0.00 0.00 -0.15 0.00 0.00 55.06 56.00 2wan s HIS 463 Cb -0.14 -2.23 0.00 0.00 1.11 0.00 0.00 32.58 31.32 2wan s HIS 463 CO 0.15 0.16 0.00 0.41 -0.85 0.00 0.00 174.74 174.60 2wan n GLY 464 N -0.70 0.63 3.77 -2.22 0.00 -1.26 -5.00 105.19 100.41 2wan n GLY 464 Ca -0.00 -0.72 -0.38 0.00 0.00 0.00 0.00 46.02 44.92 2wan n GLY 464 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2wan s THR 465 N -2.08 4.16 0.06 2.61 -4.23 -1.26 -5.01 115.64 109.88 2wan s THR 465 Ca 0.00 1.90 0.05 0.00 -1.18 0.00 0.00 61.69 62.46 2wan s THR 465 Cb 0.00 -4.11 -0.03 0.00 1.34 0.00 0.00 72.50 69.71 2wan s THR 465 CO 0.00 0.25 -0.14 -0.54 -0.54 0.00 0.00 174.62 173.65 2wan s LYS 466 N -1.78 0.89 0.00 3.99 -0.14 -1.26 -1.74 119.74 119.70 2wan s LYS 466 Ca 0.47 -0.86 0.00 0.00 -1.36 0.00 0.00 55.97 54.22 2wan s LYS 466 Cb -0.21 -0.91 0.00 0.00 -1.68 0.00 0.00 37.83 35.03 2wan s LYS 466 CO 0.26 0.21 0.00 0.41 -0.76 0.00 0.00 175.35 175.48 2wan n GLY 467 N 1.58 5.97 3.68 -3.33 0.00 0.64 -3.68 105.19 110.04 2wan n GLY 467 Ca -0.20 -2.07 -0.44 0.00 0.00 0.00 0.00 46.02 43.32 2wan n GLY 467 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2wan n PRO 468 N -0.05 2.02 -1.80 1.61 -0.02 -1.26 -1.95 135.00 133.56 2wan n PRO 468 Ca 0.00 0.71 -0.15 0.00 -2.02 0.00 0.00 63.50 62.04 2wan n PRO 468 Cb 0.00 -2.31 -0.04 0.00 -0.02 0.00 0.00 33.50 31.13 2wan n PRO 468 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 2wan n ASP 469 N 1.35 -4.76 -1.14 2.55 2.03 -1.26 -2.64 116.55 112.67 2wan n ASP 469 Ca 0.08 0.22 -0.15 0.00 0.52 0.00 0.00 54.79 55.46 2wan n ASP 469 Cb 0.34 -3.74 -0.06 0.00 -0.72 0.00 0.00 41.12 36.94 2wan n ASP 469 CO 0.00 0.00 0.00 1.57 -1.92 0.00 0.00 177.20 176.85 2wan n HIS 470 N -3.16 0.00 -1.95 -0.67 -0.00 -0.82 -4.99 115.22 103.63 2wan n HIS 470 Ca -0.17 0.00 -0.38 0.00 -0.00 0.00 0.00 57.72 57.17 2wan n HIS 470 Cb 0.56 -2.63 0.02 0.00 -0.00 0.00 0.00 29.99 27.93 2wan n HIS 470 CO 0.00 0.00 0.00 0.14 -0.00 0.00 0.00 176.34 176.48 2wan s VAL 471 N -2.55 2.43 0.25 3.57 -7.23 -1.08 -4.72 120.40 111.06 2wan s VAL 471 Ca 0.00 0.34 -0.30 0.00 -1.81 0.00 0.00 61.98 60.21 2wan s VAL 471 Cb 0.00 -3.18 -0.09 0.00 0.56 0.00 0.00 36.38 33.67 2wan s VAL 471 CO 0.00 0.01 1.23 -0.54 -0.31 0.00 0.00 175.10 175.50 2wan s LYS 472 N -2.68 4.46 0.48 4.82 1.02 -1.26 -0.26 119.74 126.32 2wan s LYS 472 Ca 0.66 1.99 0.02 0.00 0.02 0.00 0.00 55.97 58.66 2wan s LYS 472 Cb -0.37 -3.18 -0.02 0.00 -0.52 0.00 0.00 37.83 33.74 2wan s LYS 472 CO 0.46 -0.09 0.03 0.95 -0.92 0.00 0.00 175.35 175.78 2wan s THR 473 N -0.52 1.08 0.00 2.17 -4.23 -0.71 -4.39 115.64 109.04 2wan s THR 473 Ca 0.51 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 59.02 2wan s THR 473 Cb -0.35 -2.24 0.00 0.00 1.34 0.00 0.00 72.50 71.25 2wan s THR 473 CO 0.42 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 175.11 2wan n GLY 474 N -1.18 0.61 0.25 3.99 0.00 -1.26 -2.72 105.19 104.88 2wan n GLY 474 Ca -0.16 -0.76 0.07 0.00 0.00 0.00 0.00 46.02 45.17 2wan n GLY 474 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 173.32 173.48 2wan h ILE 475 N 0.00 1.06 -0.28 -0.61 3.07 -1.85 -0.88 117.51 118.02 2wan h ILE 475 Ca 0.00 -0.27 -0.05 0.00 1.55 0.00 0.00 64.86 66.09 2wan h ILE 475 Cb 0.00 1.12 -0.02 0.00 -0.27 0.00 0.00 36.82 37.66 2wan h ILE 475 CO 0.00 0.08 -0.03 0.44 -1.05 0.00 0.00 178.15 177.59 2wan h ASP 476 N 0.02 0.40 -0.30 2.16 5.19 -1.81 0.31 116.42 122.38 2wan h ASP 476 Ca 0.01 -0.07 -0.10 0.00 -0.62 0.00 0.00 57.03 56.24 2wan h ASP 476 Cb 0.13 -0.10 -0.01 0.00 0.18 0.00 0.00 39.33 39.53 2wan h ASP 476 CO 0.01 0.48 -0.22 -1.28 -3.12 0.00 0.00 179.24 175.11 2wan h SER 477 N 0.41 0.72 -0.71 6.45 0.87 -0.97 -1.93 113.55 118.38 2wan h SER 477 Ca 0.09 -0.44 0.02 0.00 -1.23 0.00 0.00 61.79 60.22 2wan h SER 477 Cb 0.31 -0.20 -0.04 0.00 -0.44 0.00 0.00 62.40 62.04 2wan h SER 477 CO 0.01 1.00 0.47 -0.07 -0.53 0.00 0.00 176.83 177.71 2wan h LEU 478 N 0.44 0.79 -0.08 2.23 3.38 -0.94 -0.61 115.31 120.52 2wan h LEU 478 Ca 0.06 -0.01 0.03 0.00 0.09 0.00 0.00 57.88 58.05 2wan h LEU 478 Cb 0.77 -0.19 -0.04 0.00 0.09 0.00 0.00 40.66 41.29 2wan h LEU 478 CO 0.06 0.57 -0.13 0.11 0.09 0.00 0.00 178.44 179.13 2wan h LYS 479 N 0.94 -0.18 -0.95 1.13 1.79 -0.88 -2.40 116.57 116.02 2wan h LYS 479 Ca 0.27 0.01 0.05 0.00 -2.18 0.00 0.00 60.65 58.80 2wan h LYS 479 Cb -0.07 0.04 -0.06 0.00 -1.58 0.00 0.00 32.23 30.56 2wan h LYS 479 CO -0.07 -0.12 0.61 1.49 -1.08 0.00 0.00 179.45 180.28 2wan h GLU 480 N -0.18 1.12 -0.10 3.15 4.81 -0.90 -2.78 114.58 119.68 2wan h GLU 480 Ca 0.07 -0.07 -0.12 0.00 -0.13 0.00 0.00 59.36 59.12 2wan h GLU 480 Cb 0.29 -0.25 -0.01 0.00 0.63 0.00 0.00 28.75 29.40 2wan h GLU 480 CO -0.19 0.74 -0.46 1.25 -0.73 0.00 0.00 179.01 179.62 2wan h LEU 481 N 1.15 0.26 0.00 1.64 5.85 -0.88 -3.47 115.31 119.86 2wan h LEU 481 Ca 0.40 -0.12 0.00 0.00 0.84 0.00 0.00 57.88 59.00 2wan h LEU 481 Cb 0.09 -0.07 0.00 0.00 0.37 0.00 0.00 40.66 41.04 2wan h LEU 481 CO -0.15 0.69 0.00 0.61 -0.34 0.00 0.00 178.44 179.25 2wan n GLY 482 N -0.07 0.65 3.74 3.75 0.00 -0.93 -4.38 105.19 107.95 2wan n GLY 482 Ca -0.02 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.65 2wan n GLY 482 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2wan s ILE 483 N -2.45 2.44 -0.05 -0.61 -5.25 -1.25 -4.84 121.20 109.19 2wan s ILE 483 Ca 0.00 0.26 0.22 0.00 -0.99 0.00 0.00 60.65 60.13 2wan s ILE 483 Cb 0.00 -3.01 -0.33 0.00 2.95 0.00 0.00 42.46 42.08 2wan s ILE 483 CO 0.00 -0.08 0.45 0.35 -1.79 0.00 0.00 174.94 173.87 2wan n THR 484 N -2.00 0.15 -3.69 8.37 -2.24 -0.67 -4.90 114.28 109.29 2wan n THR 484 Ca 0.14 -0.54 -0.10 0.00 -2.27 0.00 0.00 64.05 61.28 2wan n THR 484 Cb 0.50 -0.05 -0.11 0.00 -2.10 0.00 0.00 70.33 68.56 2wan n THR 484 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 2wan s THR 485 N -3.41 -0.11 -0.19 4.28 2.01 -1.11 -0.91 115.64 116.19 2wan s THR 485 Ca -0.08 0.11 -0.15 0.00 0.31 0.00 0.00 61.69 61.88 2wan s THR 485 Cb 0.13 -0.60 -0.04 0.00 0.01 0.00 0.00 72.50 72.00 2wan s THR 485 CO 0.90 0.05 0.36 -0.69 -0.69 0.00 0.00 174.62 174.55 2wan s VAL 486 N 1.57 5.23 -0.37 3.82 1.01 0.30 -0.73 120.40 131.23 2wan s VAL 486 Ca -0.08 0.64 -0.15 0.00 0.00 0.00 0.00 61.98 62.38 2wan s VAL 486 Cb -0.09 -3.69 0.00 0.00 0.00 0.00 0.00 36.38 32.60 2wan s VAL 486 CO -0.12 0.29 0.36 -1.58 0.00 0.00 0.00 175.10 174.04 2wan s GLN 487 N 1.11 3.33 -0.01 2.72 0.74 -0.20 -0.82 119.66 126.53 2wan s GLN 487 Ca 0.18 -0.64 -0.25 0.00 0.05 0.00 0.00 55.36 54.69 2wan s GLN 487 Cb -0.14 -3.88 -0.04 0.00 1.10 0.00 0.00 33.01 30.05 2wan s GLN 487 CO 0.07 -0.64 0.78 -0.51 -0.55 0.00 0.00 175.29 174.43 2wan s LEU 488 N 1.95 4.38 0.96 3.68 1.43 -0.28 -0.92 118.68 129.89 2wan s LEU 488 Ca 0.10 1.38 -0.11 0.00 -1.03 0.00 0.00 54.13 54.47 2wan s LEU 488 Cb -0.17 -3.23 0.17 0.00 0.03 0.00 0.00 46.19 42.99 2wan s LEU 488 CO 0.12 -0.09 1.12 -1.10 0.23 0.00 0.00 176.35 176.63 2wan s GLN 489 N 0.50 0.64 -0.27 1.70 -0.21 -0.38 -1.39 119.66 120.25 2wan s GLN 489 Ca 0.40 1.41 -0.40 0.00 0.02 0.00 0.00 55.36 56.79 2wan s GLN 489 Cb -0.19 -1.69 -0.16 0.00 1.00 0.00 0.00 33.01 31.96 2wan s GLN 489 CO 0.22 -2.84 1.70 -2.30 -2.12 0.00 0.00 175.29 169.95 2wan n PRO 490 N -4.37 1.06 -0.04 2.91 -0.02 -1.25 -4.71 135.00 128.57 2wan n PRO 490 Ca 0.10 0.39 0.06 0.00 -2.02 0.00 0.00 63.50 62.03 2wan n PRO 490 Cb 0.52 -2.05 0.07 0.00 -0.02 0.00 0.00 33.50 32.02 2wan n PRO 490 CO 0.00 0.00 0.00 1.33 1.98 0.00 0.00 175.50 178.81 2wan n VAL 491 N 4.39 0.23 -2.62 -1.45 0.24 -1.26 -4.82 118.33 113.03 2wan n VAL 491 Ca 0.26 -0.61 -0.42 0.00 -2.04 0.00 0.00 64.34 61.53 2wan n VAL 491 Cb 0.12 1.07 -0.03 0.00 -1.47 0.00 0.00 33.84 33.53 2wan n VAL 491 CO 0.00 0.00 0.00 -1.61 -2.14 0.00 0.00 176.83 173.08 2wan s GLU 492 N -0.97 4.52 -0.36 7.34 2.02 -1.26 0.10 118.70 130.09 2wan s GLU 492 Ca 0.16 1.54 -0.45 0.00 0.02 0.00 0.00 54.97 56.24 2wan s GLU 492 Cb 0.10 -3.42 -0.20 0.00 0.10 0.00 0.00 34.13 30.71 2wan s GLU 492 CO 0.15 -0.11 1.44 -1.91 0.02 0.00 0.00 175.26 174.85 2wan n GLU 493 N 3.88 0.00 -4.53 1.61 4.07 0.50 -4.65 120.64 121.52 2wan n GLU 493 Ca 0.07 0.00 -0.25 0.00 -0.06 0.00 0.00 57.16 56.91 2wan n GLU 493 Cb 0.49 -1.49 -0.11 0.00 -0.06 0.00 0.00 31.44 30.28 2wan n GLU 493 CO 0.00 0.00 0.00 -0.59 -0.06 0.00 0.00 177.13 176.48 2wan s PHE 494 N 2.16 2.34 -0.22 4.31 -0.12 -1.26 -0.72 117.98 124.47 2wan s PHE 494 Ca 1.00 -0.55 0.20 0.00 -0.05 0.00 0.00 56.93 57.52 2wan s PHE 494 Cb -1.43 -1.38 0.01 0.00 -0.63 0.00 0.00 43.02 39.60 2wan s PHE 494 CO 0.75 0.52 1.11 -0.97 -0.05 0.00 0.00 175.22 176.57 2wan h ASN 495 N 2.04 0.00 1.10 1.98 -1.24 -1.52 -3.39 115.58 114.54 2wan h ASN 495 Ca -0.42 0.00 0.00 0.00 0.71 0.00 0.00 56.30 56.59 2wan h ASN 495 Cb 1.25 0.00 0.00 0.00 0.73 0.00 0.00 38.32 40.30 2wan h ASN 495 CO 0.71 0.26 0.00 0.77 -1.29 0.00 0.00 177.43 177.88 2wan h SER 496 N 0.00 0.00 -3.46 1.15 4.64 -1.98 -3.40 113.55 110.49 2wan h SER 496 Ca -0.05 0.00 -0.65 0.00 -0.47 0.00 0.00 61.79 60.62 2wan h SER 496 Cb 1.25 0.00 -0.24 0.00 -0.31 0.00 0.00 62.40 63.10 2wan h SER 496 CO 0.02 0.00 -0.67 -0.63 -0.87 0.00 0.00 176.83 174.68 2wan s ILE 497 N -3.30 3.85 -0.18 0.95 1.01 -1.26 -4.99 121.20 117.27 2wan s ILE 497 Ca 0.06 -0.34 -0.29 0.00 0.00 0.00 0.00 60.65 60.07 2wan s ILE 497 Cb 0.10 -2.75 -0.02 0.00 0.01 0.00 0.00 42.46 39.80 2wan s ILE 497 CO 0.50 0.41 1.33 -0.62 0.00 0.00 0.00 174.94 176.57 2wan s ASP 498 N 1.21 6.84 0.22 3.58 -1.08 -1.26 -4.91 116.67 121.26 2wan s ASP 498 Ca 0.03 1.68 0.18 0.00 -0.52 0.00 0.00 52.55 53.92 2wan s ASP 498 Cb -0.15 -2.54 0.88 0.00 -1.46 0.00 0.00 42.92 39.66 2wan s ASP 498 CO 0.01 -0.86 1.56 -0.62 0.52 0.00 0.00 175.17 175.78 2wan n GLU 499 N 6.84 0.12 0.02 4.34 1.02 -1.26 -0.34 120.64 131.38 2wan n GLU 499 Ca 0.15 0.50 0.13 0.00 -0.02 0.00 0.00 57.16 57.92 2wan n GLU 499 Cb 0.45 -1.81 0.46 0.00 -0.02 0.00 0.00 31.44 30.51 2wan n GLU 499 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 2wan n THR 500 N -2.06 0.09 -3.23 2.62 -2.24 -1.26 -4.09 114.28 104.11 2wan n THR 500 Ca 0.01 -0.05 -0.25 0.00 -2.27 0.00 0.00 64.05 61.49 2wan n THR 500 Cb 0.11 -0.27 -0.06 0.00 -2.10 0.00 0.00 70.33 68.01 2wan n THR 500 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2wan n GLN 501 N -1.63 1.87 0.00 -0.78 1.13 0.54 -4.99 117.38 113.52 2wan n GLN 501 Ca 0.06 -4.07 0.11 0.00 -1.94 0.00 0.00 57.00 51.17 2wan n GLN 501 Cb 0.36 -1.85 0.66 0.00 0.11 0.00 0.00 30.24 29.52 2wan n GLN 501 CO 0.00 0.00 0.00 -0.35 -1.44 0.00 0.00 177.06 175.27 2wan n PRO 502 N 0.73 0.80 -0.35 -1.09 -0.04 -1.22 -2.81 135.00 131.02 2wan n PRO 502 Ca 0.27 0.00 0.12 0.00 -0.04 0.00 0.00 63.50 63.84 2wan n PRO 502 Cb 0.48 -1.43 0.31 0.00 -0.04 0.00 0.00 33.50 32.82 2wan n PRO 502 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 2wan n ASP 503 N -0.93 3.91 -4.78 3.54 8.00 -1.26 -4.86 116.55 120.16 2wan n ASP 503 Ca 0.17 -2.00 -0.32 0.00 0.71 0.00 0.00 54.79 53.35 2wan n ASP 503 Cb 0.08 -0.46 0.07 0.00 -0.02 0.00 0.00 41.12 40.78 2wan n ASP 503 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 2wan s THR 504 N -1.06 3.42 -0.18 -3.53 -4.23 -1.12 -5.02 115.64 103.91 2wan s THR 504 Ca 0.48 0.54 -0.06 0.00 -1.18 0.00 0.00 61.69 61.46 2wan s THR 504 Cb 0.25 -3.07 -0.04 0.00 1.34 0.00 0.00 72.50 70.99 2wan s THR 504 CO 0.33 -0.53 0.04 -0.47 -0.54 0.00 0.00 174.62 173.45 2wan s TYR 505 N -2.70 3.17 -0.09 3.99 6.14 -1.26 -5.02 117.35 121.58 2wan s TYR 505 Ca 0.63 -0.08 -0.19 0.00 0.64 0.00 0.00 57.07 58.06 2wan s TYR 505 Cb -0.18 -2.07 0.04 0.00 0.42 0.00 0.00 41.96 40.18 2wan s TYR 505 CO 0.50 0.04 0.46 1.21 0.64 0.00 0.00 175.55 178.40 2wan s ASN 506 N 0.53 -0.42 0.35 4.32 3.84 -1.26 -4.55 114.94 117.74 2wan s ASN 506 Ca 0.01 0.59 0.03 0.00 0.21 0.00 0.00 52.86 53.70 2wan s ASN 506 Cb -0.13 0.64 0.63 0.00 -0.55 0.00 0.00 41.25 41.84 2wan s ASN 506 CO 0.01 -0.37 1.95 -0.50 -2.79 0.00 0.00 177.10 175.40 2wan h TRP 507 N 4.30 0.67 0.00 0.43 6.55 -1.50 -3.48 115.95 122.92 2wan h TRP 507 Ca -0.28 -0.02 0.00 0.00 0.95 0.00 0.00 58.89 59.54 2wan h TRP 507 Cb 1.17 -0.21 0.00 0.00 -0.86 0.00 0.00 29.16 29.26 2wan h TRP 507 CO 0.44 0.51 0.00 0.41 -1.05 0.00 0.00 178.44 178.75 2wan n GLY 508 N -1.17 1.44 0.99 1.49 0.00 -1.26 -3.92 105.19 102.76 2wan n GLY 508 Ca 0.04 -0.05 0.00 0.00 0.00 0.00 0.00 46.02 46.01 2wan n GLY 508 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2wan n TYR 509 N -1.60 0.65 -3.27 1.61 4.01 -1.26 -4.31 117.16 112.99 2wan n TYR 509 Ca 0.00 -0.34 -0.27 0.00 -0.16 0.00 0.00 57.90 57.14 2wan n TYR 509 Cb 0.01 -0.26 -0.07 0.00 -0.31 0.00 0.00 39.34 38.71 2wan n TYR 509 CO 0.00 0.00 0.00 -0.40 -0.46 0.00 0.00 176.86 176.00 2wan n ASP 510 N 0.15 3.86 -4.75 7.72 5.75 -1.26 -4.89 116.55 123.13 2wan n ASP 510 Ca 0.10 -3.49 -0.38 0.00 -0.01 0.00 0.00 54.79 51.01 2wan n ASP 510 Cb 0.58 -0.64 0.03 0.00 -1.03 0.00 0.00 41.12 40.07 2wan n ASP 510 CO 0.00 0.00 0.00 -2.16 -0.11 0.00 0.00 177.20 174.93 2wan s PRO 511 N -2.74 3.21 0.00 0.11 0.04 -1.26 -1.39 135.00 132.98 2wan s PRO 511 Ca 0.42 2.04 0.00 0.00 0.04 0.00 0.00 61.00 63.51 2wan s PRO 511 Cb 0.19 -2.20 0.00 0.00 0.04 0.00 0.00 34.50 32.53 2wan s PRO 511 CO -0.05 -1.07 0.00 -2.13 0.04 0.00 0.00 177.00 173.79 2wan n ARG 512 N -1.06 0.00 -3.92 4.56 0.63 0.10 -1.44 116.66 115.52 2wan n ARG 512 Ca 0.11 0.00 -0.30 0.00 -0.92 0.00 0.00 57.85 56.73 2wan n ARG 512 Cb 0.47 -0.46 -0.14 0.00 0.45 0.00 0.00 32.46 32.78 2wan n ARG 512 CO 0.00 0.00 0.00 -0.80 -2.51 0.00 0.00 177.63 174.32 2wan s ASN 513 N -4.55 4.34 0.57 6.15 0.01 -0.80 -4.93 114.94 115.74 2wan s ASN 513 Ca 0.00 -2.55 0.32 0.00 -0.71 0.00 0.00 52.86 49.92 2wan s ASN 513 Cb 0.00 -1.48 1.73 0.00 0.41 0.00 0.00 41.25 41.92 2wan s ASN 513 CO 0.00 -0.30 2.18 1.88 -1.51 0.00 0.00 177.10 179.34 2wan h TYR 514 N 7.05 0.00 -0.31 2.20 0.05 -1.82 -2.87 116.97 121.27 2wan h TYR 514 Ca -0.06 0.00 -0.02 0.00 0.05 0.00 0.00 58.73 58.70 2wan h TYR 514 Cb 0.95 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.68 2wan h TYR 514 CO 0.48 0.05 0.01 0.09 -1.05 0.00 0.00 178.16 177.74 2wan n ASN 515 N -3.57 4.02 -4.12 3.88 3.02 -1.26 -4.78 115.26 112.45 2wan n ASN 515 Ca -0.02 -3.07 -0.26 0.00 -0.03 0.00 0.00 54.58 51.21 2wan n ASN 515 Cb 0.17 -0.57 -0.16 0.00 -0.61 0.00 0.00 39.78 38.60 2wan n ASN 515 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2wan s VAL 516 N -2.86 1.36 0.37 2.41 1.01 -1.09 -4.48 120.40 117.12 2wan s VAL 516 Ca 0.44 -0.67 -0.27 0.00 0.00 0.00 0.00 61.98 61.48 2wan s VAL 516 Cb 0.36 -1.18 -0.09 0.00 0.00 0.00 0.00 36.38 35.47 2wan s VAL 516 CO 0.09 0.40 1.27 -2.84 0.00 0.00 0.00 175.10 174.02 2wan s PRO 517 N 0.09 4.14 0.08 2.72 0.02 -1.26 -0.37 135.00 140.42 2wan s PRO 517 Ca -0.05 2.10 -0.34 0.00 0.02 0.00 0.00 61.00 62.73 2wan s PRO 517 Cb -0.12 -2.86 -0.14 0.00 0.02 0.00 0.00 34.50 31.40 2wan s PRO 517 CO 0.02 -0.33 1.64 -1.91 -0.33 0.00 0.00 177.00 176.10 2wan n GLU 518 N 0.39 2.05 0.08 5.54 4.07 0.12 -4.49 120.64 128.39 2wan n GLU 518 Ca 0.02 0.74 -0.05 0.00 -0.06 0.00 0.00 57.16 57.82 2wan n GLU 518 Cb 0.44 -2.52 0.14 0.00 -0.06 0.00 0.00 31.44 29.43 2wan n GLU 518 CO 0.00 0.00 0.00 0.78 -0.06 0.00 0.00 177.13 177.85 2wan h GLY 519 N 6.70 0.31 1.98 8.31 0.00 -1.92 -3.20 103.07 115.24 2wan h GLY 519 Ca -0.46 -0.35 0.00 0.00 0.00 0.00 0.00 47.33 46.52 2wan h GLY 519 CO 0.90 0.32 0.01 0.00 0.00 0.00 0.00 176.54 177.76 2wan h ALA 520 N 1.21 1.67 -0.02 3.60 0.00 -1.90 -0.75 119.26 123.08 2wan h ALA 520 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2wan h ALA 520 Cb 1.03 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.82 2wan h ALA 520 CO 0.09 -0.01 -0.07 0.66 0.00 0.00 0.00 179.25 179.91 2wan n TYR 521 N -4.04 0.00 -3.07 0.00 4.01 -1.21 -4.88 117.16 107.97 2wan n TYR 521 Ca -0.03 0.00 -0.26 0.00 -0.16 0.00 0.00 57.90 57.45 2wan n TYR 521 Cb 0.09 -0.02 -0.01 0.00 -0.31 0.00 0.00 39.34 39.09 2wan n TYR 521 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2wan s ALA 522 N -2.12 3.56 0.33 -0.72 0.00 -0.29 -0.86 121.76 121.66 2wan s ALA 522 Ca 0.33 -0.69 0.33 0.00 0.00 0.00 0.00 51.96 51.93 2wan s ALA 522 Cb 0.20 -2.34 1.57 0.00 0.00 0.00 0.00 23.12 22.55 2wan s ALA 522 CO 0.38 -0.12 2.08 1.79 0.00 0.00 0.00 175.76 179.89 2wan h THR 523 N 0.63 0.25 -2.83 0.00 1.35 -1.90 -3.43 112.91 106.99 2wan h THR 523 Ca -0.48 -0.49 -0.12 0.00 -0.55 0.00 0.00 66.41 64.78 2wan h THR 523 Cb 1.21 1.38 -0.22 0.00 -1.73 0.00 0.00 68.15 68.79 2wan h THR 523 CO 0.62 0.07 -0.22 0.28 -0.25 0.00 0.00 175.52 176.01 2wan s THR 524 N -3.94 0.03 -1.54 6.82 -1.32 -1.26 -5.03 115.64 109.40 2wan s THR 524 Ca -0.02 -0.23 0.30 0.00 -1.21 0.00 0.00 61.69 60.53 2wan s THR 524 Cb 0.11 -0.62 0.51 0.00 -1.51 0.00 0.00 72.50 70.99 2wan s THR 524 CO 0.54 -0.13 1.98 -0.81 -2.21 0.00 0.00 174.62 173.99 2wan n PRO 525 N 1.93 0.55 -2.26 7.08 -0.04 -1.26 -4.33 135.00 136.66 2wan n PRO 525 Ca -0.18 -0.09 -0.42 0.00 -0.04 0.00 0.00 63.50 62.78 2wan n PRO 525 Cb 0.57 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 32.50 2wan n PRO 525 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 2wan s GLU 526 N -2.51 4.39 6.52 0.54 0.41 -1.26 -4.55 118.70 122.24 2wan s GLU 526 Ca 0.29 1.98 0.00 0.00 -0.41 0.00 0.00 54.97 56.83 2wan s GLU 526 Cb 0.20 -3.25 0.00 0.00 -1.78 0.00 0.00 34.13 29.30 2wan s GLU 526 CO 0.47 -0.30 0.00 0.41 -0.49 0.00 0.00 175.26 175.35 2wan n GLY 527 N 2.92 3.13 1.19 -1.39 0.00 -1.26 -3.59 105.19 106.19 2wan n GLY 527 Ca 0.08 -0.30 0.11 0.00 0.00 0.00 0.00 46.02 45.92 2wan n GLY 527 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2wan n THR 528 N 0.00 0.74 -0.27 2.61 -2.24 -1.26 -4.38 114.28 109.48 2wan n THR 528 Ca 0.00 -0.87 0.09 0.00 -2.27 0.00 0.00 64.05 61.00 2wan n THR 528 Cb 0.00 0.75 0.33 0.00 -2.10 0.00 0.00 70.33 69.31 2wan n THR 528 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2wan h ALA 529 N 4.17 1.70 -0.24 6.98 0.00 -1.85 -1.06 119.26 128.96 2wan h ALA 529 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 2wan h ALA 529 Cb 0.96 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.56 2wan h ALA 529 CO 0.00 0.10 0.09 0.07 0.00 0.00 0.00 179.25 179.51 2wan h ARG 530 N 0.81 0.34 0.15 0.00 0.11 -1.76 -0.21 114.38 113.81 2wan h ARG 530 Ca 0.42 -0.04 -0.01 0.00 0.10 0.00 0.00 59.98 60.45 2wan h ARG 530 Cb 0.50 -0.07 0.00 0.00 1.11 0.00 0.00 29.97 31.51 2wan h ARG 530 CO -0.18 0.29 -0.07 0.82 0.10 0.00 0.00 179.97 180.92 2wan h ILE 531 N 0.34 0.93 -0.81 0.08 2.04 -1.52 -2.80 117.51 115.77 2wan h ILE 531 Ca 0.09 -1.12 0.02 0.00 1.00 0.00 0.00 64.86 64.85 2wan h ILE 531 Cb 0.08 1.54 -0.05 0.00 -0.74 0.00 0.00 36.82 37.65 2wan h ILE 531 CO -0.01 0.23 0.53 0.74 0.00 0.00 0.00 178.15 179.64 2wan h THR 532 N -0.81 1.16 -0.23 -0.27 2.02 -1.26 -1.70 112.91 111.82 2wan h THR 532 Ca -0.02 -0.36 -0.15 0.00 0.77 0.00 0.00 66.41 66.65 2wan h THR 532 Cb 0.53 0.02 -0.01 0.00 -1.74 0.00 0.00 68.15 66.96 2wan h THR 532 CO 0.03 0.19 -0.48 -0.33 0.37 0.00 0.00 175.52 175.31 2wan h GLU 533 N 1.05 0.60 -0.41 6.66 5.08 -1.12 0.36 114.58 126.80 2wan h GLU 533 Ca 0.31 -0.34 -0.15 0.00 -1.00 0.00 0.00 59.36 58.18 2wan h GLU 533 Cb -0.05 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.22 2wan h GLU 533 CO -0.09 0.95 -0.33 1.25 -1.00 0.00 0.00 179.01 179.79 2wan h LEU 534 N 0.48 0.98 -1.14 1.33 5.85 -1.34 -1.29 115.31 120.19 2wan h LEU 534 Ca 0.03 -0.42 0.03 0.00 0.84 0.00 0.00 57.88 58.35 2wan h LEU 534 Cb 1.01 -0.27 -0.05 0.00 0.37 0.00 0.00 40.66 41.72 2wan h LEU 534 CO 0.09 1.21 0.59 0.11 -0.34 0.00 0.00 178.44 180.10 2wan h LYS 535 N 0.78 1.11 -0.53 1.25 1.57 -1.02 -1.67 116.57 118.06 2wan h LYS 535 Ca 0.08 -0.07 -0.08 0.00 -1.87 0.00 0.00 60.65 58.71 2wan h LYS 535 Cb 0.91 -0.25 -0.02 0.00 0.08 0.00 0.00 32.23 32.95 2wan h LYS 535 CO 0.08 0.74 0.01 1.96 -0.57 0.00 0.00 179.45 181.67 2wan h GLN 536 N 1.15 0.90 -0.00 3.15 4.20 -0.49 0.18 115.11 124.19 2wan h GLN 536 Ca 0.34 -0.25 0.02 0.00 0.06 0.00 0.00 58.65 58.82 2wan h GLN 536 Cb -0.04 -0.10 -0.03 0.00 0.30 0.00 0.00 27.48 27.61 2wan h GLN 536 CO -0.09 0.89 -0.13 1.25 -0.67 0.00 0.00 178.83 180.07 2wan h LEU 537 N 0.83 -0.38 -0.37 1.46 6.46 -0.68 -0.61 115.31 122.02 2wan h LEU 537 Ca 0.16 0.06 -0.01 0.00 -0.12 0.00 0.00 57.88 57.96 2wan h LEU 537 Cb 0.48 0.16 -0.02 0.00 -0.73 0.00 0.00 40.66 40.56 2wan h LEU 537 CO 0.02 -0.19 0.19 0.40 -0.62 0.00 0.00 178.44 178.24 2wan h ILE 538 N -0.22 1.16 -0.64 4.05 2.04 -1.02 -1.79 117.51 121.09 2wan h ILE 538 Ca 0.05 -0.45 0.07 0.00 1.00 0.00 0.00 64.86 65.53 2wan h ILE 538 Cb 0.28 0.78 -0.06 0.00 -0.74 0.00 0.00 36.82 37.08 2wan h ILE 538 CO -0.13 0.17 0.32 -0.61 0.00 0.00 0.00 178.15 177.90 2wan h GLN 539 N 0.46 0.57 -0.35 2.37 4.15 -0.53 -0.85 115.11 120.93 2wan h GLN 539 Ca 0.13 -0.03 -0.05 0.00 0.77 0.00 0.00 58.65 59.47 2wan h GLN 539 Cb 0.10 -0.13 -0.01 0.00 0.21 0.00 0.00 27.48 27.65 2wan h GLN 539 CO -0.02 0.38 0.04 0.77 -1.93 0.00 0.00 178.83 178.07 2wan h SER 540 N 0.59 0.57 -0.47 -0.69 0.02 -0.79 -1.24 113.55 111.53 2wan h SER 540 Ca 0.30 -0.28 -0.04 0.00 -0.84 0.00 0.00 61.79 60.93 2wan h SER 540 Cb 0.25 -0.15 -0.02 0.00 0.14 0.00 0.00 62.40 62.62 2wan h SER 540 CO -0.22 0.70 0.13 -0.07 -1.14 0.00 0.00 176.83 176.23 2wan h LEU 541 N 0.41 0.70 -1.03 5.07 3.38 -1.13 -2.73 115.31 119.98 2wan h LEU 541 Ca 0.10 -0.22 0.03 0.00 0.09 0.00 0.00 57.88 57.88 2wan h LEU 541 Cb 0.39 -0.18 -0.06 0.00 0.09 0.00 0.00 40.66 40.90 2wan h LEU 541 CO 0.01 0.74 0.65 0.45 0.09 0.00 0.00 178.44 180.38 2wan h HIS 542 N 0.63 1.22 0.00 1.13 3.86 -0.96 -0.09 115.15 120.93 2wan h HIS 542 Ca 0.15 0.03 -0.00 0.00 -1.16 0.00 0.00 60.37 59.39 2wan h HIS 542 Cb 0.30 -0.41 -0.00 0.00 1.06 0.00 0.00 27.41 28.36 2wan h HIS 542 CO 0.02 0.71 -0.02 1.96 0.86 0.00 0.00 177.93 181.47 2wan h GLN 543 N 1.27 0.00 -0.65 2.45 4.20 -0.92 0.19 115.11 121.65 2wan h GLN 543 Ca 0.39 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.10 2wan h GLN 543 Cb -0.02 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.76 2wan h GLN 543 CO -0.12 0.02 0.00 1.04 -0.67 0.00 0.00 178.83 179.10 2wan n GLN 544 N -3.60 4.01 -3.22 1.46 1.13 -0.21 -4.94 117.38 112.01 2wan n GLN 544 Ca -0.03 -2.97 -0.23 0.00 -1.94 0.00 0.00 57.00 51.83 2wan n GLN 544 Cb 0.10 -1.98 0.05 0.00 0.11 0.00 0.00 30.24 28.51 2wan n GLN 544 CO 0.00 0.00 0.00 0.54 -1.44 0.00 0.00 177.06 176.16 2wan n ARG 545 N 1.07 -5.71 -4.83 -1.09 1.74 0.05 -5.00 116.66 102.90 2wan n ARG 545 Ca 0.27 0.86 -0.33 0.00 -0.77 0.00 0.00 57.85 57.88 2wan n ARG 545 Cb 0.96 -5.77 -0.15 0.00 -1.02 0.00 0.00 32.46 26.48 2wan n ARG 545 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 2wan s ILE 546 N -3.21 2.75 0.66 0.55 1.01 -0.27 -4.87 121.20 117.82 2wan s ILE 546 Ca 0.40 -0.76 -0.06 0.00 0.00 0.00 0.00 60.65 60.22 2wan s ILE 546 Cb -0.18 -2.14 0.04 0.00 0.01 0.00 0.00 42.46 40.20 2wan s ILE 546 CO 0.49 0.53 0.97 -0.83 0.00 0.00 0.00 174.94 176.11 2wan s GLY 547 N 0.44 1.66 -0.13 6.18 0.00 -0.09 -2.75 107.32 112.63 2wan s GLY 547 Ca -0.12 -0.84 -0.00 0.00 0.00 0.00 0.00 44.72 43.76 2wan s GLY 547 CO 0.05 -0.48 -0.09 0.14 0.00 0.00 0.00 173.10 172.72 2wan s VAL 548 N -3.15 1.20 -0.18 1.40 1.01 -1.26 -0.54 120.40 118.87 2wan s VAL 548 Ca 0.58 -0.42 -0.06 0.00 0.00 0.00 0.00 61.98 62.08 2wan s VAL 548 Cb -0.11 -1.20 -0.03 0.00 0.00 0.00 0.00 36.38 35.04 2wan s VAL 548 CO 0.45 0.37 0.02 0.20 0.00 0.00 0.00 175.10 176.14 2wan s ASN 549 N 1.64 5.20 -0.16 3.32 0.01 0.00 -0.80 114.94 124.15 2wan s ASN 549 Ca 0.05 -0.05 -0.19 0.00 -0.71 0.00 0.00 52.86 51.95 2wan s ASN 549 Cb -0.13 -1.88 -0.03 0.00 0.41 0.00 0.00 41.25 39.62 2wan s ASN 549 CO -0.09 0.14 0.55 -0.04 -1.51 0.00 0.00 177.10 176.15 2wan s MET 550 N 0.57 4.27 -0.01 -0.60 -1.94 -0.57 -1.12 119.30 119.89 2wan s MET 550 Ca 0.01 0.52 -0.30 0.00 -1.71 0.00 0.00 55.69 54.20 2wan s MET 550 Cb -0.14 -3.52 -0.06 0.00 2.01 0.00 0.00 34.83 33.13 2wan s MET 550 CO 0.02 -0.06 1.64 0.34 -0.01 0.00 0.00 175.02 176.95 2wan s ASP 551 N 0.97 6.66 0.04 3.03 -1.08 -0.48 -1.09 116.67 124.72 2wan s ASP 551 Ca 0.27 2.30 0.05 0.00 -0.52 0.00 0.00 52.55 54.65 2wan s ASP 551 Cb -0.16 -2.54 -0.02 0.00 -1.46 0.00 0.00 42.92 38.74 2wan s ASP 551 CO 0.11 -0.90 -0.16 0.68 0.52 0.00 0.00 175.17 175.42 2wan s VAL 552 N 3.53 1.25 -0.55 1.11 -7.23 -0.26 -4.14 120.40 114.12 2wan s VAL 552 Ca 0.73 -1.04 0.06 0.00 -1.81 0.00 0.00 61.98 59.92 2wan s VAL 552 Cb -0.35 -1.12 0.34 0.00 0.56 0.00 0.00 36.38 35.82 2wan s VAL 552 CO 0.30 0.07 0.92 0.52 -0.31 0.00 0.00 175.10 176.60 2wan n VAL 553 N 1.91 2.61 0.58 1.32 0.31 -1.26 -1.63 118.33 122.17 2wan n VAL 553 Ca -0.18 -5.42 0.08 0.00 -0.01 0.00 0.00 64.34 58.82 2wan n VAL 553 Cb 0.54 -1.23 0.36 0.00 -0.91 0.00 0.00 33.84 32.61 2wan n VAL 553 CO 0.00 0.00 0.00 -1.22 -1.32 0.00 0.00 176.83 174.29 2wan n TYR 554 N -0.18 0.01 0.47 3.52 4.01 -1.26 -3.81 117.16 119.92 2wan n TYR 554 Ca 0.30 0.00 0.13 0.00 -0.16 0.00 0.00 57.90 58.18 2wan n TYR 554 Cb 0.44 -0.51 0.38 0.00 -0.31 0.00 0.00 39.34 39.34 2wan n TYR 554 CO 0.00 0.00 0.00 -2.95 -0.46 0.00 0.00 176.86 173.45 2wan h ASN 555 N 0.00 0.00 -4.92 7.72 7.08 -1.88 -3.41 115.58 120.17 2wan h ASN 555 Ca 0.00 0.00 0.03 0.00 -3.08 0.00 0.00 56.30 53.25 2wan h ASN 555 Cb 0.29 0.00 -0.12 0.00 -2.08 0.00 0.00 38.32 36.41 2wan h ASN 555 CO 0.00 0.00 0.30 -1.38 -2.08 0.00 0.00 177.43 174.27 2wan s HIS 556 N -3.20 -0.44 0.38 4.14 -3.43 -1.25 -0.58 115.29 110.91 2wan s HIS 556 Ca 0.08 0.22 0.08 0.00 -0.80 0.00 0.00 55.06 54.64 2wan s HIS 556 Cb 0.10 0.57 -0.04 0.00 -1.43 0.00 0.00 32.58 31.78 2wan s HIS 556 CO 0.58 -0.80 0.22 0.95 -2.00 0.00 0.00 174.74 173.69 2wan s THR 557 N -3.57 2.78 0.40 -5.38 -4.23 -1.26 -4.57 115.64 99.81 2wan s THR 557 Ca 0.03 -1.59 0.13 0.00 -1.18 0.00 0.00 61.69 59.09 2wan s THR 557 Cb -0.01 -3.01 0.34 0.00 1.34 0.00 0.00 72.50 71.17 2wan s THR 557 CO -0.10 -0.09 1.89 2.19 -0.54 0.00 0.00 174.62 177.98 2wan h PHE 558 N 1.37 0.62 -2.91 3.99 -0.00 -1.43 -3.45 116.94 115.13 2wan h PHE 558 Ca -0.43 0.02 0.04 0.00 -0.00 0.00 0.00 57.97 57.60 2wan h PHE 558 Cb 1.26 -0.19 -0.02 0.00 -0.00 0.00 0.00 35.95 36.99 2wan h PHE 558 CO 0.59 0.23 0.30 0.34 -0.00 0.00 0.00 178.31 179.77 2wan s ASP 559 N -5.85 -0.09 0.48 -0.68 -1.08 -1.26 -5.02 116.67 103.17 2wan s ASP 559 Ca -0.09 -0.89 0.05 0.00 -0.52 0.00 0.00 52.55 51.09 2wan s ASP 559 Cb 0.22 0.76 -0.02 0.00 -1.46 0.00 0.00 42.92 42.42 2wan s ASP 559 CO 0.78 -1.48 0.15 0.68 0.52 0.00 0.00 175.17 175.82 2wan s VAL 560 N -2.84 1.71 0.00 1.11 -7.23 -1.26 -4.42 120.40 107.46 2wan s VAL 560 Ca 0.14 -1.79 0.00 0.00 -1.81 0.00 0.00 61.98 58.53 2wan s VAL 560 Cb -0.05 -2.50 0.00 0.00 0.56 0.00 0.00 36.38 34.40 2wan s VAL 560 CO 0.09 0.00 0.00 0.23 -0.31 0.00 0.00 175.10 175.11 2wan n MET 561 N -1.34 0.00 0.00 4.82 2.81 -1.26 -4.13 117.12 118.01 2wan n MET 561 Ca -0.08 0.00 0.13 0.00 -1.81 0.00 0.00 57.70 55.94 2wan n MET 561 Cb 0.66 -0.06 0.29 0.00 -0.71 0.00 0.00 33.22 33.40 2wan n MET 561 CO 0.00 0.00 0.00 1.33 1.51 0.00 0.00 175.97 178.81 2wan n VAL 562 N 0.00 0.00 -2.55 2.03 0.24 -1.26 -4.44 118.33 112.34 2wan n VAL 562 Ca 0.00 -0.24 -0.35 0.00 -2.04 0.00 0.00 64.34 61.71 2wan n VAL 562 Cb 0.00 0.76 -0.04 0.00 -1.47 0.00 0.00 33.84 33.10 2wan n VAL 562 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 2wan s SER 563 N -2.30 6.49 0.30 -1.34 1.04 -1.26 -4.93 113.70 111.71 2wan s SER 563 Ca 0.27 1.96 0.04 0.00 0.48 0.00 0.00 55.95 58.70 2wan s SER 563 Cb 0.20 -2.57 0.63 0.00 0.10 0.00 0.00 66.02 64.38 2wan s SER 563 CO 0.45 -0.68 1.85 0.44 0.98 0.00 0.00 173.24 176.28 2wan h ASP 564 N 1.88 0.85 -0.32 7.02 3.32 -1.91 -2.01 116.42 125.25 2wan h ASP 564 Ca -0.49 0.05 0.07 0.00 0.02 0.00 0.00 57.03 56.67 2wan h ASP 564 Cb 1.22 -0.12 -0.06 0.00 0.22 0.00 0.00 39.33 40.58 2wan h ASP 564 CO 0.60 0.45 -0.10 -0.26 -1.72 0.00 0.00 179.24 178.21 2wan h PHE 565 N 0.91 -0.22 0.00 4.55 0.04 -1.92 -2.08 116.94 118.21 2wan h PHE 565 Ca 0.48 0.03 -0.08 0.00 2.80 0.00 0.00 57.97 61.20 2wan h PHE 565 Cb 0.55 0.15 -0.01 0.00 2.20 0.00 0.00 35.95 38.84 2wan h PHE 565 CO -0.00 -0.16 -0.37 -0.44 -0.60 0.00 0.00 178.31 176.73 2wan h ASP 566 N -0.03 0.00 1.63 2.17 3.32 -1.65 -0.88 116.42 120.97 2wan h ASP 566 Ca 0.16 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.21 2wan h ASP 566 Cb 0.27 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.82 2wan h ASP 566 CO -0.35 0.37 0.00 0.11 -1.72 0.00 0.00 179.24 177.65 2wan h LYS 567 N 0.00 0.00 0.00 3.56 1.57 -1.00 -3.19 116.57 117.51 2wan h LYS 567 Ca -0.00 0.00 -0.45 0.00 -1.87 0.00 0.00 60.65 58.33 2wan h LYS 567 Cb 1.01 0.00 -0.07 0.00 0.08 0.00 0.00 32.23 33.25 2wan h LYS 567 CO 0.05 0.00 -2.52 -0.89 -0.57 0.00 0.00 179.45 175.52 2wan n ILE 568 N -3.00 1.52 -3.56 1.86 5.41 -0.82 -4.82 119.36 115.95 2wan n ILE 568 Ca 0.03 -0.42 -0.29 0.00 1.00 0.00 0.00 62.75 63.07 2wan n ILE 568 Cb 0.45 -1.79 -0.12 0.00 -0.71 0.00 0.00 39.64 37.47 2wan n ILE 568 CO 0.00 0.00 0.00 -0.69 0.00 0.00 0.00 176.55 175.86 2wan s VAL 569 N -2.51 0.84 -0.29 1.39 1.01 -0.37 -4.79 120.40 115.69 2wan s VAL 569 Ca -0.38 -2.46 -0.42 0.00 0.00 0.00 0.00 61.98 58.73 2wan s VAL 569 Cb 0.14 -1.59 -0.17 0.00 0.00 0.00 0.00 36.38 34.76 2wan s VAL 569 CO 0.51 -1.03 1.65 -2.65 0.00 0.00 0.00 175.10 173.58 2wan n PRO 570 N 3.38 0.82 0.00 2.72 -0.02 -1.20 -2.19 135.00 138.50 2wan n PRO 570 Ca 0.16 0.30 0.00 0.00 -2.02 0.00 0.00 63.50 61.94 2wan n PRO 570 Cb 0.39 -1.93 0.00 0.00 -0.02 0.00 0.00 33.50 31.94 2wan n PRO 570 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 2wan n GLN 571 N 4.63 0.00 0.24 -0.52 6.02 -1.26 -4.82 117.38 121.67 2wan n GLN 571 Ca 0.27 0.00 0.09 0.00 -0.01 0.00 0.00 57.00 57.34 2wan n GLN 571 Cb 0.08 -2.01 0.61 0.00 1.02 0.00 0.00 30.24 29.95 2wan n GLN 571 CO 0.00 0.00 0.00 -0.92 -1.01 0.00 0.00 177.06 175.13 2wan h TYR 572 N 0.00 0.00 0.00 1.08 3.20 -1.78 -1.42 116.97 118.05 2wan h TYR 572 Ca 0.00 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.87 2wan h TYR 572 Cb 0.00 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.27 2wan h TYR 572 CO 0.00 0.15 0.00 0.66 -1.64 0.00 0.00 178.16 177.33 2wan n TYR 573 N -4.05 0.00 -4.43 -3.82 4.01 -1.26 -4.76 117.16 102.86 2wan n TYR 573 Ca -0.02 0.00 -0.22 0.00 -0.16 0.00 0.00 57.90 57.49 2wan n TYR 573 Cb 0.23 -0.21 -0.10 0.00 -0.31 0.00 0.00 39.34 38.95 2wan n TYR 573 CO 0.00 0.00 0.00 0.71 -0.46 0.00 0.00 176.86 177.11 2wan s TYR 574 N -2.42 2.10 -0.00 -0.72 2.02 -0.54 -0.54 117.35 117.25 2wan s TYR 574 Ca 0.31 -0.41 -0.24 0.00 -0.37 0.00 0.00 57.07 56.35 2wan s TYR 574 Cb 0.19 -0.94 -0.05 0.00 -0.40 0.00 0.00 41.96 40.77 2wan s TYR 574 CO 0.39 0.59 0.74 1.03 -1.57 0.00 0.00 175.55 176.73 2wan s ARG 575 N -3.48 4.46 0.14 -0.62 0.52 -0.10 -4.55 118.95 115.31 2wan s ARG 575 Ca 0.27 0.99 0.06 0.00 -0.52 0.00 0.00 55.73 56.53 2wan s ARG 575 Cb -0.04 -3.40 -0.04 0.00 0.52 0.00 0.00 34.95 32.00 2wan s ARG 575 CO 0.12 0.20 -0.14 0.95 0.02 0.00 0.00 175.30 176.45 2wan s THR 576 N 0.29 1.40 0.23 0.02 -4.23 -1.26 -1.55 115.64 110.54 2wan s THR 576 Ca 0.38 -1.84 0.01 0.00 -1.18 0.00 0.00 61.69 59.06 2wan s THR 576 Cb -0.19 -1.66 0.04 0.00 1.34 0.00 0.00 72.50 72.03 2wan s THR 576 CO 0.21 -0.47 0.32 -0.90 -0.54 0.00 0.00 174.62 173.24 2wan n ASP 577 N 0.31 0.52 0.09 3.99 5.68 -0.21 -4.86 116.55 122.07 2wan n ASP 577 Ca -0.14 -1.42 0.12 0.00 -0.50 0.00 0.00 54.79 52.86 2wan n ASP 577 Cb 0.58 -0.20 0.45 0.00 -1.14 0.00 0.00 41.12 40.81 2wan n ASP 577 CO 0.00 0.00 0.00 -1.20 -1.33 0.00 0.00 177.20 174.67 2wan n SER 578 N -2.92 0.60 0.04 -1.12 7.64 -1.26 -1.72 113.62 114.88 2wan n SER 578 Ca 0.06 0.59 0.13 0.00 1.01 0.00 0.00 58.87 60.66 2wan n SER 578 Cb 0.20 -0.74 0.48 0.00 -1.01 0.00 0.00 64.21 63.14 2wan n SER 578 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 2wan n ASN 579 N -2.09 0.38 0.00 6.43 3.02 -1.26 -4.57 115.26 117.17 2wan n ASN 579 Ca 0.04 0.43 0.00 0.00 -0.03 0.00 0.00 54.58 55.03 2wan n ASN 579 Cb 0.33 -0.49 0.00 0.00 -0.61 0.00 0.00 39.78 39.02 2wan n ASN 579 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2wan n GLY 580 N 1.42 0.68 3.89 7.41 0.00 -0.70 -4.68 105.19 113.22 2wan n GLY 580 Ca 0.06 -0.41 -0.33 0.00 0.00 0.00 0.00 46.02 45.34 2wan n GLY 580 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2wan s ASN 581 N -2.37 6.48 0.11 1.61 0.02 -1.26 -4.84 114.94 114.68 2wan s ASN 581 Ca 0.00 0.53 -0.31 0.00 -1.02 0.00 0.00 52.86 52.06 2wan s ASN 581 Cb 0.00 -2.07 -0.08 0.00 0.02 0.00 0.00 41.25 39.12 2wan s ASN 581 CO 0.00 0.18 1.44 -0.31 0.02 0.00 0.00 177.10 178.43 2wan s TYR 582 N -1.44 3.12 0.58 2.20 1.51 -1.26 -1.05 117.35 121.02 2wan s TYR 582 Ca 0.33 0.84 -0.13 0.00 -1.01 0.00 0.00 57.07 57.09 2wan s TYR 582 Cb -0.13 -3.75 -0.05 0.00 -0.11 0.00 0.00 41.96 37.92 2wan s TYR 582 CO 0.20 -2.68 1.02 0.95 -1.11 0.00 0.00 175.55 173.93 2wan s THR 583 N 1.33 4.52 -0.52 -0.71 -4.23 -0.59 -4.90 115.64 110.53 2wan s THR 583 Ca 0.66 1.00 0.03 0.00 -1.18 0.00 0.00 61.69 62.20 2wan s THR 583 Cb -0.38 -3.74 0.42 0.00 1.34 0.00 0.00 72.50 70.14 2wan s THR 583 CO 0.30 -0.90 1.47 -3.20 -0.54 0.00 0.00 174.62 171.75 2wan n ASN 584 N -2.27 5.84 -0.13 3.99 5.15 -1.23 -3.44 115.26 123.18 2wan n ASN 584 Ca 0.07 -3.76 0.14 0.00 -0.60 0.00 0.00 54.58 50.42 2wan n ASN 584 Cb 0.54 -0.64 0.51 0.00 -0.53 0.00 0.00 39.78 39.66 2wan n ASN 584 CO 0.00 0.00 0.00 1.23 1.40 0.00 0.00 177.26 179.89 2wan h GLY 585 N 2.48 0.62 1.45 8.20 0.00 -1.72 -2.06 103.07 112.04 2wan h GLY 585 Ca 0.42 -0.17 0.00 0.00 0.00 0.00 0.00 47.33 47.59 2wan h GLY 585 CO 1.07 0.08 -0.43 1.48 0.00 0.00 0.00 176.54 178.73 2wan h SER 586 N 0.40 0.00 -2.40 0.19 4.64 -1.85 0.95 113.55 115.47 2wan h SER 586 Ca 0.33 -0.12 -0.03 0.00 -0.47 0.00 0.00 61.79 61.50 2wan h SER 586 Cb 0.74 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 62.84 2wan h SER 586 CO -0.10 0.06 -0.07 0.61 -0.87 0.00 0.00 176.83 176.46 2wan n GLY 587 N 1.30 0.40 0.00 -0.77 0.00 -0.77 -4.17 105.19 101.18 2wan n GLY 587 Ca 0.04 -0.41 0.00 0.00 0.00 0.00 0.00 46.02 45.65 2wan n GLY 587 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wan n GLY 589 N -1.05 0.74 3.58 -0.02 0.00 -1.26 -5.01 105.19 102.16 2wan n GLY 589 Ca -0.02 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.90 2wan n GLY 589 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2wan s ASN 590 N -1.15 -0.30 -0.03 1.61 4.22 -1.25 -4.72 114.94 113.31 2wan s ASN 590 Ca 0.00 -0.45 -0.05 0.00 -2.14 0.00 0.00 52.86 50.21 2wan s ASN 590 Cb 0.00 0.61 0.01 0.00 1.28 0.00 0.00 41.25 43.15 2wan s ASN 590 CO 0.00 -1.10 0.13 -1.83 -2.04 0.00 0.00 177.10 172.26 2wan s GLU 591 N -3.87 0.25 0.08 3.55 -1.05 -1.22 -3.83 118.70 112.61 2wan s GLU 591 Ca 0.09 0.00 -0.30 0.00 -0.15 0.00 0.00 54.97 54.61 2wan s GLU 591 Cb -0.02 0.11 -0.06 0.00 -0.44 0.00 0.00 34.13 33.73 2wan s GLU 591 CO -0.02 -0.04 1.14 0.12 0.95 0.00 0.00 175.26 177.40 2wan s PHE 592 N -0.37 3.51 -1.25 4.83 2.19 0.25 -0.93 117.98 126.22 2wan s PHE 592 Ca -0.05 1.44 -0.14 0.00 0.33 0.00 0.00 56.93 58.52 2wan s PHE 592 Cb -0.03 -3.33 0.15 0.00 -1.31 0.00 0.00 43.02 38.49 2wan s PHE 592 CO 0.00 -0.89 1.58 0.00 1.83 0.00 0.00 175.22 177.74 2wan n ALA 593 N 3.55 4.07 0.31 11.12 0.00 0.30 -4.73 120.51 135.12 2wan n ALA 593 Ca 0.07 -4.17 0.12 0.00 0.00 0.00 0.00 53.44 49.46 2wan n ALA 593 Cb 0.47 -3.17 0.54 0.00 0.00 0.00 0.00 19.45 17.30 2wan n ALA 593 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2wan n THR 594 N 4.80 0.89 0.78 0.00 -2.24 -1.26 -1.47 114.28 115.78 2wan n THR 594 Ca 0.40 0.42 0.10 0.00 -2.27 0.00 0.00 64.05 62.70 2wan n THR 594 Cb 0.42 -1.39 0.45 0.00 -2.10 0.00 0.00 70.33 67.72 2wan n THR 594 CO 0.00 0.00 0.00 -1.84 -0.57 0.00 0.00 175.07 172.66 2wan n GLU 595 N -2.28 0.11 -3.22 -0.78 0.00 -1.26 -4.09 120.64 109.11 2wan n GLU 595 Ca 0.01 0.14 -0.40 0.00 0.00 0.00 0.00 57.16 56.90 2wan n GLU 595 Cb 0.16 -1.50 -0.08 0.00 0.00 0.00 0.00 31.44 30.02 2wan n GLU 595 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.13 176.12 2wan s HIS 596 N -2.84 3.23 0.25 -1.84 3.76 -0.54 -4.99 115.29 112.31 2wan s HIS 596 Ca 0.13 0.48 -0.05 0.00 -0.15 0.00 0.00 55.06 55.47 2wan s HIS 596 Cb 0.13 -2.83 0.50 0.00 1.11 0.00 0.00 32.58 31.49 2wan s HIS 596 CO 0.34 -0.39 1.65 -1.35 -0.85 0.00 0.00 174.74 174.14 2wan h PRO 597 N 8.19 0.16 0.00 8.40 0.11 -1.87 -0.08 132.00 146.92 2wan h PRO 597 Ca -0.28 -0.01 -0.09 0.00 0.11 0.00 0.00 66.00 65.73 2wan h PRO 597 Cb 1.13 -0.04 -0.01 0.00 0.11 0.00 0.00 31.00 32.19 2wan h PRO 597 CO 0.74 0.11 -0.43 0.52 -0.21 0.00 0.00 178.00 178.73 2wan h MET 598 N 0.17 0.00 -0.14 1.05 2.86 -1.93 0.11 114.93 117.05 2wan h MET 598 Ca 0.44 0.00 -0.09 0.00 -2.06 0.00 0.00 59.70 57.99 2wan h MET 598 Cb 0.79 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.45 2wan h MET 598 CO -0.62 0.43 -0.26 0.00 1.06 0.00 0.00 176.91 177.53 2wan h ALA 599 N 1.57 0.22 -0.55 6.32 0.00 -1.41 -1.76 119.26 123.65 2wan h ALA 599 Ca -0.00 -0.39 0.05 0.00 0.00 0.00 0.00 54.91 54.56 2wan h ALA 599 Cb 1.02 -0.04 -0.05 0.00 0.00 0.00 0.00 17.79 18.73 2wan h ALA 599 CO 0.06 0.20 0.29 0.37 0.00 0.00 0.00 179.25 180.16 2wan h GLN 600 N 0.02 0.54 -0.88 0.00 4.15 -0.85 -2.09 115.11 115.99 2wan h GLN 600 Ca 0.01 -0.03 0.05 0.00 0.77 0.00 0.00 58.65 59.44 2wan h GLN 600 Cb 0.84 -0.12 -0.05 0.00 0.21 0.00 0.00 27.48 28.36 2wan h GLN 600 CO 0.06 0.35 0.58 -0.22 -1.93 0.00 0.00 178.83 177.67 2wan h LYS 601 N 0.55 1.02 -0.59 1.69 3.64 -0.74 -0.81 116.57 121.34 2wan h LYS 601 Ca 0.24 -0.06 0.04 0.00 -1.27 0.00 0.00 60.65 59.60 2wan h LYS 601 Cb 0.14 -0.23 -0.04 0.00 -0.41 0.00 0.00 32.23 31.69 2wan h LYS 601 CO -0.16 0.68 0.34 0.35 -2.27 0.00 0.00 179.45 178.38 2wan h PHE 602 N 1.06 0.63 -0.13 1.91 3.57 -0.63 0.21 116.94 123.55 2wan h PHE 602 Ca 0.36 0.02 -0.03 0.00 3.53 0.00 0.00 57.97 61.86 2wan h PHE 602 Cb 0.11 -0.20 -0.00 0.00 2.79 0.00 0.00 35.95 38.64 2wan h PHE 602 CO -0.00 0.33 -0.02 0.28 -2.23 0.00 0.00 178.31 176.67 2wan h VAL 603 N 0.65 1.28 -0.46 1.41 2.07 -1.04 -1.44 116.25 118.72 2wan h VAL 603 Ca 0.25 -0.92 0.02 0.00 0.82 0.00 0.00 66.70 66.88 2wan h VAL 603 Cb 0.09 1.62 -0.03 0.00 -1.52 0.00 0.00 31.29 31.45 2wan h VAL 603 CO -0.13 0.27 0.27 -0.07 0.02 0.00 0.00 177.57 177.92 2wan h LEU 604 N -0.05 0.43 -0.94 2.57 3.38 -0.85 -1.26 115.31 118.60 2wan h LEU 604 Ca 0.04 0.01 0.01 0.00 0.09 0.00 0.00 57.88 58.02 2wan h LEU 604 Cb 0.42 -0.08 -0.05 0.00 0.09 0.00 0.00 40.66 41.04 2wan h LEU 604 CO 0.01 0.31 0.61 0.44 0.09 0.00 0.00 178.44 179.90 2wan h ASP 605 N 0.54 1.09 -0.01 -0.43 3.32 -0.58 -2.19 116.42 118.16 2wan h ASP 605 Ca 0.19 -0.04 -0.00 0.00 0.02 0.00 0.00 57.03 57.20 2wan h ASP 605 Cb 0.02 -0.27 -0.00 0.00 0.22 0.00 0.00 39.33 39.30 2wan h ASP 605 CO -0.09 0.80 0.00 -1.28 -1.72 0.00 0.00 179.24 176.95 2wan h SER 606 N 1.28 0.01 -0.15 6.45 0.87 -0.60 -0.86 113.55 120.55 2wan h SER 606 Ca 0.34 -0.18 -0.09 0.00 -1.23 0.00 0.00 61.79 60.64 2wan h SER 606 Cb -0.13 -0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 61.81 2wan h SER 606 CO -0.07 0.18 -0.18 -0.37 -0.53 0.00 0.00 176.83 175.86 2wan h VAL 607 N -0.16 1.25 -0.78 2.23 -1.51 -1.19 -0.97 116.25 115.12 2wan h VAL 607 Ca 0.00 -1.17 -0.01 0.00 -1.23 0.00 0.00 66.70 64.29 2wan h VAL 607 Cb 0.18 1.22 -0.04 0.00 -2.13 0.00 0.00 31.29 30.52 2wan h VAL 607 CO -0.00 0.38 0.46 0.78 -1.23 0.00 0.00 177.57 177.96 2wan h ASN 608 N 0.50 0.94 -0.22 4.19 2.35 -1.27 -2.10 115.58 119.97 2wan h ASN 608 Ca 0.08 -0.07 -0.02 0.00 -0.55 0.00 0.00 56.30 55.74 2wan h ASN 608 Cb 0.60 -0.24 -0.01 0.00 0.05 0.00 0.00 38.32 38.72 2wan h ASN 608 CO 0.04 0.74 0.08 0.22 -1.65 0.00 0.00 177.43 176.86 2wan h TYR 609 N 1.07 0.35 -0.81 1.19 3.20 -0.37 0.53 116.97 122.14 2wan h TYR 609 Ca 0.28 -0.03 -0.01 0.00 3.14 0.00 0.00 58.73 62.11 2wan h TYR 609 Cb -0.02 -0.10 -0.04 0.00 1.54 0.00 0.00 36.73 38.11 2wan h TYR 609 CO -0.01 0.40 0.47 -1.49 -1.64 0.00 0.00 178.16 175.90 2wan h TRP 610 N 0.20 1.08 -0.12 -3.82 4.06 -1.06 0.22 115.95 116.52 2wan h TRP 610 Ca 0.07 -0.01 -0.02 0.00 2.06 0.00 0.00 58.89 60.99 2wan h TRP 610 Cb 0.21 -0.35 -0.00 0.00 -1.00 0.00 0.00 29.16 28.01 2wan h TRP 610 CO -0.00 0.74 -0.00 0.28 -3.56 0.00 0.00 178.44 175.89 2wan h VAL 611 N 1.11 1.26 -0.23 1.49 2.07 -1.25 -1.88 116.25 118.83 2wan h VAL 611 Ca 0.29 -0.83 -0.07 0.00 0.82 0.00 0.00 66.70 66.91 2wan h VAL 611 Cb -0.01 1.58 -0.01 0.00 -1.52 0.00 0.00 31.29 31.33 2wan h VAL 611 CO -0.05 0.24 -0.12 0.78 0.02 0.00 0.00 177.57 178.44 2wan h ASN 612 N -0.07 0.50 0.28 0.57 2.35 -0.63 -1.24 115.58 117.34 2wan h ASN 612 Ca 0.03 -0.42 -0.34 0.00 -0.55 0.00 0.00 56.30 55.03 2wan h ASN 612 Cb 0.37 -0.14 0.02 0.00 0.05 0.00 0.00 38.32 38.62 2wan h ASN 612 CO 0.01 0.80 -1.59 -0.08 -1.65 0.00 0.00 177.43 174.92 2wan h GLU 613 N 0.19 0.43 -0.01 0.81 4.57 -0.67 -3.38 114.58 116.51 2wan h GLU 613 Ca 0.05 -0.73 0.00 0.00 -1.18 0.00 0.00 59.36 57.50 2wan h GLU 613 Cb 0.62 0.27 0.00 0.00 -0.16 0.00 0.00 28.75 29.48 2wan h GLU 613 CO 0.03 1.33 -0.49 0.66 -1.18 0.00 0.00 179.01 179.37 2wan n TYR 614 N -3.62 0.00 -2.68 0.92 4.01 -0.72 -5.00 117.16 110.08 2wan n TYR 614 Ca -0.20 0.00 -0.17 0.00 -0.16 0.00 0.00 57.90 57.37 2wan n TYR 614 Cb 1.08 0.00 0.02 0.00 -0.31 0.00 0.00 39.34 40.13 2wan n TYR 614 CO 0.00 0.00 0.00 0.72 -0.46 0.00 0.00 176.86 177.12 2wan n HIS 615 N -0.61 -1.29 -2.02 -0.72 8.25 -0.47 -4.94 115.22 113.42 2wan n HIS 615 Ca 0.05 0.28 -0.38 0.00 -0.26 0.00 0.00 57.72 57.40 2wan n HIS 615 Cb 0.30 -3.61 0.01 0.00 1.12 0.00 0.00 29.99 27.81 2wan n HIS 615 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 2wan s VAL 616 N -2.97 2.57 -1.91 1.59 1.01 -1.23 -4.90 120.40 114.56 2wan s VAL 616 Ca 0.16 0.46 0.20 0.00 0.00 0.00 0.00 61.98 62.80 2wan s VAL 616 Cb -0.07 -3.25 0.02 0.00 0.00 0.00 0.00 36.38 33.07 2wan s VAL 616 CO 0.20 0.03 1.01 0.47 0.00 0.00 0.00 175.10 176.81 2wan n ASP 617 N -0.40 1.98 0.00 3.32 8.00 0.02 -4.68 116.55 124.80 2wan n ASP 617 Ca 0.07 -1.49 0.00 0.00 0.71 0.00 0.00 54.79 54.07 2wan n ASP 617 Cb 0.45 0.41 0.00 0.00 -0.02 0.00 0.00 41.12 41.96 2wan n ASP 617 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2wan n GLY 618 N 1.29 -0.68 2.96 0.44 0.00 -1.19 -2.63 105.19 105.38 2wan n GLY 618 Ca 0.09 -1.10 -0.12 0.00 0.00 0.00 0.00 46.02 44.88 2wan n GLY 618 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2wan s PHE 619 N -2.00 -0.08 -0.35 1.61 0.08 -0.59 -1.51 117.98 115.15 2wan s PHE 619 Ca 0.00 0.20 -0.09 0.00 0.12 0.00 0.00 56.93 57.16 2wan s PHE 619 Cb 0.00 0.03 0.03 0.00 -0.57 0.00 0.00 43.02 42.50 2wan s PHE 619 CO 0.00 -0.05 0.15 0.50 -0.10 0.00 0.00 175.22 175.73 2wan s ARG 620 N -0.00 2.83 -0.53 0.44 3.00 -0.25 -1.69 118.95 122.75 2wan s ARG 620 Ca -0.00 -1.06 -0.23 0.00 -1.00 0.00 0.00 55.73 53.44 2wan s ARG 620 Cb -0.01 -3.59 0.04 0.00 0.00 0.00 0.00 34.95 31.40 2wan s ARG 620 CO 0.00 -0.64 0.86 -0.06 0.00 0.00 0.00 175.30 175.46 2wan s PHE 621 N 1.50 2.87 0.24 5.12 0.08 0.94 -1.11 117.98 127.63 2wan s PHE 621 Ca 0.01 -0.10 -0.31 0.00 0.12 0.00 0.00 56.93 56.65 2wan s PHE 621 Cb -0.19 -3.91 -0.14 0.00 -0.57 0.00 0.00 43.02 38.21 2wan s PHE 621 CO 0.05 -1.24 1.36 -3.47 -0.10 0.00 0.00 175.22 171.82 2wan n ASP 622 N 7.10 2.55 -4.12 1.36 2.03 -0.65 -2.30 116.55 122.53 2wan n ASP 622 Ca 0.00 1.15 -0.31 0.00 0.52 0.00 0.00 54.79 56.15 2wan n ASP 622 Cb 0.47 -1.40 -0.07 0.00 -0.72 0.00 0.00 41.12 39.40 2wan n ASP 622 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 2wan n LEU 623 N 2.02 -0.72 -0.07 -2.67 4.77 -1.26 -4.63 117.00 114.43 2wan n LEU 623 Ca 0.11 -1.16 0.17 0.00 -0.03 0.00 0.00 56.01 55.11 2wan n LEU 623 Cb 0.31 -1.43 0.59 0.00 -2.33 0.00 0.00 43.42 40.56 2wan n LEU 623 CO 0.62 0.48 1.19 -0.03 -1.33 0.00 0.00 177.39 178.33 2wan h MET 624 N -1.62 0.22 -0.92 3.23 4.05 -1.05 -1.54 114.93 117.31 2wan h MET 624 Ca -0.60 -0.01 0.21 0.00 -0.28 0.00 0.00 59.70 59.01 2wan h MET 624 Cb 1.26 -0.05 -0.12 0.00 -0.80 0.00 0.00 31.60 31.89 2wan h MET 624 CO 0.61 0.15 0.47 0.00 0.23 0.00 0.00 176.91 178.36 2wan h ALA 625 N 1.70 1.51 0.00 0.39 0.00 -1.56 0.45 119.26 121.75 2wan h ALA 625 Ca 0.30 0.13 -0.01 0.00 0.00 0.00 0.00 54.91 55.33 2wan h ALA 625 Cb 0.86 0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.71 2wan h ALA 625 CO -0.06 -0.26 -0.03 -0.07 0.00 0.00 0.00 179.25 178.83 2wan h LEU 626 N 0.51 0.00 -0.70 0.00 3.38 -1.51 -2.06 115.31 114.94 2wan h LEU 626 Ca 0.56 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 58.47 2wan h LEU 626 Cb 1.02 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.76 2wan h LEU 626 CO -0.47 0.03 -0.31 -0.07 0.09 0.00 0.00 178.44 177.71 2wan h LEU 627 N 0.00 0.00 0.00 1.67 3.38 -1.05 -3.45 115.31 115.86 2wan h LEU 627 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2wan h LEU 627 Cb 0.09 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.84 2wan h LEU 627 CO 0.00 0.31 0.00 0.61 0.09 0.00 0.00 178.44 179.46 2wan n GLY 628 N 0.53 -0.62 0.09 0.83 0.00 -1.05 -4.40 105.19 100.58 2wan n GLY 628 Ca 0.01 -1.49 -0.10 0.00 0.00 0.00 0.00 46.02 44.44 2wan n GLY 628 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2wan h LYS 629 N 0.00 0.13 -0.68 1.61 1.57 -1.21 -1.36 116.57 116.63 2wan h LYS 629 Ca 0.00 -0.01 0.01 0.00 -1.87 0.00 0.00 60.65 58.78 2wan h LYS 629 Cb 0.00 -0.03 -0.03 0.00 0.08 0.00 0.00 32.23 32.25 2wan h LYS 629 CO 0.00 0.09 0.45 -0.44 -0.57 0.00 0.00 179.45 178.98 2wan h ASP 630 N 0.14 0.78 -0.31 0.86 3.32 -1.88 -0.35 116.42 118.98 2wan h ASP 630 Ca 0.07 -0.02 -0.03 0.00 0.02 0.00 0.00 57.03 57.07 2wan h ASP 630 Cb 0.03 -0.19 -0.01 0.00 0.22 0.00 0.00 39.33 39.38 2wan h ASP 630 CO -0.06 0.56 0.09 0.74 -1.72 0.00 0.00 179.24 178.85 2wan h THR 631 N 0.92 1.21 -0.43 0.35 2.02 -1.73 -2.31 112.91 112.94 2wan h THR 631 Ca 0.25 -0.67 -0.07 0.00 0.77 0.00 0.00 66.41 66.68 2wan h THR 631 Cb -0.11 1.06 -0.02 0.00 -1.74 0.00 0.00 68.15 67.34 2wan h THR 631 CO -0.05 0.23 -0.04 0.24 0.37 0.00 0.00 175.52 176.26 2wan h MET 632 N 0.35 0.72 -0.78 6.66 2.86 -0.88 -0.22 114.93 123.63 2wan h MET 632 Ca 0.10 -0.20 0.01 0.00 -2.06 0.00 0.00 59.70 57.55 2wan h MET 632 Cb 0.26 -0.08 -0.04 0.00 0.06 0.00 0.00 31.60 31.80 2wan h MET 632 CO -0.00 0.76 0.51 0.00 1.06 0.00 0.00 176.91 179.24 2wan h ALA 633 N 1.29 0.99 -0.33 6.32 0.00 -1.00 -0.55 119.26 125.99 2wan h ALA 633 Ca 0.13 -0.06 -0.13 0.00 0.00 0.00 0.00 54.91 54.84 2wan h ALA 633 Cb 0.47 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 2wan h ALA 633 CO 0.02 0.42 -0.32 0.87 0.00 0.00 0.00 179.25 180.24 2wan h LYS 634 N 1.06 0.79 -0.03 0.00 1.57 -0.80 -0.28 116.57 118.89 2wan h LYS 634 Ca 0.29 -0.42 0.02 0.00 -1.87 0.00 0.00 60.65 58.67 2wan h LYS 634 Cb -0.11 0.01 -0.03 0.00 0.08 0.00 0.00 32.23 32.19 2wan h LYS 634 CO -0.06 1.05 -0.12 0.82 -0.57 0.00 0.00 179.45 180.57 2wan h ILE 635 N 0.57 0.69 -0.14 1.86 2.04 -0.94 -0.48 117.51 121.09 2wan h ILE 635 Ca 0.05 0.00 0.02 0.00 1.00 0.00 0.00 64.86 65.93 2wan h ILE 635 Cb 0.90 0.69 -0.02 0.00 -0.74 0.00 0.00 36.82 37.65 2wan h ILE 635 CO 0.08 0.00 0.03 -1.28 0.00 0.00 0.00 178.15 176.98 2wan h SER 636 N -0.20 0.01 -0.52 1.72 0.87 -1.01 -0.97 113.55 113.46 2wan h SER 636 Ca 0.05 0.02 -0.00 0.00 -1.23 0.00 0.00 61.79 60.63 2wan h SER 636 Cb 0.27 0.03 -0.02 0.00 -0.44 0.00 0.00 62.40 62.23 2wan h SER 636 CO -0.14 0.03 0.31 0.78 -0.53 0.00 0.00 176.83 177.28 2wan h ASN 637 N 0.09 0.62 -0.16 6.23 2.35 -0.91 0.53 115.58 124.33 2wan h ASN 637 Ca 0.06 -0.06 -0.02 0.00 -0.55 0.00 0.00 56.30 55.73 2wan h ASN 637 Cb 0.06 -0.16 -0.01 0.00 0.05 0.00 0.00 38.32 38.26 2wan h ASN 637 CO -0.08 0.50 0.01 -0.33 -1.65 0.00 0.00 177.43 175.87 2wan h GLU 638 N 0.69 0.28 -0.26 0.81 5.08 -0.95 -2.17 114.58 118.06 2wan h GLU 638 Ca 0.18 -0.08 -0.14 0.00 -1.00 0.00 0.00 59.36 58.32 2wan h GLU 638 Cb -0.01 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.20 2wan h GLU 638 CO -0.03 0.48 -0.41 -0.07 -1.00 0.00 0.00 179.01 177.98 2wan h LEU 639 N 0.04 0.66 -1.16 1.33 3.38 -1.09 -2.89 115.31 115.59 2wan h LEU 639 Ca 0.05 -0.30 -0.05 0.00 0.09 0.00 0.00 57.88 57.67 2wan h LEU 639 Cb 0.35 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.90 2wan h LEU 639 CO 0.01 0.99 -0.22 0.45 0.09 0.00 0.00 178.44 179.75 2wan h HIS 640 N 0.51 0.00 -0.13 1.13 3.86 -0.89 -1.11 115.15 118.53 2wan h HIS 640 Ca 0.04 0.00 -0.07 0.00 -1.16 0.00 0.00 60.37 59.18 2wan h HIS 640 Cb 0.92 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 29.38 2wan h HIS 640 CO 0.04 0.22 -0.23 0.00 0.86 0.00 0.00 177.93 178.83 2wan h ALA 641 N 1.78 1.38 -0.01 2.45 0.00 -1.18 -2.51 119.26 121.17 2wan h ALA 641 Ca -0.00 -0.28 -0.01 0.00 0.00 0.00 0.00 54.91 54.62 2wan h ALA 641 Cb 0.72 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.43 2wan h ALA 641 CO 0.03 0.43 -0.05 0.82 0.00 0.00 0.00 179.25 180.48 2wan h ILE 642 N 0.21 1.56 -1.69 0.00 2.04 -1.25 -3.45 117.51 114.93 2wan h ILE 642 Ca 0.04 -1.71 -0.06 0.00 1.00 0.00 0.00 64.86 64.13 2wan h ILE 642 Cb 0.52 2.69 -0.26 0.00 -0.74 0.00 0.00 36.82 39.03 2wan h ILE 642 CO 0.04 0.45 -0.39 0.21 0.00 0.00 0.00 178.15 178.46 2wan s ASN 643 N -6.00 -0.38 0.30 1.72 3.84 -0.50 -5.03 114.94 108.89 2wan s ASN 643 Ca -0.17 0.57 0.23 0.00 0.21 0.00 0.00 52.86 53.70 2wan s ASN 643 Cb 0.00 1.52 1.10 0.00 -0.55 0.00 0.00 41.25 43.32 2wan s ASN 643 CO 0.69 -0.28 1.70 -0.81 -2.79 0.00 0.00 177.10 175.62 2wan n PRO 644 N 5.39 0.17 0.00 0.43 -0.04 -0.96 -2.06 135.00 137.94 2wan n PRO 644 Ca -0.04 0.54 0.14 0.00 -0.04 0.00 0.00 63.50 64.10 2wan n PRO 644 Cb 0.50 -1.93 0.61 0.00 -0.04 0.00 0.00 33.50 32.64 2wan n PRO 644 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2wan n GLY 645 N -0.66 -1.11 3.75 0.55 0.00 -1.26 -4.90 105.19 101.56 2wan n GLY 645 Ca 0.00 -0.23 -0.42 0.00 0.00 0.00 0.00 46.02 45.38 2wan n GLY 645 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2wan s ILE 646 N -2.61 2.02 -0.17 -0.61 1.01 -0.87 -4.30 121.20 115.67 2wan s ILE 646 Ca 0.25 0.02 -0.05 0.00 0.00 0.00 0.00 60.65 60.87 2wan s ILE 646 Cb 0.20 -3.01 -0.03 0.00 0.01 0.00 0.00 42.46 39.62 2wan s ILE 646 CO 0.50 0.00 0.00 -0.69 0.00 0.00 0.00 174.94 174.75 2wan s VAL 647 N 0.11 4.16 -0.05 2.92 1.01 -1.08 -4.95 120.40 122.52 2wan s VAL 647 Ca 0.65 -0.25 0.02 0.00 0.00 0.00 0.00 61.98 62.39 2wan s VAL 647 Cb -0.48 -2.86 0.01 0.00 0.00 0.00 0.00 36.38 33.05 2wan s VAL 647 CO 0.47 0.47 -0.09 -0.76 0.00 0.00 0.00 175.10 175.18 2wan s LEU 648 N 0.52 1.58 0.24 3.92 1.43 -1.26 -1.54 118.68 123.57 2wan s LEU 648 Ca -0.01 -0.23 -0.22 0.00 -1.03 0.00 0.00 54.13 52.64 2wan s LEU 648 Cb -0.14 -0.66 0.04 0.00 0.03 0.00 0.00 46.19 45.46 2wan s LEU 648 CO 0.02 0.01 0.83 -0.72 0.23 0.00 0.00 176.35 176.72 2wan s TYR 649 N 0.65 -0.13 -0.03 0.29 1.13 -0.68 -0.98 117.35 117.58 2wan s TYR 649 Ca -0.12 -0.28 -0.16 0.00 -1.41 0.00 0.00 57.07 55.10 2wan s TYR 649 Cb -0.14 0.69 0.05 0.00 -1.10 0.00 0.00 41.96 41.46 2wan s TYR 649 CO 0.02 -1.10 0.73 0.41 -2.51 0.00 0.00 175.55 173.10 2wan n GLY 650 N -0.48 0.31 3.67 5.49 0.00 -0.59 -0.04 105.19 113.54 2wan n GLY 650 Ca -0.05 -0.93 -0.43 0.00 0.00 0.00 0.00 46.02 44.61 2wan n GLY 650 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2wan s GLU 651 N -2.00 4.32 -0.22 1.61 2.02 -0.97 -2.02 118.70 121.44 2wan s GLU 651 Ca 0.17 1.35 -0.03 0.00 0.02 0.00 0.00 54.97 56.48 2wan s GLU 651 Cb -0.00 -3.60 -0.02 0.00 0.10 0.00 0.00 34.13 30.61 2wan s GLU 651 CO -0.01 -0.49 2.77 -0.35 0.02 0.00 0.00 175.26 177.20 2wan n PRO 652 N 5.74 1.95 -4.01 0.39 -0.04 -1.26 -1.65 135.00 136.11 2wan n PRO 652 Ca 0.10 -1.42 -0.10 0.00 -0.04 0.00 0.00 63.50 62.04 2wan n PRO 652 Cb 0.47 -1.82 -0.05 0.00 -0.04 0.00 0.00 33.50 32.06 2wan n PRO 652 CO 0.00 0.00 0.00 1.67 -0.04 0.00 0.00 175.50 177.13 2wan s TRP 653 N -0.64 0.48 0.51 0.54 -2.14 -1.26 -4.25 118.94 112.17 2wan s TRP 653 Ca 0.47 -0.83 0.05 0.00 2.66 0.00 0.00 56.10 58.46 2wan s TRP 653 Cb 0.28 0.14 0.01 0.00 -3.10 0.00 0.00 33.47 30.81 2wan s TRP 653 CO -0.08 -1.01 0.32 0.95 -2.66 0.00 0.00 176.95 174.47 2wan s THR 654 N -3.85 1.77 -1.55 0.66 -4.23 -1.26 -4.05 115.64 103.12 2wan s THR 654 Ca 0.24 -1.57 0.14 0.00 -1.18 0.00 0.00 61.69 59.32 2wan s THR 654 Cb -0.00 -2.33 0.22 0.00 1.34 0.00 0.00 72.50 71.73 2wan s THR 654 CO 0.11 0.00 1.10 0.61 -0.54 0.00 0.00 174.62 175.90 2wan n GLY 655 N -1.61 1.07 0.00 3.99 0.00 0.27 -5.01 105.19 103.90 2wan n GLY 655 Ca -0.03 -0.44 0.00 0.00 0.00 0.00 0.00 46.02 45.55 2wan n GLY 655 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wan n GLY 656 N 0.80 -1.33 3.67 -0.02 0.00 -0.84 -3.24 105.19 104.23 2wan n GLY 656 Ca 0.11 -0.95 -0.42 0.00 0.00 0.00 0.00 46.02 44.75 2wan n GLY 656 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2wan s THR 657 N -2.61 3.72 0.10 2.61 2.01 -1.25 -4.53 115.64 115.70 2wan s THR 657 Ca 0.00 0.99 -0.06 0.00 0.31 0.00 0.00 61.69 62.92 2wan s THR 657 Cb 0.00 -3.64 -0.05 0.00 0.01 0.00 0.00 72.50 68.82 2wan s THR 657 CO 0.00 -0.05 0.36 -0.55 -0.69 0.00 0.00 174.62 173.69 2wan s SER 658 N 2.49 6.53 0.51 3.53 0.15 -1.26 -2.59 113.70 123.06 2wan s SER 658 Ca 0.66 0.64 0.30 0.00 0.70 0.00 0.00 55.95 58.25 2wan s SER 658 Cb -0.31 -2.11 1.23 0.00 -1.71 0.00 0.00 66.02 63.12 2wan s SER 658 CO 0.26 0.12 1.94 1.23 1.20 0.00 0.00 173.24 177.99 2wan h GLY 659 N 3.25 0.00 -3.96 9.45 0.00 -1.94 -3.45 103.07 106.42 2wan h GLY 659 Ca -0.47 0.00 -0.51 0.00 0.00 0.00 0.00 47.33 46.35 2wan h GLY 659 CO 0.70 0.00 0.49 -2.27 0.00 0.00 0.00 176.54 175.46 2wan s LEU 660 N -6.51 4.51 0.44 3.11 2.96 -1.26 -4.99 118.68 116.94 2wan s LEU 660 Ca 0.00 2.21 -0.25 0.00 -0.22 0.00 0.00 54.13 55.87 2wan s LEU 660 Cb 0.10 -3.62 -0.08 0.00 0.50 0.00 0.00 46.19 43.09 2wan s LEU 660 CO 0.58 -0.21 1.40 -0.94 -1.32 0.00 0.00 176.35 175.86 2wan s SER 661 N -0.44 5.97 0.60 3.68 1.04 -1.26 -4.86 113.70 118.43 2wan s SER 661 Ca 0.48 2.87 0.31 0.00 0.48 0.00 0.00 55.95 60.09 2wan s SER 661 Cb -0.31 -2.65 1.87 0.00 0.10 0.00 0.00 66.02 65.03 2wan s SER 661 CO 0.38 -1.11 2.24 0.77 0.98 0.00 0.00 173.24 176.50 2wan h SER 662 N 2.40 0.00 0.84 7.02 4.64 -1.95 -0.52 113.55 125.99 2wan h SER 662 Ca -0.51 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.81 2wan h SER 662 Cb 1.26 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.35 2wan h SER 662 CO 0.61 0.00 0.00 -2.24 -0.87 0.00 0.00 176.83 174.33 2wan h ASP 663 N 0.00 0.00 0.00 4.97 3.04 -2.04 -2.94 116.42 119.45 2wan h ASP 663 Ca 0.01 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.80 2wan h ASP 663 Cb 0.09 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 38.38 2wan h ASP 663 CO -0.00 0.00 -1.49 0.00 -2.04 0.00 0.00 179.24 175.71 2wan n GLN 664 N -2.47 0.80 -1.90 4.15 1.13 -0.22 -4.92 117.38 113.95 2wan n GLN 664 Ca 0.02 -0.11 -0.42 0.00 -1.94 0.00 0.00 57.00 54.55 2wan n GLN 664 Cb 0.26 -1.38 -0.02 0.00 0.11 0.00 0.00 30.24 29.21 2wan n GLN 664 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 2wan s LEU 665 N -3.78 4.37 -1.29 1.08 1.43 -1.11 -0.68 118.68 118.69 2wan s LEU 665 Ca -0.03 2.77 -0.13 0.00 -1.03 0.00 0.00 54.13 55.72 2wan s LEU 665 Cb 0.12 -3.62 0.14 0.00 0.03 0.00 0.00 46.19 42.85 2wan s LEU 665 CO 0.71 -0.81 1.78 0.52 0.23 0.00 0.00 176.35 178.78 2wan n VAL 666 N 2.67 4.13 -2.30 -1.59 0.31 -0.80 -4.80 118.33 115.94 2wan n VAL 666 Ca 0.09 -4.25 -0.25 0.00 -0.01 0.00 0.00 64.34 59.92 2wan n VAL 666 Cb 0.39 -2.43 0.09 0.00 -0.91 0.00 0.00 33.84 30.97 2wan n VAL 666 CO 0.00 0.00 0.00 0.42 -1.32 0.00 0.00 176.83 175.93 2wan s THR 667 N 1.69 2.27 0.23 2.52 -4.23 -1.26 -3.88 115.64 112.97 2wan s THR 667 Ca 0.44 -0.36 -0.32 0.00 -1.18 0.00 0.00 61.69 60.27 2wan s THR 667 Cb 0.06 -2.91 -0.12 0.00 1.34 0.00 0.00 72.50 70.87 2wan s THR 667 CO -0.00 0.00 1.70 0.29 -0.54 0.00 0.00 174.62 176.07 2wan n LYS 668 N -2.93 2.77 0.00 3.99 5.02 -1.26 -1.23 118.16 124.52 2wan n LYS 668 Ca 0.10 1.00 0.00 0.00 -2.02 0.00 0.00 58.31 57.39 2wan n LYS 668 Cb 0.60 -2.83 0.00 0.00 -0.02 0.00 0.00 35.03 32.78 2wan n LYS 668 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2wan n GLY 669 N 3.57 2.43 0.10 0.72 0.00 -1.22 -4.90 105.19 105.89 2wan n GLY 669 Ca 0.14 -0.11 0.12 0.00 0.00 0.00 0.00 46.02 46.18 2wan n GLY 669 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2wan n GLN 670 N 0.00 0.20 0.00 1.61 1.13 -0.36 -2.83 117.38 117.13 2wan n GLN 670 Ca 0.00 0.28 0.14 0.00 -1.94 0.00 0.00 57.00 55.48 2wan n GLN 670 Cb 0.00 -1.79 0.58 0.00 0.11 0.00 0.00 30.24 29.13 2wan n GLN 670 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2wan n GLN 671 N -2.15 0.05 -1.66 -1.09 0.00 -1.26 -4.91 117.38 106.35 2wan n GLN 671 Ca 0.04 -0.01 -0.55 0.00 0.00 0.00 0.00 57.00 56.49 2wan n GLN 671 Cb 0.33 -1.50 -0.06 0.00 0.00 0.00 0.00 30.24 29.01 2wan n GLN 671 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.06 178.69 2wan n LYS 672 N -1.47 1.24 -0.91 2.61 5.02 -1.13 -1.31 118.16 122.22 2wan n LYS 672 Ca 0.08 0.45 0.00 0.00 -2.02 0.00 0.00 58.31 56.82 2wan n LYS 672 Cb 0.33 -2.13 0.00 0.00 -0.02 0.00 0.00 35.03 33.21 2wan n LYS 672 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2wan n GLY 673 N 3.57 0.64 0.03 0.72 0.00 -1.26 -4.88 105.19 104.01 2wan n GLY 673 Ca 0.23 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.37 2wan n GLY 673 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2wan n LEU 674 N 0.00 0.54 0.00 0.99 4.77 -0.43 -4.94 117.00 117.93 2wan n LEU 674 Ca 0.00 0.19 0.00 0.00 -0.03 0.00 0.00 56.01 56.17 2wan n LEU 674 Cb 0.04 -0.26 0.00 0.00 -2.33 0.00 0.00 43.42 40.87 2wan n LEU 674 CO 0.00 0.02 0.00 0.61 -1.33 0.00 0.00 177.39 176.69 2wan n GLY 675 N 1.42 0.56 3.12 -0.72 0.00 -1.26 -4.76 105.19 103.55 2wan n GLY 675 Ca 0.05 -0.82 -0.11 0.00 0.00 0.00 0.00 46.02 45.14 2wan n GLY 675 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2wan s ILE 676 N -2.00 0.55 0.29 -0.61 -4.36 -1.26 -4.54 121.20 109.26 2wan s ILE 676 Ca 0.00 -1.64 0.10 0.00 -0.26 0.00 0.00 60.65 58.85 2wan s ILE 676 Cb 0.00 -1.30 -0.05 0.00 1.25 0.00 0.00 42.46 42.36 2wan s ILE 676 CO 0.00 -0.75 -0.03 -0.83 0.24 0.00 0.00 174.94 173.57 2wan s GLY 677 N -2.56 1.82 0.00 6.27 0.00 -0.16 -4.50 107.32 108.20 2wan s GLY 677 Ca 0.04 -1.78 0.06 0.00 0.00 0.00 0.00 44.72 43.03 2wan s GLY 677 CO -0.04 -1.81 -0.17 -1.34 0.00 0.00 0.00 173.10 169.73 2wan s VAL 678 N -2.41 1.38 0.22 1.40 -7.23 0.12 -1.55 120.40 112.33 2wan s VAL 678 Ca 0.32 -0.86 -0.32 0.00 -1.81 0.00 0.00 61.98 59.32 2wan s VAL 678 Cb -0.04 -1.17 -0.12 0.00 0.56 0.00 0.00 36.38 35.60 2wan s VAL 678 CO 0.19 0.30 1.69 0.49 -0.31 0.00 0.00 175.10 177.46 2wan n PHE 679 N 2.41 2.75 -3.15 2.82 3.72 -0.86 -1.25 117.46 123.90 2wan n PHE 679 Ca -0.16 0.10 -0.45 0.00 -0.05 0.00 0.00 57.45 56.89 2wan n PHE 679 Cb 0.54 -2.65 -0.02 0.00 -0.94 0.00 0.00 39.48 36.41 2wan n PHE 679 CO 0.00 0.00 0.00 1.21 -0.05 0.00 0.00 176.76 177.92 2wan s ASN 680 N 1.01 6.85 0.34 4.37 3.84 -0.34 -4.62 114.94 126.39 2wan s ASN 680 Ca 0.73 -2.67 0.27 0.00 0.21 0.00 0.00 52.86 51.39 2wan s ASN 680 Cb -0.51 -2.30 1.10 0.00 -0.55 0.00 0.00 41.25 38.99 2wan s ASN 680 CO 0.36 -0.71 1.79 -2.24 -2.79 0.00 0.00 177.10 173.52 2wan h ASP 681 N 7.85 0.00 0.00 -4.21 2.03 -1.91 -2.85 116.42 117.33 2wan h ASP 681 Ca 0.16 0.00 -0.00 0.00 -0.73 0.00 0.00 57.03 56.46 2wan h ASP 681 Cb 0.99 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.49 2wan h ASP 681 CO 0.97 0.00 -0.00 0.78 -1.03 0.00 0.00 179.24 179.96 2wan h ASN 682 N 0.00 -0.00 -0.31 4.15 2.35 -1.97 -0.34 115.58 119.46 2wan h ASN 682 Ca 0.00 -0.31 -0.10 0.00 -0.55 0.00 0.00 56.30 55.34 2wan h ASN 682 Cb 0.40 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.76 2wan h ASN 682 CO 0.00 0.31 -0.15 -0.29 -1.65 0.00 0.00 177.43 175.66 2wan h ILE 683 N -0.32 1.26 0.09 2.81 2.10 -1.87 -0.95 117.51 120.64 2wan h ILE 683 Ca -0.00 -1.21 0.01 0.00 1.08 0.00 0.00 64.86 64.74 2wan h ILE 683 Cb 0.32 1.11 -0.02 0.00 -1.09 0.00 0.00 36.82 37.13 2wan h ILE 683 CO 0.00 0.41 -0.14 -0.09 -1.08 0.00 0.00 178.15 177.25 2wan h ARG 684 N 0.68 -0.28 -0.51 2.19 2.43 -1.47 0.49 114.38 117.91 2wan h ARG 684 Ca 0.11 0.02 -0.05 0.00 -0.81 0.00 0.00 59.98 59.24 2wan h ARG 684 Cb 0.63 0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 30.22 2wan h ARG 684 CO 0.04 -0.18 0.09 -0.91 -1.51 0.00 0.00 179.97 177.50 2wan h ASN 685 N -0.29 0.74 -0.24 -3.80 2.35 -0.99 -2.35 115.58 111.01 2wan h ASN 685 Ca 0.02 -0.14 -0.04 0.00 -0.55 0.00 0.00 56.30 55.59 2wan h ASN 685 Cb 0.30 -0.19 -0.02 0.00 0.05 0.00 0.00 38.32 38.46 2wan h ASN 685 CO -0.08 0.75 0.04 1.23 -1.65 0.00 0.00 177.43 177.72 2wan h GLY 686 N 0.95 0.54 1.03 2.83 0.00 -0.70 -0.31 103.07 107.40 2wan h GLY 686 Ca 0.16 -0.29 -0.22 0.00 0.00 0.00 0.00 47.33 46.98 2wan h GLY 686 CO 0.00 0.28 -0.87 1.41 0.00 0.00 0.00 176.54 177.36 2wan h LEU 687 N 0.49 0.76 -1.56 3.11 3.38 -0.39 0.38 115.31 121.47 2wan h LEU 687 Ca 0.11 -0.75 0.00 0.00 0.09 0.00 0.00 57.88 57.33 2wan h LEU 687 Cb 0.26 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 40.78 2wan h LEU 687 CO 0.00 1.41 -0.00 -0.90 0.09 0.00 0.00 178.44 179.04 2wan n ASP 688 N -4.00 0.56 0.00 -0.43 5.75 -1.02 -1.51 116.55 115.90 2wan n ASP 688 Ca -0.11 -1.28 0.00 0.00 -0.01 0.00 0.00 54.79 53.39 2wan n ASP 688 Cb 0.80 -0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.89 2wan n ASP 688 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2wan n GLY 689 N -0.14 2.36 3.72 6.12 0.00 -0.13 -3.65 105.19 113.47 2wan n GLY 689 Ca 0.00 -1.91 -0.42 0.00 0.00 0.00 0.00 46.02 43.69 2wan n GLY 689 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2wan n ASN 690 N 0.00 3.08 0.27 1.61 5.15 -1.26 -4.50 115.26 119.60 2wan n ASN 690 Ca 0.00 1.21 0.11 0.00 -0.60 0.00 0.00 54.58 55.30 2wan n ASN 690 Cb 0.00 -1.52 0.73 0.00 -0.53 0.00 0.00 39.78 38.46 2wan n ASN 690 CO 0.00 0.00 0.00 1.62 1.40 0.00 0.00 177.26 180.28 2wan h VAL 691 N 2.71 0.76 0.00 3.44 3.04 -1.94 -2.73 116.25 121.52 2wan h VAL 691 Ca -0.47 -0.24 -0.09 0.00 -1.01 0.00 0.00 66.70 64.88 2wan h VAL 691 Cb 1.27 1.14 -0.01 0.00 -2.01 0.00 0.00 31.29 31.68 2wan h VAL 691 CO 0.64 0.06 -0.45 0.15 -1.01 0.00 0.00 177.57 176.97 2wan h PHE 692 N 0.00 0.00 -3.48 3.17 3.04 -2.03 -3.41 116.94 114.23 2wan h PHE 692 Ca -0.00 0.00 -0.71 0.00 3.98 0.00 0.00 57.97 61.24 2wan h PHE 692 Cb 0.14 0.00 -0.28 0.00 2.56 0.00 0.00 35.95 38.37 2wan h PHE 692 CO 0.00 0.45 -0.48 0.34 -2.02 0.00 0.00 178.31 176.59 2wan s ASP 693 N -6.78 5.61 0.47 0.41 2.15 -1.03 -4.95 116.67 112.55 2wan s ASP 693 Ca -0.02 -1.44 0.16 0.00 0.43 0.00 0.00 52.55 51.68 2wan s ASP 693 Cb 0.13 -1.98 1.13 0.00 -0.30 0.00 0.00 42.92 41.90 2wan s ASP 693 CO 0.72 -0.51 2.02 0.11 -0.17 0.00 0.00 175.17 177.35 2wan h LYS 694 N 8.39 0.26 -0.02 4.34 1.57 -1.82 -1.99 116.57 127.30 2wan h LYS 694 Ca -0.23 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.54 2wan h LYS 694 Cb 1.08 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 33.33 2wan h LYS 694 CO 0.74 0.17 -0.07 0.25 -0.57 0.00 0.00 179.45 179.96 2wan n THR 695 N -4.46 0.00 -1.91 -0.16 -2.24 -1.26 -3.79 114.28 100.46 2wan n THR 695 Ca 0.07 -0.30 -0.41 0.00 -2.27 0.00 0.00 64.05 61.14 2wan n THR 695 Cb 0.34 0.79 -0.01 0.00 -2.10 0.00 0.00 70.33 69.35 2wan n THR 695 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2wan s ALA 696 N -2.11 3.60 0.33 6.98 0.00 -0.75 -4.54 121.76 125.27 2wan s ALA 696 Ca 0.32 1.46 0.06 0.00 0.00 0.00 0.00 51.96 53.80 2wan s ALA 696 Cb 0.20 -3.58 -0.01 0.00 0.00 0.00 0.00 23.12 19.73 2wan s ALA 696 CO 0.37 -0.89 0.46 -0.65 0.00 0.00 0.00 175.76 175.05 2wan s GLN 697 N -1.34 3.14 0.00 0.00 -0.21 -1.26 -4.45 119.66 115.53 2wan s GLN 697 Ca 0.55 -1.00 0.00 0.00 0.02 0.00 0.00 55.36 54.94 2wan s GLN 697 Cb -0.44 -2.82 0.00 0.00 1.00 0.00 0.00 33.01 30.74 2wan s GLN 697 CO 0.54 0.09 0.00 0.41 -2.12 0.00 0.00 175.29 174.21 2wan n GLY 698 N -1.62 4.99 0.26 3.09 0.00 -1.24 -3.48 105.19 107.19 2wan n GLY 698 Ca -0.01 -1.63 0.03 0.00 0.00 0.00 0.00 46.02 44.41 2wan n GLY 698 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 2wan h PHE 699 N 0.43 0.39 0.00 1.61 3.57 -0.65 -0.55 116.94 121.73 2wan h PHE 699 Ca 0.00 0.04 0.00 0.00 3.53 0.00 0.00 57.97 61.54 2wan h PHE 699 Cb 0.00 -0.07 0.00 0.00 2.79 0.00 0.00 35.95 38.67 2wan h PHE 699 CO 0.00 0.03 0.00 0.00 -2.23 0.00 0.00 178.31 176.11 2wan h ALA 700 N 1.51 1.00 0.00 2.41 0.00 -1.51 -3.35 119.26 119.32 2wan h ALA 700 Ca 0.37 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.28 2wan h ALA 700 Cb 0.55 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.34 2wan h ALA 700 CO -0.40 0.00 -0.01 0.25 0.00 0.00 0.00 179.25 179.09 2wan n THR 701 N -3.03 0.77 0.00 0.00 -2.24 -0.67 -4.67 114.28 104.45 2wan n THR 701 Ca 0.02 -0.78 0.00 0.00 -2.27 0.00 0.00 64.05 61.01 2wan n THR 701 Cb 0.37 0.60 0.00 0.00 -2.10 0.00 0.00 70.33 69.19 2wan n THR 701 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2wan n GLY 702 N -0.40 1.31 3.73 3.38 0.00 -0.58 -4.69 105.19 107.94 2wan n GLY 702 Ca 0.01 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.61 2wan n GLY 702 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2wan s ASP 703 N -1.29 6.90 0.00 1.61 -1.08 -0.32 -4.93 116.67 117.56 2wan s ASP 703 Ca 0.00 2.34 0.23 0.00 -0.52 0.00 0.00 52.55 54.59 2wan s ASP 703 Cb 0.00 -2.60 0.59 0.00 -1.46 0.00 0.00 42.92 39.45 2wan s ASP 703 CO 0.00 -0.55 1.48 -0.81 0.52 0.00 0.00 175.17 175.81 2wan n PRO 704 N 3.09 2.07 -0.54 4.34 -0.04 -1.26 -4.22 135.00 138.44 2wan n PRO 704 Ca 0.08 -1.60 0.07 0.00 -0.04 0.00 0.00 63.50 62.01 2wan n PRO 704 Cb 0.43 -1.45 0.28 0.00 -0.04 0.00 0.00 33.50 32.72 2wan n PRO 704 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 2wan n ASN 705 N 0.85 4.09 -0.60 3.54 3.02 -1.26 -4.61 115.26 120.29 2wan n ASN 705 Ca 0.17 -3.05 0.06 0.00 -0.03 0.00 0.00 54.58 51.73 2wan n ASN 705 Cb 0.46 -0.58 0.10 0.00 -0.61 0.00 0.00 39.78 39.16 2wan n ASN 705 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2wan n GLN 706 N -0.39 1.62 -0.12 3.52 1.13 -1.26 -4.74 117.38 117.14 2wan n GLN 706 Ca 0.23 -1.61 -0.05 0.00 -1.94 0.00 0.00 57.00 53.63 2wan n GLN 706 Cb 0.96 -1.27 0.03 0.00 0.11 0.00 0.00 30.24 30.07 2wan n GLN 706 CO 0.00 0.00 0.00 0.28 -1.44 0.00 0.00 177.06 175.90 2wan h VAL 707 N 2.42 0.79 -0.67 5.09 2.07 -1.93 -0.67 116.25 123.35 2wan h VAL 707 Ca 0.00 -0.07 -0.06 0.00 0.82 0.00 0.00 66.70 67.39 2wan h VAL 707 Cb 0.63 0.57 -0.03 0.00 -1.52 0.00 0.00 31.29 30.94 2wan h VAL 707 CO 0.00 0.04 0.17 0.44 0.02 0.00 0.00 177.57 178.24 2wan h ASP 708 N 0.20 0.99 -0.46 0.57 3.32 -1.98 0.65 116.42 119.71 2wan h ASP 708 Ca 0.19 -0.20 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2wan h ASP 708 Cb 0.23 -0.26 -0.02 0.00 0.22 0.00 0.00 39.33 39.50 2wan h ASP 708 CO -0.26 0.94 0.30 0.58 -1.72 0.00 0.00 179.24 179.09 2wan h VAL 709 N 1.00 1.12 -0.46 -1.35 2.07 -1.74 -1.46 116.25 115.43 2wan h VAL 709 Ca 0.21 -0.23 -0.06 0.00 0.82 0.00 0.00 66.70 67.45 2wan h VAL 709 Cb 0.34 0.45 -0.02 0.00 -1.52 0.00 0.00 31.29 30.54 2wan h VAL 709 CO -0.00 0.12 0.05 0.40 0.02 0.00 0.00 177.57 178.16 2wan h ILE 710 N 0.62 1.25 -0.75 4.57 1.08 -0.61 -1.62 117.51 122.06 2wan h ILE 710 Ca 0.17 -0.96 0.06 0.00 -0.39 0.00 0.00 64.86 63.74 2wan h ILE 710 Cb -0.06 0.98 -0.06 0.00 -3.07 0.00 0.00 36.82 34.61 2wan h ILE 710 CO -0.04 0.33 0.44 0.11 -0.69 0.00 0.00 178.15 178.31 2wan h LYS 711 N 0.63 0.79 -0.41 2.37 1.57 -0.73 0.11 116.57 120.90 2wan h LYS 711 Ca 0.14 -0.05 -0.05 0.00 -1.87 0.00 0.00 60.65 58.82 2wan h LYS 711 Cb 0.43 -0.18 -0.02 0.00 0.08 0.00 0.00 32.23 32.54 2wan h LYS 711 CO 0.01 0.52 0.04 -0.91 -0.57 0.00 0.00 179.45 178.55 2wan h ASN 712 N 0.81 0.59 -0.22 0.86 2.35 -0.89 -2.56 115.58 116.52 2wan h ASN 712 Ca 0.33 -0.11 -0.15 0.00 -0.55 0.00 0.00 56.30 55.82 2wan h ASN 712 Cb 0.18 -0.16 -0.01 0.00 0.05 0.00 0.00 38.32 38.39 2wan h ASN 712 CO -0.18 0.64 -0.43 1.23 -1.65 0.00 0.00 177.43 177.05 2wan h GLY 713 N 0.88 0.85 0.93 2.83 0.00 -0.70 -1.96 103.07 105.90 2wan h GLY 713 Ca 0.13 -0.89 0.05 0.00 0.00 0.00 0.00 47.33 46.63 2wan h GLY 713 CO 0.01 0.80 0.58 -2.08 0.00 0.00 0.00 176.54 175.85 2wan h VAL 714 N 0.63 1.10 -0.20 4.60 2.07 -0.41 -2.05 116.25 121.98 2wan h VAL 714 Ca 0.04 -0.36 -0.00 0.00 0.82 0.00 0.00 66.70 67.20 2wan h VAL 714 Cb 0.99 -0.04 -0.00 0.00 -1.52 0.00 0.00 31.29 30.72 2wan h VAL 714 CO 0.09 0.19 0.00 2.30 0.02 0.00 0.00 177.57 180.18 2wan n ILE 715 N -4.47 0.97 -2.06 4.57 -5.35 -1.05 -0.86 119.36 111.11 2wan n ILE 715 Ca 0.13 -0.49 -0.12 0.00 -0.27 0.00 0.00 62.75 61.99 2wan n ILE 715 Cb 0.16 -0.42 -0.02 0.00 -1.74 0.00 0.00 39.64 37.62 2wan n ILE 715 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2wan n GLY 716 N 0.22 0.15 2.56 3.28 0.00 -0.77 -3.59 105.19 107.04 2wan n GLY 716 Ca 0.10 -0.38 -0.09 0.00 0.00 0.00 0.00 46.02 45.65 2wan n GLY 716 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2wan n SER 717 N -0.29 -4.99 0.09 1.61 7.64 -0.74 -4.36 113.62 112.58 2wan n SER 717 Ca -0.14 0.22 0.10 0.00 1.01 0.00 0.00 58.87 60.06 2wan n SER 717 Cb 0.57 -3.28 0.42 0.00 -1.01 0.00 0.00 64.21 60.92 2wan n SER 717 CO 0.00 0.00 0.00 2.30 -3.01 0.00 0.00 175.04 174.33 2wan n ILE 718 N -2.44 0.97 -0.11 0.44 -5.35 -1.24 -0.95 119.36 110.69 2wan n ILE 718 Ca -0.09 0.31 0.05 0.00 -0.27 0.00 0.00 62.75 62.75 2wan n ILE 718 Cb 0.45 -1.21 0.13 0.00 -1.74 0.00 0.00 39.64 37.27 2wan n ILE 718 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2wan n GLN 719 N -2.00 2.69 0.01 6.28 6.02 -1.26 -4.65 117.38 124.47 2wan n GLN 719 Ca 0.02 -1.92 -0.01 0.00 -0.01 0.00 0.00 57.00 55.09 2wan n GLN 719 Cb 0.18 -1.23 -0.00 0.00 1.02 0.00 0.00 30.24 30.20 2wan n GLN 719 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 177.06 172.58 2wan n ASP 720 N 0.41 0.42 0.00 1.08 2.03 -0.12 -5.00 116.55 115.36 2wan n ASP 720 Ca 0.10 0.06 0.00 0.00 0.52 0.00 0.00 54.79 55.47 2wan n ASP 720 Cb 0.39 -0.21 0.00 0.00 -0.72 0.00 0.00 41.12 40.58 2wan n ASP 720 CO 0.00 0.00 0.00 2.22 -1.92 0.00 0.00 177.20 177.50 2wan n PHE 721 N -2.89 0.00 -4.23 -0.67 1.16 -0.40 -4.99 117.46 105.44 2wan n PHE 721 Ca -0.01 0.00 -0.26 0.00 -1.87 0.00 0.00 57.45 55.31 2wan n PHE 721 Cb 0.04 0.03 -0.08 0.00 -1.61 0.00 0.00 39.48 37.86 2wan n PHE 721 CO 0.00 0.00 0.00 0.95 -1.87 0.00 0.00 176.76 175.84 2wan s THR 722 N 0.00 3.59 -0.44 1.97 -4.23 -0.70 -3.45 115.64 112.38 2wan s THR 722 Ca 0.00 -1.55 0.22 0.00 -1.18 0.00 0.00 61.69 59.18 2wan s THR 722 Cb 0.00 -2.82 -0.23 0.00 1.34 0.00 0.00 72.50 70.79 2wan s THR 722 CO 0.00 -0.16 0.77 -1.20 -0.54 0.00 0.00 174.62 173.49 2wan n SER 723 N -0.24 0.47 -3.68 3.99 7.64 -1.26 -4.38 113.62 116.15 2wan n SER 723 Ca -0.09 -0.28 -0.15 0.00 1.01 0.00 0.00 58.87 59.36 2wan n SER 723 Cb 0.56 1.32 -0.08 0.00 -1.01 0.00 0.00 64.21 65.00 2wan n SER 723 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2wan s ALA 724 N -3.29 -1.11 0.37 -0.43 0.00 -1.26 -4.37 121.76 111.66 2wan s ALA 724 Ca -0.00 0.73 0.32 0.00 0.00 0.00 0.00 51.96 53.01 2wan s ALA 724 Cb 0.14 -0.05 1.60 0.00 0.00 0.00 0.00 23.12 24.82 2wan s ALA 724 CO 0.86 -0.29 2.10 -1.00 0.00 0.00 0.00 175.76 177.43 2wan h PRO 725 N 3.79 0.00 0.00 0.00 0.13 -1.77 -1.66 132.00 132.50 2wan h PRO 725 Ca -0.29 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.84 2wan h PRO 725 Cb 1.17 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.30 2wan h PRO 725 CO 0.37 0.07 0.03 0.66 -0.23 0.00 0.00 178.00 178.90 2wan h SER 726 N 0.00 0.00 0.42 1.44 4.64 -1.88 -2.76 113.55 115.41 2wan h SER 726 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2wan h SER 726 Cb 0.34 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.43 2wan h SER 726 CO 0.01 0.00 -0.16 -0.62 -0.87 0.00 0.00 176.83 175.19 2wan n GLU 727 N -2.38 0.57 -4.46 4.77 1.02 -0.62 -4.30 120.64 115.23 2wan n GLU 727 Ca -0.02 -0.22 -0.33 0.00 -0.02 0.00 0.00 57.16 56.57 2wan n GLU 727 Cb 0.06 -1.50 -0.15 0.00 -0.02 0.00 0.00 31.44 29.84 2wan n GLU 727 CO 0.00 0.00 0.00 -0.08 1.18 0.00 0.00 177.13 178.23 2wan s THR 728 N -2.58 2.92 -0.50 2.62 -1.32 -1.04 -0.71 115.64 115.03 2wan s THR 728 Ca 0.25 -0.68 -0.18 0.00 -1.21 0.00 0.00 61.69 59.87 2wan s THR 728 Cb 0.20 -2.25 0.07 0.00 -1.51 0.00 0.00 72.50 69.00 2wan s THR 728 CO 0.51 0.50 0.54 -0.63 -2.21 0.00 0.00 174.62 173.33 2wan s ILE 729 N 0.82 5.01 0.05 5.08 -1.09 -0.38 -1.23 121.20 129.46 2wan s ILE 729 Ca -0.04 -0.74 -0.25 0.00 -2.23 0.00 0.00 60.65 57.39 2wan s ILE 729 Cb -0.15 -4.25 -0.06 0.00 -1.58 0.00 0.00 42.46 36.43 2wan s ILE 729 CO 0.00 -0.74 0.76 0.20 -1.23 0.00 0.00 174.94 173.94 2wan s ASN 730 N 2.71 7.22 0.16 3.58 0.01 0.08 -1.20 114.94 127.50 2wan s ASN 730 Ca 0.11 1.45 -0.24 0.00 -0.71 0.00 0.00 52.86 53.47 2wan s ASN 730 Cb -0.21 -2.47 0.06 0.00 0.41 0.00 0.00 41.25 39.04 2wan s ASN 730 CO 0.10 0.03 0.78 -0.72 -1.51 0.00 0.00 177.10 175.78 2wan s TYR 731 N -0.14 -0.30 0.00 2.20 1.13 -1.26 -1.40 117.35 117.57 2wan s TYR 731 Ca 0.38 0.01 0.00 0.00 -1.41 0.00 0.00 57.07 56.05 2wan s TYR 731 Cb -0.21 0.62 0.00 0.00 -1.10 0.00 0.00 41.96 41.27 2wan s TYR 731 CO 0.23 -0.89 0.00 1.55 -2.51 0.00 0.00 175.55 173.93 2wan n VAL 732 N -0.40 0.00 -4.16 -3.49 3.14 -1.26 -3.32 118.33 108.85 2wan n VAL 732 Ca -0.09 0.00 -0.11 0.00 -2.96 0.00 0.00 64.34 61.18 2wan n VAL 732 Cb 0.62 -0.92 -0.10 0.00 -1.06 0.00 0.00 33.84 32.38 2wan n VAL 732 CO 0.00 0.00 0.00 0.42 -6.46 0.00 0.00 176.83 170.79 2wan s THR 733 N -2.00 0.05 0.20 1.55 -4.23 -1.26 -4.95 115.64 104.99 2wan s THR 733 Ca 0.00 -1.90 -0.04 0.00 -1.18 0.00 0.00 61.69 58.57 2wan s THR 733 Cb 0.00 -2.25 0.02 0.00 1.34 0.00 0.00 72.50 71.60 2wan s THR 733 CO 0.00 -0.22 0.33 -1.54 -0.54 0.00 0.00 174.62 172.65 2wan n SER 734 N -0.20 -0.95 0.28 3.99 3.41 -1.26 -3.69 113.62 115.20 2wan n SER 734 Ca -0.02 -1.92 0.12 0.00 -0.26 0.00 0.00 58.87 56.79 2wan n SER 734 Cb 0.65 1.66 0.81 0.00 -0.26 0.00 0.00 64.21 67.07 2wan n SER 734 CO 0.00 0.00 0.00 1.12 -0.16 0.00 0.00 175.04 176.00 2wan h HIS 735 N 1.53 0.00 -4.16 7.33 2.07 -1.96 -3.43 115.15 116.53 2wan h HIS 735 Ca -0.16 0.00 -0.47 0.00 -2.85 0.00 0.00 60.37 56.89 2wan h HIS 735 Cb 0.64 0.00 0.03 0.00 2.57 0.00 0.00 27.41 30.65 2wan h HIS 735 CO 0.00 0.00 0.37 -0.51 -3.07 0.00 0.00 177.93 174.73 2wan s ASP 736 N -6.50 6.33 0.85 3.10 1.01 -1.26 -4.68 116.67 115.53 2wan s ASP 736 Ca -0.05 1.73 0.00 0.00 0.71 0.00 0.00 52.55 54.94 2wan s ASP 736 Cb 0.16 -2.53 0.00 0.00 1.01 0.00 0.00 42.92 41.56 2wan s ASP 736 CO 0.59 -0.79 0.00 0.59 0.21 0.00 0.00 175.17 175.78 2wan n ASN 737 N -1.51 0.00 -4.92 0.27 3.02 -0.98 -4.83 115.26 106.30 2wan n ASN 737 Ca 0.08 0.00 -0.30 0.00 -0.03 0.00 0.00 54.58 54.33 2wan n ASN 737 Cb 0.53 0.00 -0.04 0.00 -0.61 0.00 0.00 39.78 39.67 2wan n ASN 737 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 2wan s MET 738 N 0.00 3.48 0.74 3.52 -1.94 -1.26 -4.25 119.30 119.59 2wan s MET 738 Ca 0.00 -0.41 -0.13 0.00 -1.71 0.00 0.00 55.69 53.44 2wan s MET 738 Cb 0.00 -2.97 0.05 0.00 2.01 0.00 0.00 34.83 33.91 2wan s MET 738 CO 0.00 0.55 1.13 0.95 -0.01 0.00 0.00 175.02 177.63 2wan s THR 739 N -1.62 2.92 0.30 2.05 -4.23 -1.26 -4.69 115.64 109.11 2wan s THR 739 Ca 0.36 0.37 0.00 0.00 -1.18 0.00 0.00 61.69 61.25 2wan s THR 739 Cb -0.12 -2.82 0.18 0.00 1.34 0.00 0.00 72.50 71.08 2wan s THR 739 CO 0.28 -0.32 1.88 0.25 -0.54 0.00 0.00 174.62 176.16 2wan h LEU 740 N -0.67 0.74 -0.47 4.79 5.85 -1.94 0.10 115.31 123.71 2wan h LEU 740 Ca -0.45 -0.10 -0.01 0.00 0.84 0.00 0.00 57.88 58.16 2wan h LEU 740 Cb 1.25 -0.19 -0.02 0.00 0.37 0.00 0.00 40.66 42.07 2wan h LEU 740 CO 0.51 0.68 0.27 -0.25 -0.34 0.00 0.00 178.44 179.31 2wan h TRP 741 N 0.79 0.63 -0.42 1.25 2.91 -1.90 0.15 115.95 119.36 2wan h TRP 741 Ca 0.18 -0.01 -0.11 0.00 1.13 0.00 0.00 58.89 60.09 2wan h TRP 741 Cb 0.20 -0.20 -0.01 0.00 -0.51 0.00 0.00 29.16 28.63 2wan h TRP 741 CO 0.01 0.45 -0.15 -0.44 -1.03 0.00 0.00 178.44 177.28 2wan h ASP 742 N 0.62 0.85 -0.52 2.65 5.19 -1.72 -2.12 116.42 121.37 2wan h ASP 742 Ca 0.17 -0.38 0.01 0.00 -0.62 0.00 0.00 57.03 56.20 2wan h ASP 742 Cb 0.02 -0.23 -0.03 0.00 0.18 0.00 0.00 39.33 39.27 2wan h ASP 742 CO -0.03 1.04 0.35 0.50 -3.12 0.00 0.00 179.24 177.98 2wan h LYS 743 N 0.65 0.69 -0.14 3.56 1.63 -0.42 -1.99 116.57 120.56 2wan h LYS 743 Ca 0.10 -0.04 -0.13 0.00 -0.85 0.00 0.00 60.65 59.72 2wan h LYS 743 Cb 0.70 -0.16 -0.01 0.00 -0.60 0.00 0.00 32.23 32.16 2wan h LYS 743 CO 0.05 0.46 -0.49 0.82 -3.45 0.00 0.00 179.45 176.83 2wan h ILE 744 N 0.71 1.33 -0.84 2.00 2.04 -0.92 -1.14 117.51 120.69 2wan h ILE 744 Ca 0.19 -1.72 0.03 0.00 1.00 0.00 0.00 64.86 64.36 2wan h ILE 744 Cb -0.08 1.77 -0.05 0.00 -0.74 0.00 0.00 36.82 37.72 2wan h ILE 744 CO -0.04 0.52 0.55 -0.07 0.00 0.00 0.00 178.15 179.12 2wan h LEU 745 N 0.29 0.91 -0.29 1.44 3.38 -1.11 0.16 115.31 120.10 2wan h LEU 745 Ca 0.01 -0.01 -0.15 0.00 0.09 0.00 0.00 57.88 57.82 2wan h LEU 745 Cb 0.97 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 41.51 2wan h LEU 745 CO 0.08 0.63 -0.41 0.00 0.09 0.00 0.00 178.44 178.83 2wan h ALA 746 N 1.50 0.43 0.00 1.53 0.00 -0.81 -3.07 119.26 118.85 2wan h ALA 746 Ca 0.33 -0.46 -0.04 0.00 0.00 0.00 0.00 54.91 54.74 2wan h ALA 746 Cb 0.01 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 2wan h ALA 746 CO -0.10 0.55 -1.08 0.66 0.00 0.00 0.00 179.25 179.28 2wan h SER 747 N 0.54 0.00 -1.37 0.00 4.64 -1.06 -3.40 113.55 112.90 2wan h SER 747 Ca 0.03 0.00 -0.46 0.00 -0.47 0.00 0.00 61.79 60.88 2wan h SER 747 Cb 1.01 0.00 -0.41 0.00 -0.31 0.00 0.00 62.40 62.69 2wan h SER 747 CO 0.10 0.15 -1.01 0.59 -0.87 0.00 0.00 176.83 175.79 2wan n ASN 748 N -2.75 2.67 0.26 4.97 4.13 0.56 -4.83 115.26 120.28 2wan n ASN 748 Ca -0.02 -3.14 0.10 0.00 1.68 0.00 0.00 54.58 53.20 2wan n ASN 748 Cb 0.63 -0.52 0.71 0.00 -1.54 0.00 0.00 39.78 39.06 2wan n ASN 748 CO 0.00 0.00 0.00 1.55 0.28 0.00 0.00 177.26 179.09 2wan h PRO 749 N 2.86 0.00 -0.00 3.52 0.13 -1.70 -2.20 132.00 134.61 2wan h PRO 749 Ca 0.07 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.20 2wan h PRO 749 Cb 1.02 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.15 2wan h PRO 749 CO 0.64 0.07 -0.23 0.43 -0.23 0.00 0.00 178.00 178.68 2wan n SER 750 N -4.10 0.31 -4.84 1.44 7.64 -1.26 -4.90 113.62 107.92 2wan n SER 750 Ca -0.03 -0.03 -0.32 0.00 1.01 0.00 0.00 58.87 59.50 2wan n SER 750 Cb 0.16 -0.10 -0.06 0.00 -1.01 0.00 0.00 64.21 63.20 2wan n SER 750 CO 0.00 0.00 0.00 -1.81 -3.01 0.00 0.00 175.04 170.22 2wan s ASP 751 N -2.90 6.81 0.87 6.43 1.01 -0.83 -5.05 116.67 123.02 2wan s ASP 751 Ca 0.16 1.45 -0.11 0.00 0.71 0.00 0.00 52.55 54.76 2wan s ASP 751 Cb 0.19 -2.44 0.12 0.00 1.01 0.00 0.00 42.92 41.79 2wan s ASP 751 CO 0.59 -0.31 1.10 0.42 0.21 0.00 0.00 175.17 177.18 2wan s THR 752 N -2.14 2.73 0.23 -1.27 -4.23 -1.26 -4.81 115.64 104.90 2wan s THR 752 Ca 0.57 0.24 -0.05 0.00 -1.18 0.00 0.00 61.69 61.27 2wan s THR 752 Cb -0.10 -2.58 0.14 0.00 1.34 0.00 0.00 72.50 71.30 2wan s THR 752 CO 0.18 -0.31 1.77 -0.08 -0.54 0.00 0.00 174.62 175.63 2wan h GLU 753 N -1.54 1.02 -0.61 3.99 4.81 -1.98 -0.42 114.58 119.85 2wan h GLU 753 Ca -0.46 -0.23 0.01 0.00 -0.13 0.00 0.00 59.36 58.55 2wan h GLU 753 Cb 1.26 -0.14 -0.03 0.00 0.63 0.00 0.00 28.75 30.47 2wan h GLU 753 CO 0.50 0.90 0.40 0.00 -0.73 0.00 0.00 179.01 180.08 2wan h ALA 754 N 1.20 0.77 -0.28 2.92 0.00 -2.00 -0.01 119.26 121.87 2wan h ALA 754 Ca 0.21 -0.04 -0.16 0.00 0.00 0.00 0.00 54.91 54.91 2wan h ALA 754 Cb 0.33 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 2wan h ALA 754 CO -0.00 0.21 -0.48 -0.44 0.00 0.00 0.00 179.25 178.54 2wan h ASP 755 N 0.82 0.81 -0.50 0.00 3.32 -1.86 -2.39 116.42 116.63 2wan h ASP 755 Ca 0.22 -0.40 -0.05 0.00 0.02 0.00 0.00 57.03 56.82 2wan h ASP 755 Cb -0.09 -0.23 -0.03 0.00 0.22 0.00 0.00 39.33 39.20 2wan h ASP 755 CO -0.05 1.16 0.15 0.03 -1.72 0.00 0.00 179.24 178.80 2wan h ARG 756 N 0.59 0.84 -0.45 3.56 3.08 -0.74 -0.94 114.38 120.33 2wan h ARG 756 Ca 0.03 -0.17 0.00 0.00 0.07 0.00 0.00 59.98 59.92 2wan h ARG 756 Cb 1.04 -0.13 -0.02 0.00 0.08 0.00 0.00 29.97 30.94 2wan h ARG 756 CO 0.10 0.75 0.28 0.82 -1.07 0.00 0.00 179.97 180.85 2wan h ILE 757 N 0.81 1.13 -0.83 2.04 2.04 -0.89 -1.48 117.51 120.33 2wan h ILE 757 Ca 0.18 -0.27 0.01 0.00 1.00 0.00 0.00 64.86 65.78 2wan h ILE 757 Cb 0.28 0.51 -0.04 0.00 -0.74 0.00 0.00 36.82 36.82 2wan h ILE 757 CO -0.00 0.13 0.55 0.11 0.00 0.00 0.00 178.15 178.94 2wan h LYS 758 N 0.60 1.09 -0.60 2.37 1.57 -0.89 -0.79 116.57 119.92 2wan h LYS 758 Ca 0.16 -0.07 -0.03 0.00 -1.87 0.00 0.00 60.65 58.84 2wan h LYS 758 Cb -0.03 -0.25 -0.03 0.00 0.08 0.00 0.00 32.23 32.00 2wan h LYS 758 CO -0.03 0.72 0.25 0.52 -0.57 0.00 0.00 179.45 180.33 2wan h MET 759 N 1.12 0.89 0.05 3.15 2.86 -0.93 0.33 114.93 122.41 2wan h MET 759 Ca 0.31 -0.16 -0.00 0.00 -2.06 0.00 0.00 59.70 57.79 2wan h MET 759 Cb -0.12 -0.15 0.00 0.00 0.06 0.00 0.00 31.60 31.40 2wan h MET 759 CO -0.07 0.76 -0.02 0.22 1.06 0.00 0.00 176.91 178.85 2wan h ASP 760 N 0.83 -0.06 -0.73 1.22 1.82 -0.99 -1.34 116.42 117.17 2wan h ASP 760 Ca 0.20 -0.07 0.04 0.00 -0.39 0.00 0.00 57.03 56.81 2wan h ASP 760 Cb 0.19 0.01 -0.05 0.00 0.68 0.00 0.00 39.33 40.17 2wan h ASP 760 CO -0.02 0.04 0.45 -0.33 -1.61 0.00 0.00 179.24 177.77 2wan h GLU 761 N -0.14 0.84 -0.55 0.28 5.08 -1.01 -2.50 114.58 116.58 2wan h GLU 761 Ca -0.01 -0.05 -0.01 0.00 -1.00 0.00 0.00 59.36 58.30 2wan h GLU 761 Cb 0.12 -0.19 -0.03 0.00 0.50 0.00 0.00 28.75 29.16 2wan h GLU 761 CO 0.01 0.56 0.32 1.25 -1.00 0.00 0.00 179.01 180.15 2wan h LEU 762 N 0.87 0.66 -0.41 1.33 5.85 -0.66 0.11 115.31 123.07 2wan h LEU 762 Ca 0.30 -0.07 0.02 0.00 0.84 0.00 0.00 57.88 58.98 2wan h LEU 762 Cb 0.07 -0.17 -0.03 0.00 0.37 0.00 0.00 40.66 40.90 2wan h LEU 762 CO -0.13 0.54 0.23 0.00 -0.34 0.00 0.00 178.44 178.74 2wan h ALA 763 N 1.15 0.52 -0.11 1.25 0.00 -1.01 -1.70 119.26 119.36 2wan h ALA 763 Ca 0.19 0.00 -0.11 0.00 0.00 0.00 0.00 54.91 55.00 2wan h ALA 763 Cb 0.00 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 2wan h ALA 763 CO -0.04 -0.11 -0.41 0.45 0.00 0.00 0.00 179.25 179.14 2wan h HIS 764 N 0.46 0.28 -0.92 0.00 3.86 -1.28 -2.82 115.15 114.73 2wan h HIS 764 Ca 0.17 -0.08 0.00 0.00 -1.16 0.00 0.00 60.37 59.30 2wan h HIS 764 Cb 0.04 -0.06 -0.04 0.00 1.06 0.00 0.00 27.41 28.40 2wan h HIS 764 CO -0.08 0.62 0.57 0.00 0.86 0.00 0.00 177.93 179.90 2wan h ALA 765 N 1.37 1.16 -0.14 2.45 0.00 -0.01 0.24 119.26 124.34 2wan h ALA 765 Ca 0.02 -0.09 0.01 0.00 0.00 0.00 0.00 54.91 54.85 2wan h ALA 765 Cb 0.82 -0.37 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 2wan h ALA 765 CO 0.06 0.60 0.06 0.28 0.00 0.00 0.00 179.25 180.26 2wan h VAL 766 N 1.25 0.99 -0.57 0.00 2.07 -1.19 -1.15 116.25 117.66 2wan h VAL 766 Ca 0.33 -0.05 0.06 0.00 0.82 0.00 0.00 66.70 67.86 2wan h VAL 766 Cb -0.09 0.84 -0.05 0.00 -1.52 0.00 0.00 31.29 30.47 2wan h VAL 766 CO -0.07 0.03 0.27 0.58 0.02 0.00 0.00 177.57 178.40 2wan h VAL 767 N 0.14 0.91 0.00 2.57 2.07 -1.11 -1.74 116.25 119.09 2wan h VAL 767 Ca 0.06 -0.18 0.00 0.00 0.82 0.00 0.00 66.70 67.40 2wan h VAL 767 Cb 0.02 0.35 0.00 0.00 -1.52 0.00 0.00 31.29 30.13 2wan h VAL 767 CO -0.04 0.09 0.00 -0.26 0.02 0.00 0.00 177.57 177.38 2wan h PHE 768 N 0.51 0.00 -0.03 1.57 0.04 -0.71 -3.26 116.94 115.07 2wan h PHE 768 Ca 0.26 0.00 0.00 0.00 2.80 0.00 0.00 57.97 61.03 2wan h PHE 768 Cb 0.22 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.37 2wan h PHE 768 CO -0.11 0.00 0.00 0.25 -0.60 0.00 0.00 178.31 177.85 2wan n THR 769 N -2.76 0.06 -3.09 -1.55 -2.24 -0.46 -4.79 114.28 99.46 2wan n THR 769 Ca 0.03 -0.53 -0.34 0.00 -2.27 0.00 0.00 64.05 60.94 2wan n THR 769 Cb 0.41 1.17 -0.06 0.00 -2.10 0.00 0.00 70.33 69.75 2wan n THR 769 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 2wan s SER 770 N -0.86 6.92 0.51 3.42 0.01 -0.68 -4.95 113.70 118.06 2wan s SER 770 Ca 0.12 1.38 -0.22 0.00 1.31 0.00 0.00 55.95 58.55 2wan s SER 770 Cb 0.09 -2.41 -0.06 0.00 0.21 0.00 0.00 66.02 63.85 2wan s SER 770 CO 0.13 -0.12 1.32 -1.10 0.41 0.00 0.00 173.24 173.88 2wan s GLN 771 N -2.58 3.35 0.00 12.44 -1.52 -0.04 -4.81 119.66 126.49 2wan s GLN 771 Ca 0.50 2.15 0.00 0.00 -1.95 0.00 0.00 55.36 56.06 2wan s GLN 771 Cb -0.13 -2.34 0.00 0.00 -0.22 0.00 0.00 33.01 30.32 2wan s GLN 771 CO 0.19 -0.99 0.00 0.41 -0.25 0.00 0.00 175.29 174.64 2wan n GLY 772 N 0.65 0.45 3.29 3.09 0.00 -1.26 -3.15 105.19 108.26 2wan n GLY 772 Ca 0.09 -2.28 -0.39 0.00 0.00 0.00 0.00 46.02 43.44 2wan n GLY 772 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2wan s VAL 773 N -0.12 4.10 0.22 1.61 1.01 -0.37 -4.56 120.40 122.29 2wan s VAL 773 Ca 0.00 -1.22 -0.30 0.00 0.00 0.00 0.00 61.98 60.47 2wan s VAL 773 Cb 0.00 -3.41 -0.08 0.00 0.00 0.00 0.00 36.38 32.89 2wan s VAL 773 CO 0.00 -0.34 1.04 -2.16 0.00 0.00 0.00 175.10 173.64 2wan s PRO 774 N 1.43 4.70 0.01 2.72 0.04 -1.25 -0.74 135.00 141.91 2wan s PRO 774 Ca 0.01 1.65 0.03 0.00 0.04 0.00 0.00 61.00 62.73 2wan s PRO 774 Cb -0.21 -3.26 -0.01 0.00 0.04 0.00 0.00 34.50 31.06 2wan s PRO 774 CO 0.03 0.27 -0.09 0.12 0.04 0.00 0.00 177.00 177.36 2wan s PHE 775 N -0.80 0.83 0.02 0.56 5.36 -0.49 -1.58 117.98 121.88 2wan s PHE 775 Ca 0.45 -0.22 0.01 0.00 -0.96 0.00 0.00 56.93 56.22 2wan s PHE 775 Cb -0.29 -0.52 -0.02 0.00 -0.34 0.00 0.00 43.02 41.86 2wan s PHE 775 CO 0.36 -0.01 -0.05 0.00 -1.46 0.00 0.00 175.22 174.05 2wan s MET 776 N -0.50 0.39 -0.03 10.12 0.23 0.07 -4.47 119.30 125.10 2wan s MET 776 Ca 0.02 -0.50 -0.30 0.00 -1.03 0.00 0.00 55.69 53.88 2wan s MET 776 Cb -0.05 -0.19 -0.05 0.00 -1.53 0.00 0.00 34.83 33.01 2wan s MET 776 CO 0.00 0.03 1.41 -1.14 -2.03 0.00 0.00 175.02 173.29 2wan s GLN 777 N -1.02 4.27 0.22 3.16 0.74 -1.24 -1.26 119.66 124.53 2wan s GLN 777 Ca -0.07 1.95 -0.32 0.00 0.05 0.00 0.00 55.36 56.96 2wan s GLN 777 Cb -0.07 -3.64 -0.14 0.00 1.10 0.00 0.00 33.01 30.26 2wan s GLN 777 CO -0.00 -0.62 1.41 0.41 -0.55 0.00 0.00 175.29 175.95 2wan n GLY 778 N 3.68 0.77 0.00 2.59 0.00 0.87 -2.04 105.19 111.07 2wan n GLY 778 Ca 0.14 0.52 0.00 0.00 0.00 0.00 0.00 46.02 46.68 2wan n GLY 778 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wan n GLY 779 N 2.31 1.00 0.26 -0.02 0.00 -1.26 -4.92 105.19 102.55 2wan n GLY 779 Ca 0.13 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.24 2wan n GLY 779 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2wan h GLU 780 N 3.62 0.00 0.00 1.61 4.39 -1.77 -1.46 114.58 120.97 2wan h GLU 780 Ca 0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 2wan h GLU 780 Cb 0.00 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.65 2wan h GLU 780 CO 0.00 0.10 0.00 -0.85 -1.16 0.00 0.00 179.01 177.10 2wan n GLU 781 N -4.05 0.08 -0.47 2.33 0.00 -1.26 -1.95 120.64 115.32 2wan n GLU 781 Ca -0.02 0.38 0.07 0.00 0.00 0.00 0.00 57.16 57.58 2wan n GLU 781 Cb 0.19 -1.68 0.14 0.00 0.00 0.00 0.00 31.44 30.09 2wan n GLU 781 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 2wan n MET 782 N -1.84 1.11 -3.77 3.44 0.00 -0.62 -2.16 117.12 113.28 2wan n MET 782 Ca 0.02 -2.60 -0.25 0.00 0.00 0.00 0.00 57.70 54.87 2wan n MET 782 Cb 0.16 -1.26 0.03 0.00 0.00 0.00 0.00 33.22 32.15 2wan n MET 782 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 175.97 177.25 2wan n LEU 783 N -0.94 -2.93 -4.64 3.17 4.77 -0.82 -4.53 117.00 111.07 2wan n LEU 783 Ca 0.14 -0.78 -0.44 0.00 -0.03 0.00 0.00 56.01 54.89 2wan n LEU 783 Cb 0.72 -2.65 -0.02 0.00 -2.33 0.00 0.00 43.42 39.14 2wan n LEU 783 CO -0.02 0.45 0.79 -1.14 -1.33 0.00 0.00 177.39 176.14 2wan n ARG 784 N -4.47 1.75 -4.81 3.23 0.63 -0.78 -4.89 116.66 107.31 2wan n ARG 784 Ca -0.15 0.62 -0.25 0.00 -0.92 0.00 0.00 57.85 57.15 2wan n ARG 784 Cb 0.61 -2.13 -0.15 0.00 0.45 0.00 0.00 32.46 31.23 2wan n ARG 784 CO 0.00 0.00 0.00 -0.08 -2.51 0.00 0.00 177.63 175.04 2wan s THR 785 N -0.78 1.36 -0.48 5.15 -1.32 -1.26 -4.54 115.64 113.77 2wan s THR 785 Ca 0.61 -0.72 0.16 0.00 -1.21 0.00 0.00 61.69 60.52 2wan s THR 785 Cb -0.66 -1.14 0.62 0.00 -1.51 0.00 0.00 72.50 69.81 2wan s THR 785 CO 0.58 0.39 1.53 0.29 -2.21 0.00 0.00 174.62 175.20 2wan n LYS 786 N 2.79 3.60 -2.13 7.08 5.02 -1.26 -4.81 118.16 128.45 2wan n LYS 786 Ca -0.16 -2.84 -0.20 0.00 -2.02 0.00 0.00 58.31 53.09 2wan n LYS 786 Cb 0.54 -1.89 -0.03 0.00 -0.02 0.00 0.00 35.03 33.62 2wan n LYS 786 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2wan n GLY 787 N 0.24 0.30 1.22 0.72 0.00 -1.26 -2.22 105.19 104.20 2wan n GLY 787 Ca 0.23 -0.03 0.00 0.00 0.00 0.00 0.00 46.02 46.22 2wan n GLY 787 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wan n GLY 788 N -0.84 0.81 3.73 -0.02 0.00 -1.26 -5.04 105.19 102.56 2wan n GLY 788 Ca -0.23 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.37 2wan n GLY 788 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2wan n ASN 789 N 0.00 3.92 -0.67 1.61 2.85 -0.94 -4.92 115.26 117.11 2wan n ASN 789 Ca 0.00 1.09 0.06 0.00 -0.11 0.00 0.00 54.58 55.62 2wan n ASN 789 Cb 0.00 -1.58 0.16 0.00 1.24 0.00 0.00 39.78 39.61 2wan n ASN 789 CO 0.00 0.00 0.00 -0.90 -2.11 0.00 0.00 177.26 174.25 2wan n ASP 790 N 3.35 3.02 -2.71 1.20 5.68 -1.26 -4.47 116.55 121.35 2wan n ASP 790 Ca 0.14 -2.08 -0.06 0.00 -0.50 0.00 0.00 54.79 52.29 2wan n ASP 790 Cb 0.35 -0.26 0.05 0.00 -1.14 0.00 0.00 41.12 40.12 2wan n ASP 790 CO 0.00 0.00 0.00 -3.20 -1.33 0.00 0.00 177.20 172.67 2wan n ASN 791 N 0.45 -2.30 -1.46 -1.12 5.15 -1.26 -2.33 115.26 112.39 2wan n ASN 791 Ca 0.12 -2.46 -0.05 0.00 -0.60 0.00 0.00 54.58 51.60 2wan n ASN 791 Cb 0.47 1.32 0.15 0.00 -0.53 0.00 0.00 39.78 41.19 2wan n ASN 791 CO 0.00 0.00 0.00 -1.54 1.40 0.00 0.00 177.26 177.12 2wan n SER 792 N 1.93 3.47 -0.17 1.20 3.41 -1.26 -4.63 113.62 117.57 2wan n SER 792 Ca 0.08 -2.68 0.19 0.00 -0.26 0.00 0.00 58.87 56.20 2wan n SER 792 Cb 0.65 -0.64 0.55 0.00 -0.26 0.00 0.00 64.21 64.51 2wan n SER 792 CO 0.00 0.00 0.00 0.10 -0.16 0.00 0.00 175.04 174.98 2wan h TYR 793 N 1.31 0.40 0.00 7.33 -0.00 -1.97 -1.91 116.97 122.12 2wan h TYR 793 Ca 0.18 0.01 -0.02 0.00 0.00 0.00 0.00 58.73 58.90 2wan h TYR 793 Cb 1.66 -0.12 -0.05 0.00 0.00 0.00 0.00 36.73 38.22 2wan h TYR 793 CO 0.72 0.13 -0.36 0.27 -0.00 0.00 0.00 178.16 178.93 2wan n ASN 794 N -4.45 1.39 0.02 0.10 6.94 -1.26 -1.21 115.26 116.78 2wan n ASN 794 Ca 0.16 -2.78 0.13 0.00 -0.02 0.00 0.00 54.58 52.08 2wan n ASN 794 Cb 0.65 -0.36 0.56 0.00 -2.36 0.00 0.00 39.78 38.26 2wan n ASN 794 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2wan n ALA 795 N -0.73 2.28 0.00 -2.53 0.00 -0.72 -4.85 120.51 113.96 2wan n ALA 795 Ca 0.11 -0.08 0.00 0.00 0.00 0.00 0.00 53.44 53.47 2wan n ALA 795 Cb 0.73 -1.46 0.00 0.00 0.00 0.00 0.00 19.45 18.72 2wan n ALA 795 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wan n GLY 796 N 1.37 -2.49 0.13 0.00 0.00 -1.26 -4.52 105.19 98.42 2wan n GLY 796 Ca 0.06 -1.74 -0.20 0.00 0.00 0.00 0.00 46.02 44.15 2wan n GLY 796 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2wan h ASP 797 N 0.00 0.63 0.04 1.61 3.32 -1.95 -1.40 116.42 118.67 2wan h ASP 797 Ca 0.00 -0.66 -0.02 0.00 0.02 0.00 0.00 57.03 56.37 2wan h ASP 797 Cb 0.00 -0.20 -0.00 0.00 0.22 0.00 0.00 39.33 39.34 2wan h ASP 797 CO 0.00 1.51 -0.06 0.28 -1.72 0.00 0.00 179.24 179.25 2wan h SER 798 N 0.13 0.05 0.00 6.45 0.02 -1.96 0.62 113.55 118.85 2wan h SER 798 Ca -0.18 -0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 60.76 2wan h SER 798 Cb 2.03 -0.01 -0.00 0.00 0.14 0.00 0.00 62.40 64.56 2wan h SER 798 CO 0.23 0.12 -0.01 0.58 -1.14 0.00 0.00 176.83 176.61 2wan h VAL 799 N 0.05 1.31 0.00 2.27 2.07 -1.78 -3.42 116.25 116.75 2wan h VAL 799 Ca 0.01 -1.99 0.00 0.00 0.82 0.00 0.00 66.70 65.54 2wan h VAL 799 Cb 0.14 2.48 0.00 0.00 -1.52 0.00 0.00 31.29 32.40 2wan h VAL 799 CO 0.01 0.45 -1.24 0.59 0.02 0.00 0.00 177.57 177.40 2wan n ASN 800 N -4.65 0.57 -4.73 0.57 3.02 -0.53 -4.17 115.26 105.33 2wan n ASN 800 Ca -0.07 0.08 -0.33 0.00 -0.03 0.00 0.00 54.58 54.23 2wan n ASN 800 Cb 0.35 0.92 0.09 0.00 -0.61 0.00 0.00 39.78 40.53 2wan n ASN 800 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2wan s GLN 801 N -3.34 2.13 -0.44 3.52 -2.07 0.20 -4.80 119.66 114.85 2wan s GLN 801 Ca -0.01 1.53 -0.28 0.00 -1.82 0.00 0.00 55.36 54.77 2wan s GLN 801 Cb 0.12 -1.86 -0.00 0.00 -1.09 0.00 0.00 33.01 30.18 2wan s GLN 801 CO 0.82 -1.80 1.58 -0.06 -1.32 0.00 0.00 175.29 174.52 2wan s PHE 802 N -2.35 2.11 -0.62 9.60 0.40 0.19 -4.92 117.98 122.38 2wan s PHE 802 Ca 0.69 0.63 -0.21 0.00 -0.60 0.00 0.00 56.93 57.44 2wan s PHE 802 Cb -0.24 -4.25 0.08 0.00 0.51 0.00 0.00 43.02 39.12 2wan s PHE 802 CO 0.48 -2.31 0.85 0.34 0.70 0.00 0.00 175.22 175.28 2wan s ASP 803 N 5.16 6.19 0.21 1.36 2.15 -1.26 -4.46 116.67 126.03 2wan s ASP 803 Ca 0.66 -1.11 0.24 0.00 0.43 0.00 0.00 52.55 52.77 2wan s ASP 803 Cb -0.16 -2.37 0.92 0.00 -0.30 0.00 0.00 42.92 41.01 2wan s ASP 803 CO 0.30 -1.28 1.72 0.79 -0.17 0.00 0.00 175.17 176.52 2wan n TRP 804 N 7.12 0.74 0.26 -5.34 7.02 -1.26 -1.75 117.44 124.22 2wan n TRP 804 Ca -0.06 0.27 0.15 0.00 -1.02 0.00 0.00 57.50 56.84 2wan n TRP 804 Cb 0.44 -0.93 0.85 0.00 -2.42 0.00 0.00 31.31 29.26 2wan n TRP 804 CO 0.00 0.00 0.00 0.66 -2.02 0.00 0.00 177.69 176.33 2wan h SER 805 N 0.00 0.00 1.01 -0.99 4.64 -1.91 -2.19 113.55 114.11 2wan h SER 805 Ca 0.00 0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 61.25 2wan h SER 805 Cb 0.45 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.53 2wan h SER 805 CO 0.00 0.00 -0.33 0.03 -0.87 0.00 0.00 176.83 175.66 2wan h ARG 806 N 0.00 0.00 -0.37 4.77 3.08 -1.64 -0.58 114.38 119.64 2wan h ARG 806 Ca 0.03 0.00 -0.10 0.00 0.07 0.00 0.00 59.98 59.98 2wan h ARG 806 Cb 0.18 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.21 2wan h ARG 806 CO -0.00 0.33 -0.17 -0.22 -1.07 0.00 0.00 179.97 178.84 2wan h LYS 807 N 0.00 0.69 -0.32 0.04 3.64 -1.56 0.85 116.57 119.91 2wan h LYS 807 Ca -0.00 -0.25 -0.06 0.00 -1.27 0.00 0.00 60.65 59.07 2wan h LYS 807 Cb 0.92 -0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 32.68 2wan h LYS 807 CO 0.04 0.82 -0.03 0.00 -2.27 0.00 0.00 179.45 178.02 2wan h ALA 808 N 1.19 0.43 -0.55 5.00 0.00 -1.45 -1.87 119.26 122.01 2wan h ALA 808 Ca 0.10 -0.26 -0.09 0.00 0.00 0.00 0.00 54.91 54.67 2wan h ALA 808 Cb 0.64 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.29 2wan h ALA 808 CO 0.05 0.21 0.00 0.37 0.00 0.00 0.00 179.25 179.88 2wan h GLN 809 N 0.36 0.95 -0.94 0.00 4.15 -1.01 -3.21 115.11 115.41 2wan h GLN 809 Ca 0.09 -0.28 -0.57 0.00 0.77 0.00 0.00 58.65 58.66 2wan h GLN 809 Cb 0.49 -0.10 -0.42 0.00 0.21 0.00 0.00 27.48 27.66 2wan h GLN 809 CO 0.02 0.93 -0.67 1.19 -1.93 0.00 0.00 178.83 178.38 2wan n PHE 810 N -4.19 2.92 -0.07 3.99 3.72 0.28 -4.81 117.46 119.30 2wan n PHE 810 Ca 0.03 -2.45 0.05 0.00 -0.05 0.00 0.00 57.45 55.02 2wan n PHE 810 Cb 0.33 -0.37 0.39 0.00 -0.94 0.00 0.00 39.48 38.89 2wan n PHE 810 CO 0.00 0.00 0.00 -0.22 -0.05 0.00 0.00 176.76 176.49 2wan h LYS 811 N 2.26 0.62 -0.84 -1.08 1.63 -1.34 -0.85 116.57 116.97 2wan h LYS 811 Ca 0.37 -0.04 -0.03 0.00 -0.85 0.00 0.00 60.65 60.10 2wan h LYS 811 Cb 1.34 -0.14 -0.04 0.00 -0.60 0.00 0.00 32.23 32.79 2wan h LYS 811 CO 0.84 0.41 0.39 -0.44 -3.45 0.00 0.00 179.45 177.20 2wan h ASP 812 N 0.64 1.11 -0.22 4.20 3.32 -1.87 0.10 116.42 123.70 2wan h ASP 812 Ca 0.21 -0.14 -0.02 0.00 0.02 0.00 0.00 57.03 57.10 2wan h ASP 812 Cb 0.04 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 39.29 2wan h ASP 812 CO -0.05 0.94 0.08 0.58 -1.72 0.00 0.00 179.24 179.07 2wan h VAL 813 N 1.20 1.18 -0.49 -1.35 2.07 -1.49 -0.16 116.25 117.21 2wan h VAL 813 Ca 0.29 -0.55 0.07 0.00 0.82 0.00 0.00 66.70 67.33 2wan h VAL 813 Cb 0.14 1.13 -0.06 0.00 -1.52 0.00 0.00 31.29 30.98 2wan h VAL 813 CO -0.03 0.18 0.15 0.15 0.02 0.00 0.00 177.57 178.04 2wan h PHE 814 N 0.19 0.26 -0.62 1.57 3.04 -0.74 -0.64 116.94 120.00 2wan h PHE 814 Ca 0.07 0.03 -0.05 0.00 3.98 0.00 0.00 57.97 62.00 2wan h PHE 814 Cb 0.20 -0.04 -0.03 0.00 2.56 0.00 0.00 35.95 38.64 2wan h PHE 814 CO -0.00 0.06 0.20 -0.44 -2.02 0.00 0.00 178.31 176.11 2wan h ASP 815 N 0.31 0.86 0.03 0.41 3.32 -0.60 -0.29 116.42 120.46 2wan h ASP 815 Ca 0.24 -0.14 -0.00 0.00 0.02 0.00 0.00 57.03 57.15 2wan h ASP 815 Cb 0.28 -0.22 0.00 0.00 0.22 0.00 0.00 39.33 39.61 2wan h ASP 815 CO -0.27 0.80 -0.01 0.22 -1.72 0.00 0.00 179.24 178.26 2wan h TYR 816 N 0.90 -0.03 -0.38 4.55 5.03 -0.38 0.57 116.97 127.23 2wan h TYR 816 Ca 0.20 -0.00 0.07 0.00 2.58 0.00 0.00 58.73 61.58 2wan h TYR 816 Cb 0.25 0.01 -0.06 0.00 1.55 0.00 0.00 36.73 38.48 2wan h TYR 816 CO 0.02 0.13 0.02 0.74 -1.32 0.00 0.00 178.16 177.75 2wan h PHE 817 N -0.19 0.02 -0.79 -3.82 -1.00 -0.97 -1.60 116.94 108.59 2wan h PHE 817 Ca -0.00 0.03 0.01 0.00 2.81 0.00 0.00 57.97 60.81 2wan h PHE 817 Cb 0.18 0.05 -0.04 0.00 3.61 0.00 0.00 35.95 39.75 2wan h PHE 817 CO -0.02 -0.05 0.52 1.03 -1.61 0.00 0.00 178.31 178.18 2wan h SER 818 N 0.13 0.90 -0.64 2.17 0.87 -0.89 -0.61 113.55 115.47 2wan h SER 818 Ca 0.19 -0.02 -0.09 0.00 -1.23 0.00 0.00 61.79 60.64 2wan h SER 818 Cb 0.25 -0.22 -0.02 0.00 -0.44 0.00 0.00 62.40 61.96 2wan h SER 818 CO -0.29 0.65 0.06 0.28 -0.53 0.00 0.00 176.83 177.00 2wan h SER 819 N 1.06 1.06 -0.43 6.23 0.02 -0.49 0.03 113.55 121.03 2wan h SER 819 Ca 0.29 -0.28 -0.03 0.00 -0.84 0.00 0.00 61.79 60.93 2wan h SER 819 Cb -0.11 -0.28 -0.02 0.00 0.14 0.00 0.00 62.40 62.13 2wan h SER 819 CO -0.07 1.07 0.14 0.24 -1.14 0.00 0.00 176.83 177.07 2wan h MET 820 N 1.01 0.66 -0.20 3.45 2.07 -0.96 -1.68 114.93 119.28 2wan h MET 820 Ca 0.19 -0.14 -0.03 0.00 -2.07 0.00 0.00 59.70 57.65 2wan h MET 820 Cb 0.49 -0.10 -0.01 0.00 -1.87 0.00 0.00 31.60 30.12 2wan h MET 820 CO 0.02 0.64 0.02 0.82 1.07 0.00 0.00 176.91 179.49 2wan h ILE 821 N 0.55 1.23 -0.68 -1.22 2.04 -0.80 -2.31 117.51 116.32 2wan h ILE 821 Ca 0.14 -0.78 -0.03 0.00 1.00 0.00 0.00 64.86 65.20 2wan h ILE 821 Cb 0.25 1.35 -0.03 0.00 -0.74 0.00 0.00 36.82 37.66 2wan h ILE 821 CO -0.01 0.24 0.32 0.45 0.00 0.00 0.00 178.15 179.16 2wan h HIS 822 N 0.13 0.97 0.02 1.37 3.86 -1.00 -0.87 115.15 119.62 2wan h HIS 822 Ca 0.06 -0.04 0.01 0.00 -1.16 0.00 0.00 60.37 59.24 2wan h HIS 822 Cb 0.34 -0.30 -0.02 0.00 1.06 0.00 0.00 27.41 28.49 2wan h HIS 822 CO 0.02 0.71 -0.09 1.25 0.86 0.00 0.00 177.93 180.69 2wan h LEU 823 N 0.97 -0.24 -0.68 2.43 5.85 -1.16 -1.38 115.31 121.10 2wan h LEU 823 Ca 0.24 0.03 0.07 0.00 0.84 0.00 0.00 57.88 59.06 2wan h LEU 823 Cb 0.11 0.10 -0.06 0.00 0.37 0.00 0.00 40.66 41.18 2wan h LEU 823 CO -0.03 -0.13 0.36 -0.09 -0.34 0.00 0.00 178.44 178.22 2wan h ARG 824 N -0.16 0.63 -0.21 1.25 2.43 -1.10 -1.81 114.38 115.42 2wan h ARG 824 Ca 0.03 -0.04 -0.01 0.00 -0.81 0.00 0.00 59.98 59.15 2wan h ARG 824 Cb 0.19 -0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 29.58 2wan h ARG 824 CO -0.07 0.42 0.07 -0.91 -1.51 0.00 0.00 179.97 177.97 2wan h ASN 825 N 0.65 0.26 1.18 -3.80 2.35 -0.76 -2.59 115.58 112.86 2wan h ASN 825 Ca 0.32 -0.02 0.00 0.00 -0.55 0.00 0.00 56.30 56.05 2wan h ASN 825 Cb 0.25 -0.07 0.00 0.00 0.05 0.00 0.00 38.32 38.55 2wan h ASN 825 CO -0.21 0.25 -0.57 1.56 -1.65 0.00 0.00 177.43 176.81 2wan h GLN 826 N 0.29 0.00 -3.64 0.81 1.08 -0.67 -3.44 115.11 109.54 2wan h GLN 826 Ca 0.07 0.00 -0.62 0.00 -1.45 0.00 0.00 58.65 56.65 2wan h GLN 826 Cb 0.09 0.00 -0.40 0.00 -0.05 0.00 0.00 27.48 27.11 2wan h GLN 826 CO -0.01 0.00 -0.72 -1.01 -0.95 0.00 0.00 178.83 176.14 2wan s HIS 827 N -3.23 2.54 -1.05 2.96 3.76 -0.74 -4.86 115.29 114.68 2wan s HIS 827 Ca 0.05 -2.49 0.10 0.00 -0.15 0.00 0.00 55.06 52.56 2wan s HIS 827 Cb 0.10 -2.25 0.43 0.00 1.11 0.00 0.00 32.58 31.98 2wan s HIS 827 CO 0.72 -0.85 1.31 -0.35 -0.85 0.00 0.00 174.74 174.72 2wan n PRO 828 N 4.03 0.02 0.09 8.40 -0.04 -1.26 -2.12 135.00 144.11 2wan n PRO 828 Ca 0.04 0.31 0.10 0.00 -0.04 0.00 0.00 63.50 63.92 2wan n PRO 828 Cb 0.38 -1.50 0.58 0.00 -0.04 0.00 0.00 33.50 32.92 2wan n PRO 828 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2wan h ALA 829 N 2.36 2.04 0.00 0.55 0.00 -1.78 0.46 119.26 122.90 2wan h ALA 829 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2wan h ALA 829 Cb 0.16 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.91 2wan h ALA 829 CO 0.00 -0.10 0.00 1.19 0.00 0.00 0.00 179.25 180.34 2wan n PHE 830 N -4.48 0.00 -2.61 0.00 3.72 -0.90 -3.94 117.46 109.25 2wan n PHE 830 Ca 0.03 0.00 -0.09 0.00 -0.05 0.00 0.00 57.45 57.34 2wan n PHE 830 Cb 0.24 -0.37 0.03 0.00 -0.94 0.00 0.00 39.48 38.44 2wan n PHE 830 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 176.76 177.25 2wan n ARG 831 N -1.37 2.10 -1.69 -1.08 1.74 0.15 -4.22 116.66 112.29 2wan n ARG 831 Ca 0.07 -3.67 -0.38 0.00 -0.77 0.00 0.00 57.85 53.11 2wan n ARG 831 Cb 0.18 -1.71 0.06 0.00 -1.02 0.00 0.00 32.46 29.97 2wan n ARG 831 CO 0.00 0.00 0.00 -1.33 -1.52 0.00 0.00 177.63 174.78 2wan n MET 832 N -0.47 1.17 -0.00 5.56 2.81 -1.20 -4.89 117.12 120.09 2wan n MET 832 Ca 0.18 0.45 0.06 0.00 -1.81 0.00 0.00 57.70 56.57 2wan n MET 832 Cb 0.82 -2.41 -0.08 0.00 -0.71 0.00 0.00 33.22 30.85 2wan n MET 832 CO 0.00 0.00 0.00 0.25 1.51 0.00 0.00 175.97 177.73 2wan n THR 833 N -1.64 0.00 -4.24 2.03 -2.24 -1.26 -4.75 114.28 102.18 2wan n THR 833 Ca 0.14 -0.22 -0.17 0.00 -2.27 0.00 0.00 64.05 61.52 2wan n THR 833 Cb 0.47 0.85 -0.11 0.00 -2.10 0.00 0.00 70.33 69.44 2wan n THR 833 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 2wan s THR 834 N -2.30 1.30 0.20 4.28 -4.23 -1.26 -4.40 115.64 109.23 2wan s THR 834 Ca 0.03 -1.79 -0.11 0.00 -1.18 0.00 0.00 61.69 58.64 2wan s THR 834 Cb 0.09 -1.59 0.13 0.00 1.34 0.00 0.00 72.50 72.47 2wan s THR 834 CO 0.51 -0.49 1.85 0.00 -0.54 0.00 0.00 174.62 175.95 2wan h ALA 835 N 3.35 0.89 -0.74 3.99 0.00 -1.95 -2.59 119.26 122.21 2wan h ALA 835 Ca -0.39 -0.03 0.02 0.00 0.00 0.00 0.00 54.91 54.51 2wan h ALA 835 Cb 1.20 -0.24 -0.04 0.00 0.00 0.00 0.00 17.79 18.71 2wan h ALA 835 CO 0.53 0.23 0.48 -0.44 0.00 0.00 0.00 179.25 180.06 2wan h ASP 836 N 0.87 0.82 -0.52 0.00 3.32 -1.96 -0.73 116.42 118.22 2wan h ASP 836 Ca 0.27 -0.01 0.05 0.00 0.02 0.00 0.00 57.03 57.35 2wan h ASP 836 Cb -0.02 -0.19 -0.04 0.00 0.22 0.00 0.00 39.33 39.29 2wan h ASP 836 CO -0.09 0.58 0.26 1.56 -1.72 0.00 0.00 179.24 179.84 2wan h GLN 837 N 0.97 0.50 -0.43 3.56 4.20 -1.93 -0.34 115.11 121.63 2wan h GLN 837 Ca 0.28 -0.03 -0.03 0.00 0.06 0.00 0.00 58.65 58.93 2wan h GLN 837 Cb -0.06 -0.11 -0.02 0.00 0.30 0.00 0.00 27.48 27.59 2wan h GLN 837 CO -0.08 0.33 0.13 0.82 -0.67 0.00 0.00 178.83 179.36 2wan h ILE 838 N 0.51 1.22 -0.32 2.54 2.04 -1.04 -0.36 117.51 122.10 2wan h ILE 838 Ca 0.23 -0.73 -0.04 0.00 1.00 0.00 0.00 64.86 65.31 2wan h ILE 838 Cb 0.13 0.90 -0.02 0.00 -0.74 0.00 0.00 36.82 37.09 2wan h ILE 838 CO -0.16 0.26 0.01 0.11 0.00 0.00 0.00 178.15 178.38 2wan h LYS 839 N 0.55 0.49 -0.24 2.37 1.57 -0.91 -0.56 116.57 119.84 2wan h LYS 839 Ca 0.14 -0.10 -0.20 0.00 -1.87 0.00 0.00 60.65 58.62 2wan h LYS 839 Cb 0.27 -0.08 0.00 0.00 0.08 0.00 0.00 32.23 32.51 2wan h LYS 839 CO -0.00 0.51 -0.63 0.37 -0.57 0.00 0.00 179.45 179.12 2wan h GLN 840 N 0.47 0.85 0.00 3.15 4.15 -0.70 -3.40 115.11 119.64 2wan h GLN 840 Ca 0.11 -0.59 0.00 0.00 0.77 0.00 0.00 58.65 58.93 2wan h GLN 840 Cb 0.29 0.09 0.00 0.00 0.21 0.00 0.00 27.48 28.07 2wan h GLN 840 CO 0.01 1.22 -1.13 0.09 -1.93 0.00 0.00 178.83 177.08 2wan n ASN 841 N -3.98 1.87 -4.45 -0.69 3.02 -0.18 -4.95 115.26 105.90 2wan n ASN 841 Ca -0.05 -0.26 -0.35 0.00 -0.03 0.00 0.00 54.58 53.89 2wan n ASN 841 Cb 0.67 1.31 -0.12 0.00 -0.61 0.00 0.00 39.78 41.03 2wan n ASN 841 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 2wan s LEU 842 N -3.29 3.24 -0.02 3.41 0.20 -0.24 -0.26 118.68 121.71 2wan s LEU 842 Ca -0.01 -0.19 0.03 0.00 0.69 0.00 0.00 54.13 54.65 2wan s LEU 842 Cb 0.07 -1.81 -0.00 0.00 -0.43 0.00 0.00 46.19 44.02 2wan s LEU 842 CO 0.43 0.09 -0.10 0.42 -0.29 0.00 0.00 176.35 176.89 2wan s THR 843 N 0.86 0.87 0.22 3.68 -4.23 -0.53 -4.78 115.64 111.73 2wan s THR 843 Ca 0.00 -0.43 -0.30 0.00 -1.18 0.00 0.00 61.69 59.79 2wan s THR 843 Cb -0.14 -0.75 -0.09 0.00 1.34 0.00 0.00 72.50 72.86 2wan s THR 843 CO 0.02 0.26 0.97 -0.36 -0.54 0.00 0.00 174.62 174.97 2wan s PHE 844 N 0.02 3.89 -0.03 3.99 0.08 -1.26 -0.43 117.98 124.24 2wan s PHE 844 Ca -0.01 1.86 -0.02 0.00 0.12 0.00 0.00 56.93 58.88 2wan s PHE 844 Cb -0.07 -3.05 -0.04 0.00 -0.57 0.00 0.00 43.02 39.29 2wan s PHE 844 CO 0.00 0.24 0.11 -0.51 -0.10 0.00 0.00 175.22 174.96 2wan s LEU 845 N -1.02 4.07 0.20 -0.37 1.43 0.06 -4.93 118.68 118.13 2wan s LEU 845 Ca 0.43 0.25 -0.32 0.00 -1.03 0.00 0.00 54.13 53.45 2wan s LEU 845 Cb -0.27 -2.30 -0.12 0.00 0.03 0.00 0.00 46.19 43.53 2wan s LEU 845 CO 0.33 0.30 1.72 1.21 0.23 0.00 0.00 176.35 180.14 2wan n GLU 846 N 1.31 2.74 -4.06 1.70 4.07 -1.26 -4.43 120.64 120.71 2wan n GLU 846 Ca -0.14 0.99 -0.10 0.00 -0.06 0.00 0.00 57.16 57.85 2wan n GLU 846 Cb 0.53 -2.83 -0.08 0.00 -0.06 0.00 0.00 31.44 29.01 2wan n GLU 846 CO 0.00 0.00 0.00 -1.54 -0.06 0.00 0.00 177.13 175.53 2wan s SER 847 N 1.18 0.05 0.96 4.31 1.04 -1.26 -4.64 113.70 115.34 2wan s SER 847 Ca 0.75 -1.07 -0.11 0.00 0.48 0.00 0.00 55.95 56.00 2wan s SER 847 Cb -0.52 0.46 0.17 0.00 0.10 0.00 0.00 66.02 66.23 2wan s SER 847 CO 0.33 -0.95 1.10 -2.84 0.98 0.00 0.00 173.24 171.87 2wan s PRO 848 N -4.05 0.67 0.15 4.02 0.02 -1.26 -4.87 135.00 129.68 2wan s PRO 848 Ca 0.26 1.25 -0.34 0.00 0.02 0.00 0.00 61.00 62.20 2wan s PRO 848 Cb 0.03 -1.71 -0.16 0.00 0.02 0.00 0.00 34.50 32.68 2wan s PRO 848 CO 0.07 -2.77 1.15 2.41 -0.33 0.00 0.00 177.00 177.52 2wan n THR 849 N -4.30 0.77 -3.35 0.99 -1.04 -1.26 -2.17 114.28 103.92 2wan n THR 849 Ca 0.09 -0.19 -0.21 0.00 -2.04 0.00 0.00 64.05 61.69 2wan n THR 849 Cb 0.53 -0.74 0.06 0.00 -1.82 0.00 0.00 70.33 68.36 2wan n THR 849 CO 0.00 0.00 0.00 -3.20 -0.64 0.00 0.00 175.07 171.23 2wan n ASN 850 N 2.03 -5.92 -4.15 8.00 5.15 -1.26 -5.02 115.26 114.10 2wan n ASN 850 Ca 0.16 -0.43 -0.11 0.00 -0.60 0.00 0.00 54.58 53.60 2wan n ASN 850 Cb 0.23 -4.59 -0.10 0.00 -0.53 0.00 0.00 39.78 34.79 2wan n ASN 850 CO 0.00 0.00 0.00 0.42 1.40 0.00 0.00 177.26 179.08 2wan s THR 851 N -3.25 0.68 -0.10 -0.44 -4.23 -0.92 -4.41 115.64 102.98 2wan s THR 851 Ca 0.47 -1.74 0.01 0.00 -1.18 0.00 0.00 61.69 59.25 2wan s THR 851 Cb -0.21 -1.44 0.02 0.00 1.34 0.00 0.00 72.50 72.21 2wan s THR 851 CO 0.58 -0.75 -0.11 -0.69 -0.54 0.00 0.00 174.62 173.10 2wan s VAL 852 N -3.08 1.21 -0.03 2.29 1.01 -1.09 -4.83 120.40 115.88 2wan s VAL 852 Ca 0.07 -0.46 0.02 0.00 0.00 0.00 0.00 61.98 61.61 2wan s VAL 852 Cb 0.02 -1.15 0.01 0.00 0.00 0.00 0.00 36.38 35.25 2wan s VAL 852 CO -0.03 0.39 -0.08 0.00 0.00 0.00 0.00 175.10 175.37 2wan s ALA 853 N 1.16 0.83 0.11 5.51 0.00 -1.26 -0.49 121.76 127.61 2wan s ALA 853 Ca -0.05 -0.30 -0.04 0.00 0.00 0.00 0.00 51.96 51.57 2wan s ALA 853 Cb -0.14 -0.33 -0.03 0.00 0.00 0.00 0.00 23.12 22.63 2wan s ALA 853 CO -0.03 0.12 0.10 -0.59 0.00 0.00 0.00 175.76 175.37 2wan s PHE 854 N 0.26 0.53 -0.05 0.00 -0.12 -0.02 -0.76 117.98 117.82 2wan s PHE 854 Ca -0.04 -0.96 0.04 0.00 -0.05 0.00 0.00 56.93 55.91 2wan s PHE 854 Cb -0.09 -0.28 0.00 0.00 -0.63 0.00 0.00 43.02 42.02 2wan s PHE 854 CO 0.01 -0.53 -0.16 -2.00 -0.05 0.00 0.00 175.22 172.49 2wan s GLU 855 N -3.96 1.70 -0.37 1.99 2.12 0.42 -1.26 118.70 119.34 2wan s GLU 855 Ca 0.14 -0.55 -0.11 0.00 0.36 0.00 0.00 54.97 54.82 2wan s GLU 855 Cb 0.06 -1.46 0.03 0.00 0.26 0.00 0.00 34.13 33.01 2wan s GLU 855 CO -0.04 0.19 0.20 -0.51 -0.54 0.00 0.00 175.26 174.56 2wan s LEU 856 N 0.15 4.66 0.35 2.70 1.43 0.67 -1.45 118.68 127.21 2wan s LEU 856 Ca -0.06 -0.98 0.08 0.00 -1.03 0.00 0.00 54.13 52.14 2wan s LEU 856 Cb -0.12 -2.01 -0.03 0.00 0.03 0.00 0.00 46.19 44.06 2wan s LEU 856 CO 0.02 -0.37 0.30 -0.54 0.23 0.00 0.00 176.35 176.00 2wan s LYS 857 N 1.55 2.67 -0.49 1.70 1.02 0.64 -1.01 119.74 125.82 2wan s LYS 857 Ca 0.02 -1.36 -0.01 0.00 0.02 0.00 0.00 55.97 54.64 2wan s LYS 857 Cb -0.19 -2.44 0.00 0.00 -0.52 0.00 0.00 37.83 34.68 2wan s LYS 857 CO 0.06 0.03 0.16 0.09 -0.92 0.00 0.00 175.35 174.78 2wan n ASN 858 N -1.40 -2.88 -3.85 2.83 3.02 -0.67 -2.79 115.26 109.52 2wan n ASN 858 Ca -0.01 -0.08 -0.29 0.00 -0.03 0.00 0.00 54.58 54.18 2wan n ASN 858 Cb 0.60 -1.87 0.01 0.00 -0.61 0.00 0.00 39.78 37.91 2wan n ASN 858 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 2wan n TYR 859 N -3.68 -1.73 -1.65 3.10 4.01 -0.42 -4.74 117.16 112.05 2wan n TYR 859 Ca -0.04 0.60 -0.47 0.00 -0.16 0.00 0.00 57.90 57.83 2wan n TYR 859 Cb 0.54 -3.61 -0.05 0.00 -0.31 0.00 0.00 39.34 35.92 2wan n TYR 859 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2wan n ALA 860 N -4.36 0.83 -3.87 -0.72 0.00 -1.12 -1.78 120.51 109.49 2wan n ALA 860 Ca -0.22 0.45 -0.29 0.00 0.00 0.00 0.00 53.44 53.38 2wan n ALA 860 Cb 0.65 -2.30 0.03 0.00 0.00 0.00 0.00 19.45 17.83 2wan n ALA 860 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 2wan n ASN 861 N 3.37 -5.08 -1.82 0.00 5.15 -1.26 -1.80 115.26 113.82 2wan n ASN 861 Ca 0.18 -0.74 -0.15 0.00 -0.60 0.00 0.00 54.58 53.27 2wan n ASN 861 Cb 0.27 -4.04 0.00 0.00 -0.53 0.00 0.00 39.78 35.48 2wan n ASN 861 CO 0.00 0.00 0.00 1.41 1.40 0.00 0.00 177.26 180.07 2wan n HIS 862 N -4.73 -0.93 -2.17 1.20 8.25 -0.74 -4.57 115.22 111.53 2wan n HIS 862 Ca 0.04 0.13 -0.35 0.00 -0.26 0.00 0.00 57.72 57.28 2wan n HIS 862 Cb 0.53 -3.18 0.01 0.00 1.12 0.00 0.00 29.99 28.47 2wan n HIS 862 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 2wan s ASP 863 N -2.52 5.54 0.00 0.41 -1.08 -0.75 -4.83 116.67 113.45 2wan s ASP 863 Ca 0.08 2.24 0.29 0.00 -0.52 0.00 0.00 52.55 54.64 2wan s ASP 863 Cb -0.03 -2.59 1.23 0.00 -1.46 0.00 0.00 42.92 40.07 2wan s ASP 863 CO 0.10 -1.34 1.87 0.35 0.52 0.00 0.00 175.17 176.66 2wan n THR 864 N -1.41 0.00 -3.96 1.71 -2.24 -1.26 -4.68 114.28 102.44 2wan n THR 864 Ca 0.12 -0.03 -0.35 0.00 -2.27 0.00 0.00 64.05 61.52 2wan n THR 864 Cb 0.51 -0.20 -0.11 0.00 -2.10 0.00 0.00 70.33 68.43 2wan n THR 864 CO 0.00 0.00 0.00 0.26 -0.57 0.00 0.00 175.07 174.76 2wan s TRP 865 N -2.61 3.19 0.07 4.78 0.51 -1.26 -5.03 118.94 118.60 2wan s TRP 865 Ca 0.25 -0.07 -0.31 0.00 -2.12 0.00 0.00 56.10 53.86 2wan s TRP 865 Cb 0.20 -2.12 -0.18 0.00 -0.81 0.00 0.00 33.47 30.55 2wan s TRP 865 CO 0.50 0.00 1.65 -0.22 -0.51 0.00 0.00 176.95 178.37 2wan h LYS 866 N 7.16 -0.69 -5.06 4.98 3.64 -1.85 -3.36 116.57 121.39 2wan h LYS 866 Ca -0.36 0.05 -0.53 0.00 -1.27 0.00 0.00 60.65 58.53 2wan h LYS 866 Cb 1.17 0.16 -0.32 0.00 -0.41 0.00 0.00 32.23 32.83 2wan h LYS 866 CO 0.66 -0.46 -0.83 -0.80 -2.27 0.00 0.00 179.45 175.75 2wan s ASN 867 N -4.56 1.95 -0.09 4.20 0.01 -1.26 -1.30 114.94 113.90 2wan s ASN 867 Ca -0.17 -0.32 0.04 0.00 -0.71 0.00 0.00 52.86 51.70 2wan s ASN 867 Cb 0.04 -0.61 -0.00 0.00 0.41 0.00 0.00 41.25 41.09 2wan s ASN 867 CO 0.63 0.12 -0.23 -0.63 -1.51 0.00 0.00 177.10 175.48 2wan s ILE 868 N 0.17 1.96 -0.11 0.60 1.01 -0.18 -1.12 121.20 123.54 2wan s ILE 868 Ca -0.06 -0.97 -0.01 0.00 0.00 0.00 0.00 60.65 59.61 2wan s ILE 868 Cb -0.12 -1.70 -0.02 0.00 0.01 0.00 0.00 42.46 40.63 2wan s ILE 868 CO 0.02 0.54 -0.08 -0.63 0.00 0.00 0.00 174.94 174.79 2wan s ILE 869 N 0.30 3.51 -0.04 2.92 1.01 0.17 -0.23 121.20 128.83 2wan s ILE 869 Ca -0.16 -0.52 0.05 0.00 0.00 0.00 0.00 60.65 60.02 2wan s ILE 869 Cb -0.17 -2.48 -0.01 0.00 0.01 0.00 0.00 42.46 39.81 2wan s ILE 869 CO 0.08 0.54 -0.21 -0.69 0.00 0.00 0.00 174.94 174.66 2wan s VAL 870 N -0.06 1.72 -0.05 2.92 1.01 -0.39 -0.95 120.40 124.60 2wan s VAL 870 Ca -0.00 -0.89 0.00 0.00 0.00 0.00 0.00 61.98 61.09 2wan s VAL 870 Cb -0.14 -1.46 0.02 0.00 0.00 0.00 0.00 36.38 34.81 2wan s VAL 870 CO 0.03 0.49 -0.03 -0.32 0.00 0.00 0.00 175.10 175.27 2wan s MET 871 N -0.14 0.66 -0.23 2.72 0.00 -0.26 -0.84 119.30 121.21 2wan s MET 871 Ca -0.01 -0.02 -0.14 0.00 0.00 0.00 0.00 55.69 55.51 2wan s MET 871 Cb -0.12 -0.77 -0.04 0.00 0.00 0.00 0.00 34.83 33.90 2wan s MET 871 CO 0.02 -0.13 0.33 0.71 0.00 0.00 0.00 175.02 175.95 2wan s TYR 872 N 1.12 3.32 -0.46 4.11 2.02 0.36 -0.50 117.35 127.32 2wan s TYR 872 Ca -0.08 0.46 0.03 0.00 -0.37 0.00 0.00 57.07 57.11 2wan s TYR 872 Cb -0.14 -2.48 0.12 0.00 -0.40 0.00 0.00 41.96 39.07 2wan s TYR 872 CO -0.01 -0.06 0.20 1.21 -1.57 0.00 0.00 175.55 175.32 2wan s ASN 873 N 1.23 4.64 0.00 2.29 2.47 0.27 -2.67 114.94 123.16 2wan s ASN 873 Ca 0.15 -2.64 0.30 0.00 0.42 0.00 0.00 52.86 51.09 2wan s ASN 873 Cb -0.15 -1.67 1.41 0.00 -1.45 0.00 0.00 41.25 39.39 2wan s ASN 873 CO 0.08 -0.32 2.00 -0.81 -3.72 0.00 0.00 177.10 174.33 2wan n PRO 874 N 3.64 0.26 -1.88 0.43 -0.04 -1.26 -1.25 135.00 134.91 2wan n PRO 874 Ca 0.04 0.00 -0.32 0.00 -0.04 0.00 0.00 63.50 63.19 2wan n PRO 874 Cb 0.37 -1.50 0.02 0.00 -0.04 0.00 0.00 33.50 32.35 2wan n PRO 874 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 2wan s ASN 875 N -2.74 5.79 0.00 3.54 0.01 -1.26 -4.45 114.94 115.83 2wan s ASN 875 Ca 0.23 1.65 0.31 0.00 -0.71 0.00 0.00 52.86 54.34 2wan s ASN 875 Cb 0.20 -2.51 1.75 0.00 0.41 0.00 0.00 41.25 41.10 2wan s ASN 875 CO 0.49 -1.17 2.15 0.29 -1.51 0.00 0.00 177.10 177.35 2wan n LYS 876 N -2.51 0.89 -4.44 -0.60 5.02 -1.26 -1.42 118.16 113.84 2wan n LYS 876 Ca 0.08 -0.06 -0.24 0.00 -2.02 0.00 0.00 58.31 56.07 2wan n LYS 876 Cb 0.53 -1.50 -0.11 0.00 -0.02 0.00 0.00 35.03 33.94 2wan n LYS 876 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 2wan s THR 877 N -2.15 2.36 0.68 -0.18 -4.23 -1.26 -4.81 115.64 106.05 2wan s THR 877 Ca 0.42 -2.27 -0.16 0.00 -1.18 0.00 0.00 61.69 58.50 2wan s THR 877 Cb 0.21 -2.21 0.01 0.00 1.34 0.00 0.00 72.50 71.85 2wan s THR 877 CO 0.39 -0.34 1.19 -0.94 -0.54 0.00 0.00 174.62 174.38 2wan s SER 878 N -3.24 4.66 0.05 3.99 1.04 -1.26 -4.22 113.70 114.72 2wan s SER 878 Ca 0.26 2.30 0.03 0.00 0.48 0.00 0.00 55.95 59.02 2wan s SER 878 Cb -0.05 -2.58 -0.02 0.00 0.10 0.00 0.00 66.02 63.46 2wan s SER 878 CO 0.13 -1.95 -0.08 -1.10 0.98 0.00 0.00 173.24 171.22 2wan s GLN 879 N -3.77 0.56 0.06 4.02 -1.52 -0.64 -4.93 119.66 113.44 2wan s GLN 879 Ca 0.74 -0.78 0.04 0.00 -1.95 0.00 0.00 55.36 53.41 2wan s GLN 879 Cb -0.28 -0.35 -0.04 0.00 -0.22 0.00 0.00 33.01 32.13 2wan s GLN 879 CO 0.41 0.06 -0.00 0.95 -0.25 0.00 0.00 175.29 176.46 2wan s THR 880 N -1.37 4.04 -0.09 -0.19 -4.23 -1.26 0.18 115.64 112.71 2wan s THR 880 Ca -0.09 -0.87 0.03 0.00 -1.18 0.00 0.00 61.69 59.58 2wan s THR 880 Cb -0.10 -2.88 0.01 0.00 1.34 0.00 0.00 72.50 70.86 2wan s THR 880 CO 0.01 0.20 -0.18 -0.22 -0.54 0.00 0.00 174.62 173.89 2wan s LEU 881 N -2.06 1.86 0.10 4.79 2.96 0.19 -4.47 118.68 122.05 2wan s LEU 881 Ca 0.24 -0.45 -0.30 0.00 -0.22 0.00 0.00 54.13 53.40 2wan s LEU 881 Cb -0.12 -1.15 -0.06 0.00 0.50 0.00 0.00 46.19 45.37 2wan s LEU 881 CO 0.16 0.08 1.08 0.20 -1.32 0.00 0.00 176.35 176.55 2wan s ASN 882 N 0.64 7.27 0.06 3.68 0.01 -1.26 -1.43 114.94 123.92 2wan s ASN 882 Ca -0.14 1.94 0.02 0.00 -0.71 0.00 0.00 52.86 53.97 2wan s ASN 882 Cb -0.16 -2.59 -0.04 0.00 0.41 0.00 0.00 41.25 38.87 2wan s ASN 882 CO 0.04 -0.27 0.12 -0.76 -1.51 0.00 0.00 177.10 174.71 2wan s LEU 883 N 0.35 3.97 1.13 0.60 1.43 0.70 -4.95 118.68 121.92 2wan s LEU 883 Ca 0.52 0.09 -0.12 0.00 -1.03 0.00 0.00 54.13 53.58 2wan s LEU 883 Cb -0.27 -2.59 0.26 0.00 0.03 0.00 0.00 46.19 43.63 2wan s LEU 883 CO 0.31 0.18 1.04 -2.84 0.23 0.00 0.00 176.35 175.28 2wan s PRO 884 N -2.34 -0.65 0.80 1.29 0.02 -1.26 -4.66 135.00 128.20 2wan s PRO 884 Ca 0.30 0.90 -0.14 0.00 0.02 0.00 0.00 61.00 62.07 2wan s PRO 884 Cb -0.12 -1.58 0.04 0.00 0.02 0.00 0.00 34.50 32.86 2wan s PRO 884 CO 0.23 -3.56 0.90 -1.13 -0.33 0.00 0.00 177.00 173.11 2wan n SER 885 N -4.81 -0.00 0.00 2.53 3.41 -1.26 -4.65 113.62 108.84 2wan n SER 885 Ca 0.04 0.56 0.00 0.00 -0.26 0.00 0.00 58.87 59.21 2wan n SER 885 Cb 0.54 -1.39 0.00 0.00 -0.26 0.00 0.00 64.21 63.11 2wan n SER 885 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2wan n GLY 886 N 1.00 0.46 3.71 5.00 0.00 -1.26 -4.94 105.19 109.16 2wan n GLY 886 Ca 0.12 -2.05 -0.41 0.00 0.00 0.00 0.00 46.02 43.67 2wan n GLY 886 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2wan s ASP 887 N -0.22 7.26 -0.11 1.61 -1.08 -1.26 -4.56 116.67 118.32 2wan s ASP 887 Ca 0.00 1.53 -0.00 0.00 -0.52 0.00 0.00 52.55 53.56 2wan s ASP 887 Cb 0.00 -2.53 -0.02 0.00 -1.46 0.00 0.00 42.92 38.91 2wan s ASP 887 CO 0.00 -0.23 -0.10 0.26 0.52 0.00 0.00 175.17 175.62 2wan s TRP 888 N 1.02 2.86 -0.24 -5.34 0.52 0.09 -4.69 118.94 113.15 2wan s TRP 888 Ca 0.48 -0.33 -0.13 0.00 0.02 0.00 0.00 56.10 56.13 2wan s TRP 888 Cb -0.20 -1.80 -0.04 0.00 -1.15 0.00 0.00 33.47 30.28 2wan s TRP 888 CO 0.25 0.02 0.30 0.99 0.02 0.00 0.00 176.95 178.52 2wan s THR 889 N -0.10 5.25 -0.11 2.01 2.01 0.32 -0.88 115.64 124.14 2wan s THR 889 Ca -0.00 0.45 -0.30 0.00 0.31 0.00 0.00 61.69 62.15 2wan s THR 889 Cb -0.13 -3.63 -0.02 0.00 0.01 0.00 0.00 72.50 68.73 2wan s THR 889 CO 0.03 0.25 1.11 -0.63 -0.69 0.00 0.00 174.62 174.70 2wan s ILE 890 N 1.49 4.51 -0.02 1.82 1.01 0.14 -0.79 121.20 129.37 2wan s ILE 890 Ca 0.13 1.81 0.01 0.00 0.00 0.00 0.00 60.65 62.60 2wan s ILE 890 Cb -0.15 -4.17 -0.01 0.00 0.01 0.00 0.00 42.46 38.14 2wan s ILE 890 CO 0.08 -0.04 0.03 1.33 0.00 0.00 0.00 174.94 176.33 2wan n VAL 891 N 4.78 0.00 -3.73 2.92 0.24 -0.29 -0.29 118.33 121.97 2wan n VAL 891 Ca 0.11 -0.22 -0.24 0.00 -2.04 0.00 0.00 64.34 61.95 2wan n VAL 891 Cb 0.47 0.70 -0.17 0.00 -1.47 0.00 0.00 33.84 33.37 2wan n VAL 891 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 2wan s GLY 892 N -1.66 0.45 -0.17 7.63 0.00 -0.48 -1.68 107.32 111.42 2wan s GLY 892 Ca -0.00 -0.18 -0.07 0.00 0.00 0.00 0.00 44.72 44.47 2wan s GLY 892 CO 0.03 1.31 0.36 -2.27 0.00 0.00 0.00 173.10 172.53 2wan s LEU 893 N 2.01 -0.38 0.00 0.66 2.96 -0.11 -0.84 118.68 122.98 2wan s LEU 893 Ca 0.04 0.83 0.00 0.00 -0.22 0.00 0.00 54.13 54.78 2wan s LEU 893 Cb -0.13 1.12 0.00 0.00 0.50 0.00 0.00 46.19 47.68 2wan s LEU 893 CO -0.06 -0.22 0.00 0.61 -1.32 0.00 0.00 176.35 175.36 2wan n GLY 894 N 5.11 3.66 0.28 7.98 0.00 -1.26 -1.73 105.19 119.22 2wan n GLY 894 Ca -0.11 0.01 0.09 0.00 0.00 0.00 0.00 46.02 46.00 2wan n GLY 894 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2wan n ASP 895 N 5.57 0.82 -4.30 1.61 5.68 -1.26 -4.75 116.55 119.93 2wan n ASP 895 Ca 0.00 -1.64 -0.35 0.00 -0.50 0.00 0.00 54.79 52.30 2wan n ASP 895 Cb 0.00 -0.06 -0.14 0.00 -1.14 0.00 0.00 41.12 39.78 2wan n ASP 895 CO 0.00 0.00 0.00 -1.10 -1.33 0.00 0.00 177.20 174.77 2wan s GLN 896 N -1.88 3.24 -0.04 0.11 -0.21 -0.71 -4.89 119.66 115.29 2wan s GLN 896 Ca 0.27 -0.72 0.03 0.00 0.02 0.00 0.00 55.36 54.96 2wan s GLN 896 Cb 0.13 -3.07 0.00 0.00 1.00 0.00 0.00 33.01 31.08 2wan s GLN 896 CO 0.21 -0.27 -0.12 0.42 -2.12 0.00 0.00 175.29 173.41 2wan s ILE 897 N 1.46 1.04 0.00 1.08 -1.09 -1.26 -0.93 121.20 121.49 2wan s ILE 897 Ca 0.04 -0.49 0.00 0.00 -2.23 0.00 0.00 60.65 57.97 2wan s ILE 897 Cb -0.15 -0.92 0.00 0.00 -1.58 0.00 0.00 42.46 39.81 2wan s ILE 897 CO -0.02 0.32 0.00 0.61 -1.23 0.00 0.00 174.94 174.61 2wan n GLY 898 N 3.34 0.59 0.07 6.18 0.00 -0.67 -4.84 105.19 109.86 2wan n GLY 898 Ca -0.19 -0.68 0.11 0.00 0.00 0.00 0.00 46.02 45.26 2wan n GLY 898 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2wan n GLU 899 N 0.00 0.18 -3.85 1.61 -0.58 -1.26 -4.70 120.64 112.03 2wan n GLU 899 Ca 0.00 -0.13 -0.30 0.00 -0.42 0.00 0.00 57.16 56.31 2wan n GLU 899 Cb 0.00 -1.50 -0.04 0.00 -0.57 0.00 0.00 31.44 29.33 2wan n GLU 899 CO 0.00 0.00 0.00 0.15 -0.48 0.00 0.00 177.13 176.80 2wan s LYS 900 N -2.91 3.48 0.15 3.49 1.02 -1.26 -5.05 119.74 118.67 2wan s LYS 900 Ca 0.11 -0.39 -0.31 0.00 0.02 0.00 0.00 55.97 55.40 2wan s LYS 900 Cb 0.17 -2.97 -0.10 0.00 -0.52 0.00 0.00 37.83 34.41 2wan s LYS 900 CO 0.75 0.55 1.61 0.45 -0.92 0.00 0.00 175.35 177.79 2wan s SER 901 N -2.68 6.55 0.00 2.83 0.15 -1.26 -4.51 113.70 114.79 2wan s SER 901 Ca 0.36 2.63 0.18 0.00 0.70 0.00 0.00 55.95 59.83 2wan s SER 901 Cb -0.12 -2.59 0.41 0.00 -1.71 0.00 0.00 66.02 62.01 2wan s SER 901 CO 0.28 -0.86 1.34 0.18 1.20 0.00 0.00 173.24 175.37 2wan n LEU 902 N 4.32 3.29 0.00 3.45 4.77 0.60 -5.02 117.00 128.41 2wan n LEU 902 Ca 0.15 -1.72 0.00 0.00 -0.03 0.00 0.00 56.01 54.41 2wan n LEU 902 Cb 0.38 -0.28 0.00 0.00 -2.33 0.00 0.00 43.42 41.19 2wan n LEU 902 CO 0.62 0.77 0.00 0.61 -1.33 0.00 0.00 177.39 178.06 2wan n GLY 903 N 1.18 4.20 3.49 -0.72 0.00 -1.26 -4.91 105.19 107.18 2wan n GLY 903 Ca 0.17 -1.57 -0.31 0.00 0.00 0.00 0.00 46.02 44.31 2wan n GLY 903 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2wan s HIS 904 N -2.18 2.66 0.04 1.61 3.76 -1.26 -0.68 115.29 119.24 2wan s HIS 904 Ca 0.00 -0.19 -0.03 0.00 -0.15 0.00 0.00 55.06 54.69 2wan s HIS 904 Cb 0.00 -1.52 -0.02 0.00 1.11 0.00 0.00 32.58 32.15 2wan s HIS 904 CO 0.00 0.27 0.02 0.14 -0.85 0.00 0.00 174.74 174.33 2wan s VAL 905 N -0.92 0.17 0.07 -0.90 -7.23 -0.06 -4.98 120.40 106.54 2wan s VAL 905 Ca 0.15 -1.39 0.05 0.00 -1.81 0.00 0.00 61.98 58.98 2wan s VAL 905 Cb -0.11 -1.09 -0.03 0.00 0.56 0.00 0.00 36.38 35.71 2wan s VAL 905 CO 0.05 -0.77 -0.14 -0.04 -0.31 0.00 0.00 175.10 173.90 2wan s MET 906 N -3.08 0.83 0.00 4.82 -1.94 -1.26 -0.73 119.30 117.93 2wan s MET 906 Ca -0.01 -0.98 0.00 0.00 -1.71 0.00 0.00 55.69 53.00 2wan s MET 906 Cb 0.02 -0.83 0.00 0.00 2.01 0.00 0.00 34.83 36.03 2wan s MET 906 CO -0.07 0.18 0.00 0.41 -0.01 0.00 0.00 175.02 175.53 2wan n GLY 907 N 1.22 1.90 3.30 -0.03 0.00 -1.26 -4.83 105.19 105.48 2wan n GLY 907 Ca -0.21 -0.22 -0.14 0.00 0.00 0.00 0.00 46.02 45.46 2wan n GLY 907 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2wan s ASN 908 N 0.00 -0.27 -0.05 1.61 2.47 -1.26 -0.21 114.94 117.23 2wan s ASN 908 Ca 0.00 0.12 -0.10 0.00 0.42 0.00 0.00 52.86 53.29 2wan s ASN 908 Cb 0.00 0.38 0.02 0.00 -1.45 0.00 0.00 41.25 40.20 2wan s ASN 908 CO 0.00 -0.55 0.25 0.54 -3.72 0.00 0.00 177.10 173.62 2wan s VAL 909 N -1.75 0.04 -0.14 -5.21 0.11 -0.51 -4.93 120.40 108.00 2wan s VAL 909 Ca -0.10 -0.31 -0.13 0.00 -2.93 0.00 0.00 61.98 58.51 2wan s VAL 909 Cb -0.03 -0.46 -0.05 0.00 -1.53 0.00 0.00 36.38 34.31 2wan s VAL 909 CO 0.02 -0.17 0.27 -1.58 -3.33 0.00 0.00 175.10 170.32 2wan s GLN 910 N -0.68 4.11 -0.27 1.54 0.74 -1.26 -0.63 119.66 123.21 2wan s GLN 910 Ca -0.08 0.08 -0.06 0.00 0.05 0.00 0.00 55.36 55.35 2wan s GLN 910 Cb -0.04 -3.37 -0.01 0.00 1.10 0.00 0.00 33.01 30.69 2wan s GLN 910 CO 0.02 0.36 0.05 0.08 -0.55 0.00 0.00 175.29 175.25 2wan s VAL 911 N 0.09 3.94 0.84 1.34 1.01 0.13 -4.96 120.40 122.79 2wan s VAL 911 Ca 0.16 -0.50 -0.13 0.00 0.00 0.00 0.00 61.98 61.51 2wan s VAL 911 Cb -0.13 -2.93 0.07 0.00 0.00 0.00 0.00 36.38 33.38 2wan s VAL 911 CO 0.04 0.23 0.93 -2.65 0.00 0.00 0.00 175.10 173.65 2wan n PRO 912 N 4.87 -0.00 -1.61 2.72 -0.02 -1.26 -1.62 135.00 138.08 2wan n PRO 912 Ca -0.16 0.07 -0.42 0.00 -2.02 0.00 0.00 63.50 60.97 2wan n PRO 912 Cb 0.50 -2.22 0.01 0.00 -0.02 0.00 0.00 33.50 31.77 2wan n PRO 912 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2wan n ALA 913 N -3.37 0.13 -3.96 3.55 0.00 -1.26 -3.46 120.51 112.14 2wan n ALA 913 Ca 0.11 0.25 -0.39 0.00 0.00 0.00 0.00 53.44 53.42 2wan n ALA 913 Cb 0.51 -2.07 0.02 0.00 0.00 0.00 0.00 19.45 17.91 2wan n ALA 913 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 2wan n ILE 914 N -0.37 -3.21 -3.94 0.00 5.41 -0.51 -4.95 119.36 111.79 2wan n ILE 914 Ca 0.09 -0.45 -0.10 0.00 1.00 0.00 0.00 62.75 63.30 2wan n ILE 914 Cb 0.38 -2.68 -0.03 0.00 -0.71 0.00 0.00 39.64 36.61 2wan n ILE 914 CO 0.00 0.00 0.00 -0.94 0.00 0.00 0.00 176.55 175.61 2wan s SER 915 N -3.36 0.10 -0.11 4.38 1.04 -0.38 -4.72 113.70 110.65 2wan s SER 915 Ca 0.34 -1.03 0.02 0.00 0.48 0.00 0.00 55.95 55.77 2wan s SER 915 Cb -0.18 0.69 -0.01 0.00 0.10 0.00 0.00 66.02 66.62 2wan s SER 915 CO 0.94 -1.34 -0.20 -0.89 0.98 0.00 0.00 173.24 172.73 2wan s THR 916 N -3.41 2.44 -0.14 2.02 2.01 -1.26 -0.56 115.64 116.74 2wan s THR 916 Ca 0.20 -0.88 -0.10 0.00 0.31 0.00 0.00 61.69 61.22 2wan s THR 916 Cb -0.03 -1.97 -0.05 0.00 0.01 0.00 0.00 72.50 70.47 2wan s THR 916 CO 0.11 0.55 0.19 -0.22 -0.69 0.00 0.00 174.62 174.56 2wan s LEU 917 N 0.34 4.33 -0.07 4.42 2.96 0.34 -4.28 118.68 126.72 2wan s LEU 917 Ca -0.16 0.46 0.02 0.00 -0.22 0.00 0.00 54.13 54.23 2wan s LEU 917 Cb -0.17 -2.17 0.02 0.00 0.50 0.00 0.00 46.19 44.36 2wan s LEU 917 CO 0.08 0.29 -0.10 -0.63 -1.32 0.00 0.00 176.35 174.67 2wan s ILE 918 N -0.44 1.03 0.20 6.68 1.01 -0.02 -1.10 121.20 128.56 2wan s ILE 918 Ca 0.14 -0.40 0.08 0.00 0.00 0.00 0.00 60.65 60.47 2wan s ILE 918 Cb -0.12 -0.97 -0.05 0.00 0.01 0.00 0.00 42.46 41.34 2wan s ILE 918 CO 0.03 0.34 -0.15 -0.76 0.00 0.00 0.00 174.94 174.40 2wan s LEU 919 N 0.84 2.53 0.08 2.97 1.43 -0.12 -1.13 118.68 125.26 2wan s LEU 919 Ca -0.12 -0.98 -0.05 0.00 -1.03 0.00 0.00 54.13 51.95 2wan s LEU 919 Cb -0.15 -0.71 -0.02 0.00 0.03 0.00 0.00 46.19 45.34 2wan s LEU 919 CO 0.02 -0.14 0.10 -1.59 0.23 0.00 0.00 176.35 174.97 2wan s LYS 920 N -3.44 0.76 0.00 1.70 0.00 0.03 -0.66 119.74 118.14 2wan s LYS 920 Ca 0.21 -1.09 0.00 0.00 0.00 0.00 0.00 55.97 55.09 2wan s LYS 920 Cb -0.02 0.29 0.00 0.00 0.00 0.00 0.00 37.83 38.10 2wan s LYS 920 CO 0.07 -0.21 0.06 0.94 0.00 0.00 0.00 175.35 176.22