#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qsh h ALA 124 N 0.00 0.83 0.00 -1.67 0.00 -2.05 -2.89 119.26 113.48 2qsh h ALA 124 Ca 0.00 -0.39 -0.03 0.00 0.00 0.00 0.00 54.91 54.49 2qsh h ALA 124 Cb 0.00 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 17.64 2qsh h ALA 124 CO 0.00 0.64 -0.13 0.07 0.00 0.00 0.00 179.25 179.83 2qsh h ARG 125 N 0.66 0.00 -0.19 0.00 0.11 -2.05 -0.02 114.38 112.89 2qsh h ARG 125 Ca 0.08 0.00 -0.10 0.00 0.10 0.00 0.00 59.98 60.06 2qsh h ARG 125 Cb 0.79 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 31.87 2qsh h ARG 125 CO 0.07 0.13 -0.26 0.00 0.10 0.00 0.00 179.97 180.00 2qsh h ARG 126 N 0.00 0.52 0.00 0.08 2.47 -1.94 -2.65 114.38 112.85 2qsh h ARG 126 Ca -0.00 -0.30 -0.22 0.00 -1.26 0.00 0.00 59.98 58.20 2qsh h ARG 126 Cb 0.35 0.02 -0.03 0.00 -1.65 0.00 0.00 29.97 28.66 2qsh h ARG 126 CO 0.02 0.89 -1.05 1.15 0.56 0.00 0.00 179.97 181.54 2qsh h THR 127 N 0.18 1.63 -0.14 2.04 2.02 -1.45 -2.34 112.91 114.86 2qsh h THR 127 Ca 0.02 -3.35 0.02 0.00 0.77 0.00 0.00 66.41 63.88 2qsh h THR 127 Cb 0.83 2.81 -0.02 0.00 -1.74 0.00 0.00 68.15 70.03 2qsh h THR 127 CO 0.06 0.93 -0.01 0.28 0.37 0.00 0.00 175.52 177.15 2qsh h SER 128 N 0.00 -0.08 -0.43 4.18 0.02 -1.08 -1.87 113.55 114.29 2qsh h SER 128 Ca -0.03 0.03 0.09 0.00 -0.84 0.00 0.00 61.79 61.04 2qsh h SER 128 Cb 1.78 0.06 -0.09 0.00 0.14 0.00 0.00 62.40 64.30 2qsh h SER 128 CO 0.12 -0.02 -0.17 0.03 -1.14 0.00 0.00 176.83 175.65 2qsh h ARG 129 N 0.03 -0.08 -5.49 3.45 2.47 -1.47 -3.47 114.38 109.83 2qsh h ARG 129 Ca 0.07 0.01 -0.42 0.00 -1.26 0.00 0.00 59.98 58.37 2qsh h ARG 129 Cb 0.09 0.02 0.06 0.00 -1.65 0.00 0.00 29.97 28.49 2qsh h ARG 129 CO -0.12 -0.05 -0.66 -1.71 0.56 0.00 0.00 179.97 177.98 2qsh n ASN 130 N -5.37 -5.79 -4.18 7.04 5.15 -0.71 -5.01 115.26 106.39 2qsh n ASN 130 Ca 0.03 -0.50 -0.32 0.00 -0.60 0.00 0.00 54.58 53.19 2qsh n ASN 130 Cb 0.28 -4.62 -0.17 0.00 -0.53 0.00 0.00 39.78 34.74 2qsh n ASN 130 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 2qsh s VAL 131 N -3.24 2.02 0.93 3.44 1.01 -1.26 -3.11 120.40 120.19 2qsh s VAL 131 Ca 0.50 -0.97 -0.12 0.00 0.00 0.00 0.00 61.98 61.39 2qsh s VAL 131 Cb -0.23 -1.77 0.15 0.00 0.00 0.00 0.00 36.38 34.53 2qsh s VAL 131 CO 0.62 0.55 1.13 0.00 0.00 0.00 0.00 175.10 177.40 2qsh s SER 133 N -3.94 2.73 0.29 0.00 1.04 -1.26 -4.85 113.70 107.72 2qsh s SER 133 Ca 0.64 1.56 0.01 0.00 0.48 0.00 0.00 55.95 58.65 2qsh s SER 133 Cb -0.15 -2.22 0.44 0.00 0.10 0.00 0.00 66.02 64.19 2qsh s SER 133 CO 0.54 -3.11 1.78 -1.13 0.98 0.00 0.00 173.24 172.29 2qsh h ASN 134 N -1.88 0.58 -0.38 7.02 -1.24 -2.00 -1.96 115.58 115.72 2qsh h ASN 134 Ca -0.52 -0.15 0.05 0.00 0.71 0.00 0.00 56.30 56.39 2qsh h ASN 134 Cb 1.30 -0.15 -0.05 0.00 0.73 0.00 0.00 38.32 40.15 2qsh h ASN 134 CO 0.52 0.72 0.11 -0.33 -1.29 0.00 0.00 177.43 177.16 2qsh h GLU 135 N 0.55 0.25 -0.66 6.67 5.08 -2.00 -2.25 114.58 122.22 2qsh h GLU 135 Ca 0.10 -0.01 -0.01 0.00 -1.00 0.00 0.00 59.36 58.43 2qsh h GLU 135 Cb 0.50 -0.06 -0.03 0.00 0.50 0.00 0.00 28.75 29.66 2qsh h GLU 135 CO 0.03 0.16 0.35 0.93 -1.00 0.00 0.00 179.01 179.49 2qsh h GLU 136 N 0.25 0.92 -0.40 2.33 4.39 -1.84 -1.40 114.58 118.83 2qsh h GLU 136 Ca 0.18 -0.11 0.08 0.00 0.34 0.00 0.00 59.36 59.85 2qsh h GLU 136 Cb 0.18 -0.18 -0.09 0.00 -0.10 0.00 0.00 28.75 28.56 2qsh h GLU 136 CO -0.21 0.70 -0.34 0.00 -1.16 0.00 0.00 179.01 178.01 2qsh h ARG 137 N 0.90 -0.25 -0.59 2.33 3.08 -0.88 0.24 114.38 119.21 2qsh h ARG 137 Ca 0.23 0.02 -0.07 0.00 0.07 0.00 0.00 59.98 60.22 2qsh h ARG 137 Cb 0.05 0.06 -0.02 0.00 0.08 0.00 0.00 29.97 30.13 2qsh h ARG 137 CO -0.04 -0.17 0.08 0.87 -1.07 0.00 0.00 179.97 179.65 2qsh h LYS 138 N -0.26 0.98 -0.82 0.04 1.57 -1.23 -1.17 116.57 115.68 2qsh h LYS 138 Ca 0.17 -0.27 -0.01 0.00 -1.87 0.00 0.00 60.65 58.67 2qsh h LYS 138 Cb 0.54 -0.11 -0.04 0.00 0.08 0.00 0.00 32.23 32.70 2qsh h LYS 138 CO -0.55 0.93 0.47 -0.09 -0.57 0.00 0.00 179.45 179.65 2qsh h ARG 139 N 0.88 1.12 -0.39 3.15 2.43 -0.63 -0.60 114.38 120.33 2qsh h ARG 139 Ca 0.18 -0.11 -0.13 0.00 -0.81 0.00 0.00 59.98 59.11 2qsh h ARG 139 Cb 0.44 -0.23 -0.01 0.00 -0.42 0.00 0.00 29.97 29.75 2qsh h ARG 139 CO 0.01 0.80 -0.26 0.00 -1.51 0.00 0.00 179.97 179.02 2qsh h ARG 140 N 1.13 0.81 -0.31 0.20 3.08 -0.19 -0.21 114.38 118.89 2qsh h ARG 140 Ca 0.29 -0.35 -0.02 0.00 0.07 0.00 0.00 59.98 59.97 2qsh h ARG 140 Cb -0.01 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.00 2qsh h ARG 140 CO -0.05 0.98 0.11 -0.22 -1.07 0.00 0.00 179.97 179.71 2qsh h LYS 141 N 0.70 0.48 -0.13 0.04 3.64 -0.59 0.34 116.57 121.05 2qsh h LYS 141 Ca 0.09 -0.10 -0.01 0.00 -1.27 0.00 0.00 60.65 59.36 2qsh h LYS 141 Cb 0.79 -0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 32.54 2qsh h LYS 141 CO 0.07 0.51 0.04 -0.92 -2.27 0.00 0.00 179.45 176.88 2qsh h TYR 142 N 0.35 0.21 -0.68 1.91 3.20 -1.07 -2.61 116.97 118.29 2qsh h TYR 142 Ca 0.10 -0.02 -0.00 0.00 3.14 0.00 0.00 58.73 61.95 2qsh h TYR 142 Cb 0.23 -0.06 -0.03 0.00 1.54 0.00 0.00 36.73 38.40 2qsh h TYR 142 CO 0.00 0.34 0.41 0.35 -1.64 0.00 0.00 178.16 177.63 2qsh h PHE 143 N 0.02 0.88 -0.06 -3.82 3.57 -0.92 -1.18 116.94 115.43 2qsh h PHE 143 Ca 0.04 0.01 0.03 0.00 3.53 0.00 0.00 57.97 61.58 2qsh h PHE 143 Cb 0.23 -0.29 -0.04 0.00 2.79 0.00 0.00 35.95 38.64 2qsh h PHE 143 CO 0.00 0.58 -0.15 1.25 -2.23 0.00 0.00 178.31 177.76 2qsh h HIS 144 N 0.93 -0.38 0.62 0.41 2.76 -0.81 -0.95 115.15 117.72 2qsh h HIS 144 Ca 0.24 0.02 -0.02 0.00 -2.20 0.00 0.00 60.37 58.41 2qsh h HIS 144 Cb -0.05 0.18 -0.01 0.00 1.55 0.00 0.00 27.41 29.08 2qsh h HIS 144 CO 0.00 -0.22 -0.48 0.52 -1.30 0.00 0.00 177.93 176.46 2qsh h MET 145 N -0.22 -1.02 -0.69 5.26 2.86 -0.98 0.11 114.93 120.24 2qsh h MET 145 Ca 0.07 0.07 0.15 0.00 -2.06 0.00 0.00 59.70 57.93 2qsh h MET 145 Cb 0.32 0.23 -0.12 0.00 0.06 0.00 0.00 31.60 32.09 2qsh h MET 145 CO -0.19 -0.68 -0.01 1.25 1.06 0.00 0.00 176.91 178.34 2qsh h LEU 146 N -1.06 -0.33 -0.11 1.22 6.46 -1.16 0.76 115.31 121.09 2qsh h LEU 146 Ca -0.08 0.18 -0.01 0.00 -0.12 0.00 0.00 57.88 57.85 2qsh h LEU 146 Cb 0.89 0.32 -0.00 0.00 -0.73 0.00 0.00 40.66 41.13 2qsh h LEU 146 CO 0.02 -0.15 0.03 0.22 -0.62 0.00 0.00 178.44 177.94 2qsh h TYR 147 N 0.10 0.17 -0.28 1.25 3.20 -1.00 -2.28 116.97 118.14 2qsh h TYR 147 Ca 0.37 -0.02 0.07 0.00 3.14 0.00 0.00 58.73 62.29 2qsh h TYR 147 Cb 0.62 -0.05 -0.07 0.00 1.54 0.00 0.00 36.73 38.77 2qsh h TYR 147 CO -0.41 0.31 -0.20 1.25 -1.64 0.00 0.00 178.16 177.47 2qsh h LEU 148 N -0.01 -0.65 -0.47 2.82 6.46 0.97 -1.36 115.31 123.08 2qsh h LEU 148 Ca 0.04 0.13 0.07 0.00 -0.12 0.00 0.00 57.88 58.00 2qsh h LEU 148 Cb 0.21 0.33 -0.06 0.00 -0.73 0.00 0.00 40.66 40.41 2qsh h LEU 148 CO -0.00 -0.24 0.13 0.58 -0.62 0.00 0.00 178.44 178.30 2qsh h VAL 149 N -0.18 0.79 -0.58 1.05 2.07 -0.79 0.87 116.25 119.49 2qsh h VAL 149 Ca 0.15 -0.10 0.00 0.00 0.82 0.00 0.00 66.70 67.58 2qsh h VAL 149 Cb 0.41 0.48 -0.03 0.00 -1.52 0.00 0.00 31.29 30.63 2qsh h VAL 149 CO -0.39 0.05 0.38 0.00 0.02 0.00 0.00 177.57 177.63 2qsh h LEU 151 N 0.78 0.55 -0.83 0.00 3.38 -0.47 0.13 115.31 118.86 2qsh h LEU 151 Ca 0.21 -0.12 -0.07 0.00 0.09 0.00 0.00 57.88 57.99 2qsh h LEU 151 Cb -0.08 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 40.51 2qsh h LEU 151 CO -0.04 0.52 0.08 0.24 0.09 0.00 0.00 178.44 179.33 2qsh h MET 152 N 0.54 0.96 -0.42 1.13 2.86 -0.51 -0.97 114.93 118.53 2qsh h MET 152 Ca 0.15 -0.24 -0.09 0.00 -2.06 0.00 0.00 59.70 57.45 2qsh h MET 152 Cb 0.11 -0.12 -0.02 0.00 0.06 0.00 0.00 31.60 31.63 2qsh h MET 152 CO -0.02 0.90 -0.12 0.28 1.06 0.00 0.00 176.91 179.01 2qsh h VAL 153 N 0.90 1.26 -0.77 -2.22 2.07 -0.44 -1.76 116.25 115.30 2qsh h VAL 153 Ca 0.18 -1.16 -0.00 0.00 0.82 0.00 0.00 66.70 66.53 2qsh h VAL 153 Cb 0.41 1.06 -0.04 0.00 -1.52 0.00 0.00 31.29 31.21 2qsh h VAL 153 CO 0.01 0.40 0.47 -0.74 0.02 0.00 0.00 177.57 177.72 2qsh h HIS 154 N 0.68 1.01 -0.78 1.57 6.17 -0.02 -1.36 115.15 122.40 2qsh h HIS 154 Ca 0.11 -0.00 -0.05 0.00 0.71 0.00 0.00 60.37 61.15 2qsh h HIS 154 Cb 0.59 -0.33 -0.03 0.00 2.52 0.00 0.00 27.41 30.15 2qsh h HIS 154 CO 0.03 0.68 0.31 0.78 0.71 0.00 0.00 177.93 180.43 2qsh h GLY 155 N 1.05 1.26 0.84 5.26 0.00 -0.92 -0.56 103.07 110.00 2qsh h GLY 155 Ca 0.28 -0.68 -0.01 0.00 0.00 0.00 0.00 47.33 46.92 2qsh h GLY 155 CO -0.05 0.65 -0.21 -2.75 0.00 0.00 0.00 176.54 174.17 2qsh h PHE 156 N 1.14 -0.55 -0.26 5.60 3.57 -0.91 -1.53 116.94 123.99 2qsh h PHE 156 Ca 0.26 -0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.74 2qsh h PHE 156 Cb 0.22 0.20 -0.01 0.00 2.79 0.00 0.00 35.95 39.15 2qsh h PHE 156 CO 0.02 -0.32 0.10 0.82 -2.23 0.00 0.00 178.31 176.70 2qsh h ILE 157 N -0.50 1.18 -0.74 1.41 2.04 -1.11 -2.28 117.51 117.51 2qsh h ILE 157 Ca -0.02 -0.55 0.04 0.00 1.00 0.00 0.00 64.86 65.33 2qsh h ILE 157 Cb 0.43 1.06 -0.04 0.00 -0.74 0.00 0.00 36.82 37.53 2qsh h ILE 157 CO 0.00 0.18 0.49 -0.09 0.00 0.00 0.00 178.15 178.73 2qsh h ARG 158 N 0.26 0.85 -0.51 2.37 9.65 -1.11 -0.59 114.38 125.30 2qsh h ARG 158 Ca 0.09 -0.05 -0.04 0.00 -1.10 0.00 0.00 59.98 58.87 2qsh h ARG 158 Cb 0.19 -0.19 -0.02 0.00 -1.39 0.00 0.00 29.97 28.56 2qsh h ARG 158 CO -0.01 0.56 0.14 -0.97 2.80 0.00 0.00 179.97 182.49 2qsh h ASN 159 N 0.87 0.71 0.22 -3.80 -0.73 -0.88 -1.99 115.58 109.98 2qsh h ASN 159 Ca 0.30 -0.11 0.00 0.00 1.87 0.00 0.00 56.30 58.36 2qsh h ASN 159 Cb 0.10 -0.18 -0.01 0.00 0.27 0.00 0.00 38.32 38.49 2qsh h ASN 159 CO -0.09 0.69 -0.19 -0.33 -0.37 0.00 0.00 177.43 177.14 2qsh h GLU 160 N 0.74 -0.41 -0.64 6.67 5.08 -0.57 -3.11 114.58 122.33 2qsh h GLU 160 Ca 0.17 0.03 0.12 0.00 -1.00 0.00 0.00 59.36 58.68 2qsh h GLU 160 Cb 0.25 0.09 -0.09 0.00 0.50 0.00 0.00 28.75 29.51 2qsh h GLU 160 CO -0.01 -0.27 0.18 -1.49 -1.00 0.00 0.00 179.01 176.42 2qsh h TRP 161 N -0.43 0.29 -0.88 4.33 4.06 -0.87 0.64 115.95 123.10 2qsh h TRP 161 Ca -0.01 0.04 0.19 0.00 2.06 0.00 0.00 58.89 61.17 2qsh h TRP 161 Cb 0.39 -0.03 -0.07 0.00 -1.00 0.00 0.00 29.16 28.45 2qsh h TRP 161 CO -0.13 -0.00 0.58 0.82 -3.56 0.00 0.00 178.44 176.14 2qsh h ILE 162 N 0.31 0.71 0.00 1.49 2.04 -1.34 0.85 117.51 121.58 2qsh h ILE 162 Ca 0.34 -0.15 0.00 0.00 1.00 0.00 0.00 64.86 66.05 2qsh h ILE 162 Cb 0.51 0.23 0.00 0.00 -0.74 0.00 0.00 36.82 36.82 2qsh h ILE 162 CO -0.40 0.08 0.00 0.59 0.00 0.00 0.00 178.15 178.42 2qsh n ASN 163 N -4.52 0.00 -4.67 1.72 3.02 0.22 -4.62 115.26 106.42 2qsh n ASN 163 Ca 0.18 -0.67 -0.46 0.00 -0.03 0.00 0.00 54.58 53.60 2qsh n ASN 163 Cb 0.65 0.00 -0.04 0.00 -0.61 0.00 0.00 39.78 39.77 2qsh n ASN 163 CO 0.00 0.00 0.00 -0.24 -2.62 0.00 0.00 177.26 174.40 2qsh n SER 164 N -0.96 3.03 -0.07 6.41 2.88 0.29 -4.91 113.62 120.29 2qsh n SER 164 Ca 0.14 1.08 -0.13 0.00 -1.33 0.00 0.00 58.87 58.63 2qsh n SER 164 Cb 0.06 -1.41 -0.06 0.00 -0.75 0.00 0.00 64.21 62.06 2qsh n SER 164 CO 0.00 0.00 0.00 0.50 -1.23 0.00 0.00 175.04 174.31 2qsh h LYS 165 N 6.03 0.46 -0.61 -1.46 1.63 -1.91 -1.86 116.57 118.84 2qsh h LYS 165 Ca -0.45 -0.22 0.10 0.00 -0.85 0.00 0.00 60.65 59.23 2qsh h LYS 165 Cb 1.26 -0.00 -0.04 0.00 -0.60 0.00 0.00 32.23 32.85 2qsh h LYS 165 CO 0.89 0.77 0.41 0.00 -3.45 0.00 0.00 179.45 178.06 2qsh h ARG 166 N 0.14 0.41 0.15 1.90 -0.00 -1.99 -2.63 114.38 112.36 2qsh h ARG 166 Ca 0.04 -0.02 -0.21 0.00 -0.50 0.00 0.00 59.98 59.28 2qsh h ARG 166 Cb 0.65 -0.09 0.02 0.00 0.00 0.00 0.00 29.97 30.56 2qsh h ARG 166 CO 0.04 0.27 -0.93 1.25 0.00 0.00 0.00 179.97 180.60 2qsh h LEU 167 N 0.42 0.55 -0.77 3.04 6.46 -1.92 -3.35 115.31 119.75 2qsh h LEU 167 Ca 0.28 -0.93 -0.09 0.00 -0.12 0.00 0.00 57.88 57.02 2qsh h LEU 167 Cb 0.55 -0.18 -0.02 0.00 -0.73 0.00 0.00 40.66 40.28 2qsh h LEU 167 CO -0.08 1.45 -0.04 0.77 -0.62 0.00 0.00 178.44 179.92 2qsh h SER 168 N -0.25 0.87 -0.00 1.25 4.64 -0.98 -1.25 113.55 117.83 2qsh h SER 168 Ca -0.16 -0.24 0.00 0.00 -0.47 0.00 0.00 61.79 60.92 2qsh h SER 168 Cb 1.73 -0.23 -0.00 0.00 -0.31 0.00 0.00 62.40 63.58 2qsh h SER 168 CO 0.18 0.95 0.00 0.08 -0.87 0.00 0.00 176.83 177.17 2qsh h ARG 169 N 0.82 0.00 0.02 4.77 0.11 -1.65 -0.83 114.38 117.62 2qsh h ARG 169 Ca 0.15 0.00 -0.08 0.00 0.10 0.00 0.00 59.98 60.15 2qsh h ARG 169 Cb 0.54 0.00 0.01 0.00 1.11 0.00 0.00 29.97 31.63 2qsh h ARG 169 CO 0.03 0.00 -0.32 -0.22 0.10 0.00 0.00 179.97 179.56 2qsh h LYS 170 N 0.00 0.18 -0.02 0.08 3.64 -1.42 -3.36 116.57 115.66 2qsh h LYS 170 Ca 0.00 -0.22 -0.11 0.00 -1.27 0.00 0.00 60.65 59.05 2qsh h LYS 170 Cb 0.01 0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 31.88 2qsh h LYS 170 CO -0.00 1.00 -0.50 -0.07 -2.27 0.00 0.00 179.45 177.60 2qsh h LEU 171 N -0.54 0.06 -0.91 5.20 3.38 -0.74 -3.07 115.31 118.69 2qsh h LEU 171 Ca -0.05 -0.03 0.24 0.00 0.09 0.00 0.00 57.88 58.13 2qsh h LEU 171 Cb 1.12 -0.02 -0.13 0.00 0.09 0.00 0.00 40.66 41.72 2qsh h LEU 171 CO 0.06 0.56 0.39 -1.28 0.09 0.00 0.00 178.44 178.26 2qsh h SER 172 N 0.05 0.30 0.28 -0.43 0.87 -1.32 0.52 113.55 113.82 2qsh h SER 172 Ca -0.00 0.17 0.00 0.00 -1.23 0.00 0.00 61.79 60.73 2qsh h SER 172 Cb 0.91 0.16 0.00 0.00 -0.44 0.00 0.00 62.40 63.03 2qsh h SER 172 CO 0.07 -0.05 0.00 0.59 -0.53 0.00 0.00 176.83 176.91 2qsh n ASN 173 N -5.08 0.00 0.13 6.23 5.03 -1.16 -2.06 115.26 118.35 2qsh n ASN 173 Ca 0.23 0.43 0.13 0.00 0.87 0.00 0.00 54.58 56.24 2qsh n ASN 173 Cb 0.71 -0.45 0.40 0.00 -1.02 0.00 0.00 39.78 39.41 2qsh n ASN 173 CO 0.00 0.00 0.00 -0.07 -1.83 0.00 0.00 177.26 175.36 2qsh h LEU 174 N 0.00 0.00 -8.16 3.41 3.38 -1.07 -3.43 115.31 109.44 2qsh h LEU 174 Ca 0.00 0.00 -0.70 0.00 0.09 0.00 0.00 57.88 57.27 2qsh h LEU 174 Cb 0.14 0.00 -0.29 0.00 0.09 0.00 0.00 40.66 40.60 2qsh h LEU 174 CO 0.00 0.00 -0.57 -0.69 0.09 0.00 0.00 178.44 177.27 2qsh s VAL 175 N -3.17 3.85 0.89 1.22 1.01 -0.87 -5.02 120.40 118.31 2qsh s VAL 175 Ca 0.09 -1.25 -0.12 0.00 0.00 0.00 0.00 61.98 60.70 2qsh s VAL 175 Cb 0.11 -3.25 0.07 0.00 0.00 0.00 0.00 36.38 33.31 2qsh s VAL 175 CO 0.57 -0.28 0.82 -2.65 0.00 0.00 0.00 175.10 173.56 2qsh n PRO 176 N 4.82 -0.19 0.07 2.72 -0.02 -1.26 -4.73 135.00 136.40 2qsh n PRO 176 Ca -0.11 0.00 -0.12 0.00 -2.02 0.00 0.00 63.50 61.25 2qsh n PRO 176 Cb 0.44 -2.14 -0.06 0.00 -0.02 0.00 0.00 33.50 31.72 2qsh n PRO 176 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 2qsh h GLU 177 N -1.42 -0.16 -0.82 -0.52 4.81 -1.98 -0.87 114.58 113.62 2qsh h GLU 177 Ca -0.44 0.01 0.20 0.00 -0.13 0.00 0.00 59.36 59.00 2qsh h GLU 177 Cb 1.29 0.04 -0.14 0.00 0.63 0.00 0.00 28.75 30.56 2qsh h GLU 177 CO 0.40 -0.11 0.04 -0.22 -0.73 0.00 0.00 179.01 178.38 2qsh h LYS 178 N -0.17 0.10 -0.37 1.92 3.11 -2.01 -0.23 116.57 118.92 2qsh h LYS 178 Ca 0.02 -0.01 -0.16 0.00 -2.81 0.00 0.00 60.65 57.70 2qsh h LYS 178 Cb 0.19 -0.02 -0.01 0.00 -1.00 0.00 0.00 32.23 31.39 2qsh h LYS 178 CO -0.06 0.07 -0.38 0.28 -2.81 0.00 0.00 179.45 176.55 2qsh h VAL 179 N 0.10 1.27 -0.71 2.00 2.07 -1.78 -3.11 116.25 116.10 2qsh h VAL 179 Ca 0.46 -1.56 0.08 0.00 0.82 0.00 0.00 66.70 66.50 2qsh h VAL 179 Cb 0.86 1.39 -0.06 0.00 -1.52 0.00 0.00 31.29 31.96 2qsh h VAL 179 CO -0.71 0.52 0.38 0.15 0.02 0.00 0.00 177.57 177.93 2qsh h PHE 180 N 0.73 0.69 -0.46 1.57 3.57 0.35 -1.53 116.94 121.86 2qsh h PHE 180 Ca 0.06 0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.58 2qsh h PHE 180 Cb 0.97 -0.20 -0.02 0.00 2.79 0.00 0.00 35.95 39.48 2qsh h PHE 180 CO 0.06 0.29 0.23 0.93 -2.23 0.00 0.00 178.31 177.59 2qsh h GLU 181 N 0.67 0.63 -0.06 1.11 4.39 -1.27 -1.89 114.58 118.16 2qsh h GLU 181 Ca 0.33 -0.07 -0.08 0.00 0.34 0.00 0.00 59.36 59.89 2qsh h GLU 181 Cb 0.28 -0.13 -0.01 0.00 -0.10 0.00 0.00 28.75 28.79 2qsh h GLU 181 CO -0.23 0.48 -0.34 -0.07 -1.16 0.00 0.00 179.01 177.70 2qsh h LEU 182 N 0.64 0.12 -0.51 1.33 3.38 -1.24 -2.11 115.31 116.91 2qsh h LEU 182 Ca 0.16 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.09 2qsh h LEU 182 Cb 0.05 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 40.77 2qsh h LEU 182 CO -0.02 0.45 0.00 -0.07 0.09 0.00 0.00 178.44 178.89 2qsh h LEU 183 N 0.10 0.00 -5.65 1.67 3.38 -0.99 -3.20 115.31 110.62 2qsh h LEU 183 Ca 0.01 0.00 -0.51 0.00 0.09 0.00 0.00 57.88 57.48 2qsh h LEU 183 Cb 0.65 0.00 -0.41 0.00 0.09 0.00 0.00 40.66 41.00 2qsh h LEU 183 CO 0.05 0.00 -1.02 1.41 0.09 0.00 0.00 178.44 178.97 2qsh n HIS 184 N -2.45 1.52 -1.01 1.13 8.25 -0.81 -4.92 115.22 116.93 2qsh n HIS 184 Ca 0.03 -3.76 -0.32 0.00 -0.26 0.00 0.00 57.72 53.41 2qsh n HIS 184 Cb 0.34 -0.42 0.14 0.00 1.12 0.00 0.00 29.99 31.16 2qsh n HIS 184 CO 0.00 0.00 0.00 -1.25 0.64 0.00 0.00 176.34 175.73 2qsh s PRO 185 N -2.84 1.50 0.34 -0.41 0.04 -1.15 -4.93 135.00 127.56 2qsh s PRO 185 Ca 0.42 1.65 -0.29 0.00 0.04 0.00 0.00 61.00 62.82 2qsh s PRO 185 Cb 0.34 -1.77 -0.10 0.00 0.04 0.00 0.00 34.50 33.00 2qsh s PRO 185 CO -0.09 -2.29 1.35 -1.14 0.04 0.00 0.00 177.00 174.86 2qsh s GLN 186 N -4.34 4.30 0.15 4.56 2.00 -1.26 -4.96 119.66 120.11 2qsh s GLN 186 Ca 0.70 2.30 -0.31 0.00 -2.00 0.00 0.00 55.36 56.04 2qsh s GLN 186 Cb -0.26 -3.05 -0.10 0.00 0.80 0.00 0.00 33.01 30.40 2qsh s GLN 186 CO 0.53 -0.27 1.69 0.21 -0.50 0.00 0.00 175.29 176.95 2qsh s LYS 187 N -1.83 4.17 -0.31 1.67 2.47 -1.26 -4.80 119.74 119.85 2qsh s LYS 187 Ca 0.50 2.48 -0.07 0.00 -1.56 0.00 0.00 55.97 57.32 2qsh s LYS 187 Cb -0.41 -3.31 0.02 0.00 -1.46 0.00 0.00 37.83 32.67 2qsh s LYS 187 CO 0.55 -0.73 0.09 0.34 0.16 0.00 0.00 175.35 175.76 2qsh s ASP 188 N 1.73 5.18 -0.01 1.43 -1.08 -1.26 -5.02 116.67 117.65 2qsh s ASP 188 Ca 0.75 -0.82 -0.15 0.00 -0.52 0.00 0.00 52.55 51.80 2qsh s ASP 188 Cb -0.45 -1.88 -0.08 0.00 -1.46 0.00 0.00 42.92 39.04 2qsh s ASP 188 CO 0.33 -0.23 0.76 -0.33 0.52 0.00 0.00 175.17 176.21 2qsh h GLU 189 N 8.24 -0.52 -0.70 4.34 4.39 -1.98 -3.09 114.58 125.25 2qsh h GLU 189 Ca -0.29 0.04 0.15 0.00 0.34 0.00 0.00 59.36 59.60 2qsh h GLU 189 Cb 1.11 0.12 -0.11 0.00 -0.10 0.00 0.00 28.75 29.77 2qsh h GLU 189 CO 0.61 -0.35 0.12 1.49 -1.16 0.00 0.00 179.01 179.72 2qsh h GLU 190 N -0.89 0.21 -1.86 2.33 4.81 -2.05 -3.39 114.58 113.75 2qsh h GLU 190 Ca -0.06 -0.01 -0.34 0.00 -0.13 0.00 0.00 59.36 58.82 2qsh h GLU 190 Cb 0.41 -0.05 -0.30 0.00 0.63 0.00 0.00 28.75 29.45 2qsh h GLU 190 CO 0.09 0.14 -0.67 -1.17 -0.73 0.00 0.00 179.01 176.67 2qsh s LEU 191 N -10.62 -0.19 0.60 1.64 2.96 -1.25 -5.01 118.68 106.81 2qsh s LEU 191 Ca -0.13 -1.52 0.30 0.00 -0.22 0.00 0.00 54.13 52.56 2qsh s LEU 191 Cb 0.21 0.69 1.75 0.00 0.50 0.00 0.00 46.19 49.33 2qsh s LEU 191 CO 0.75 -0.25 2.16 -0.65 -1.32 0.00 0.00 176.35 177.04 2qsh h PRO 192 N 7.03 0.00 -0.91 0.98 0.11 -1.75 -2.15 132.00 135.32 2qsh h PRO 192 Ca 0.05 0.00 0.12 0.00 0.11 0.00 0.00 66.00 66.29 2qsh h PRO 192 Cb 1.07 0.00 -0.09 0.00 0.11 0.00 0.00 31.00 32.09 2qsh h PRO 192 CO 0.19 0.00 0.53 1.25 -0.21 0.00 0.00 178.00 179.76 2qsh h LEU 193 N 0.00 0.73 -1.96 2.35 5.85 -1.91 -0.31 115.31 120.07 2qsh h LEU 193 Ca 0.05 0.06 0.10 0.00 0.84 0.00 0.00 57.88 58.94 2qsh h LEU 193 Cb 0.32 -0.07 -0.02 0.00 0.37 0.00 0.00 40.66 41.26 2qsh h LEU 193 CO -0.00 0.37 0.28 0.03 -0.34 0.00 0.00 178.44 178.78 2qsh h ARG 194 N 0.82 0.04 0.00 1.25 3.08 -1.78 0.54 114.38 118.33 2qsh h ARG 194 Ca 0.46 -0.00 -0.04 0.00 0.07 0.00 0.00 59.98 60.47 2qsh h ARG 194 Cb 0.53 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.57 2qsh h ARG 194 CO -0.29 0.03 -0.15 0.77 -1.07 0.00 0.00 179.97 179.26 2qsh h SER 195 N 0.05 0.13 -0.65 7.04 0.02 -1.23 -2.62 113.55 116.28 2qsh h SER 195 Ca 0.18 -0.79 0.13 0.00 -0.84 0.00 0.00 61.79 60.47 2qsh h SER 195 Cb 0.68 -0.04 -0.12 0.00 0.14 0.00 0.00 62.40 63.05 2qsh h SER 195 CO -0.01 0.90 -0.17 0.74 -1.14 0.00 0.00 176.83 177.15 2qsh h THR 196 N -0.63 0.34 -0.46 -2.27 2.02 -1.07 0.15 112.91 110.99 2qsh h THR 196 Ca -0.02 0.00 0.09 0.00 0.77 0.00 0.00 66.41 67.25 2qsh h THR 196 Cb 0.92 0.34 -0.10 0.00 -1.74 0.00 0.00 68.15 67.58 2qsh h THR 196 CO 0.03 0.00 -0.25 -0.09 0.37 0.00 0.00 175.52 175.58 2qsh h ARG 197 N -0.00 -0.15 -0.66 6.66 1.12 -0.89 0.33 114.38 120.78 2qsh h ARG 197 Ca 0.31 0.01 -0.04 0.00 -1.11 0.00 0.00 59.98 59.15 2qsh h ARG 197 Cb 0.48 0.03 -0.03 0.00 -0.01 0.00 0.00 29.97 30.44 2qsh h ARG 197 CO -0.67 -0.10 0.26 0.87 -3.11 0.00 0.00 179.97 177.21 2qsh h LYS 198 N -0.16 0.97 0.17 0.20 1.57 -0.84 -1.50 116.57 116.98 2qsh h LYS 198 Ca 0.21 -0.16 -0.00 0.00 -1.87 0.00 0.00 60.65 58.83 2qsh h LYS 198 Cb 0.49 -0.17 -0.01 0.00 0.08 0.00 0.00 32.23 32.63 2qsh h LYS 198 CO -0.56 0.80 -0.12 1.25 -0.57 0.00 0.00 179.45 180.25 2qsh h LEU 199 N 0.95 -0.31 -1.36 2.94 6.46 0.17 -1.92 115.31 122.24 2qsh h LEU 199 Ca 0.22 0.02 0.04 0.00 -0.12 0.00 0.00 57.88 58.05 2qsh h LEU 199 Cb 0.19 0.10 -0.04 0.00 -0.73 0.00 0.00 40.66 40.18 2qsh h LEU 199 CO -0.02 -0.19 0.46 -0.07 -0.62 0.00 0.00 178.44 178.00 2qsh h LEU 200 N -0.30 0.70 -0.71 2.25 3.38 -0.64 -0.51 115.31 119.48 2qsh h LEU 200 Ca -0.01 -0.01 -0.10 0.00 0.09 0.00 0.00 57.88 57.85 2qsh h LEU 200 Cb 0.26 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.83 2qsh h LEU 200 CO -0.00 0.48 -0.11 -0.78 0.09 0.00 0.00 178.44 178.12 2qsh h ASP 201 N 0.81 0.87 -0.02 -0.43 3.58 -1.04 -0.10 116.42 120.09 2qsh h ASP 201 Ca 0.29 -0.27 -0.00 0.00 0.42 0.00 0.00 57.03 57.46 2qsh h ASP 201 Cb 0.12 -0.24 -0.00 0.00 1.72 0.00 0.00 39.33 40.93 2qsh h ASP 201 CO -0.08 0.99 0.01 1.23 -2.88 0.00 0.00 179.24 178.51 2qsh h GLY 202 N 0.97 0.04 0.71 -0.78 0.00 -0.41 -1.82 103.07 101.77 2qsh h GLY 202 Ca 0.13 -0.02 0.09 0.00 0.00 0.00 0.00 47.33 47.53 2qsh h GLY 202 CO 0.04 0.02 0.58 1.41 0.00 0.00 0.00 176.54 178.60 2qsh h LEU 203 N -0.11 0.83 -0.14 3.11 3.38 -0.97 -0.59 115.31 120.81 2qsh h LEU 203 Ca 0.01 0.02 -0.02 0.00 0.09 0.00 0.00 57.88 57.98 2qsh h LEU 203 Cb 0.15 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.75 2qsh h LEU 203 CO -0.00 0.49 0.03 0.50 0.09 0.00 0.00 178.44 179.55 2qsh h LYS 204 N 0.92 0.24 -0.28 1.13 3.64 -0.75 -1.77 116.57 119.70 2qsh h LYS 204 Ca 0.42 -0.06 -0.04 0.00 -1.27 0.00 0.00 60.65 59.70 2qsh h LYS 204 Cb 0.39 -0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 32.16 2qsh h LYS 204 CO -0.18 0.41 0.00 0.87 -2.27 0.00 0.00 179.45 178.28 2qsh h LYS 205 N 0.02 0.42 -0.65 1.90 1.57 -0.77 -1.35 116.57 117.70 2qsh h LYS 205 Ca 0.04 -0.08 -0.02 0.00 -1.87 0.00 0.00 60.65 58.73 2qsh h LYS 205 Cb 0.29 -0.07 -0.03 0.00 0.08 0.00 0.00 32.23 32.50 2qsh h LYS 205 CO 0.00 0.44 0.32 0.00 -0.57 0.00 0.00 179.45 179.65 2qsh h MET 207 N 0.90 1.27 -0.02 0.00 1.85 -0.51 -1.63 114.93 116.79 2qsh h MET 207 Ca 0.23 -0.10 -0.01 0.00 -0.61 0.00 0.00 59.70 59.21 2qsh h MET 207 Cb 0.10 -0.28 -0.00 0.00 0.43 0.00 0.00 31.60 31.86 2qsh h MET 207 CO -0.03 0.87 -0.01 0.93 -0.40 0.00 0.00 176.91 178.27 2qsh h GLU 208 N 1.30 0.04 0.00 0.39 5.08 -0.72 -2.71 114.58 117.96 2qsh h GLU 208 Ca 0.34 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.69 2qsh h GLU 208 Cb -0.10 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.15 2qsh h GLU 208 CO -0.07 0.40 0.00 1.37 -1.00 0.00 0.00 179.01 179.71 2qsh h LEU 209 N -0.32 0.00 -0.42 1.33 8.10 -1.18 -2.36 115.31 120.46 2qsh h LEU 209 Ca 0.01 0.00 -0.16 0.00 0.11 0.00 0.00 57.88 57.84 2qsh h LEU 209 Cb 0.39 0.00 -0.01 0.00 -0.44 0.00 0.00 40.66 40.60 2qsh h LEU 209 CO 0.00 0.00 -0.41 -0.25 -4.11 0.00 0.00 178.44 173.67 2qsh h TRP 210 N 0.00 1.07 -0.90 0.17 2.91 -1.21 -0.06 115.95 117.93 2qsh h TRP 210 Ca 0.00 -0.33 0.07 0.00 1.13 0.00 0.00 58.89 59.77 2qsh h TRP 210 Cb 0.60 -0.22 -0.07 0.00 -0.51 0.00 0.00 29.16 28.96 2qsh h TRP 210 CO 0.00 1.14 0.55 1.96 -1.03 0.00 0.00 178.44 181.07 2qsh h GLN 211 N 0.72 0.95 -0.59 2.65 1.08 -1.10 0.25 115.11 119.06 2qsh h GLN 211 Ca 0.05 -0.06 -0.07 0.00 -1.45 0.00 0.00 58.65 57.13 2qsh h GLN 211 Cb 1.00 -0.22 -0.02 0.00 -0.05 0.00 0.00 27.48 28.19 2qsh h GLN 211 CO 0.10 0.63 0.10 -0.22 -0.95 0.00 0.00 178.83 178.49 2qsh h LYS 212 N 0.98 0.98 -0.09 1.46 1.63 -1.29 -3.25 116.57 116.99 2qsh h LYS 212 Ca 0.40 -0.26 -0.02 0.00 -0.85 0.00 0.00 60.65 59.92 2qsh h LYS 212 Cb 0.24 -0.12 -0.00 0.00 -0.60 0.00 0.00 32.23 31.75 2qsh h LYS 212 CO -0.20 0.92 -0.04 1.25 -3.45 0.00 0.00 179.45 177.94 2qsh h HIS 213 N 0.88 0.21 -2.38 1.91 2.76 -0.23 -3.40 115.15 114.90 2qsh h HIS 213 Ca 0.18 -0.05 -0.53 0.00 -2.20 0.00 0.00 60.37 57.77 2qsh h HIS 213 Cb 0.41 -0.05 -0.06 0.00 1.55 0.00 0.00 27.41 29.27 2qsh h HIS 213 CO 0.03 0.53 1.18 -0.46 -1.30 0.00 0.00 177.93 177.91 2qsh s TRP 214 N -4.62 2.04 -0.15 5.26 -0.11 0.00 -4.67 118.94 116.70 2qsh s TRP 214 Ca -0.15 0.43 0.21 0.00 1.22 0.00 0.00 56.10 57.81 2qsh s TRP 214 Cb 0.04 -4.35 -0.14 0.00 -1.50 0.00 0.00 33.47 27.53 2qsh s TRP 214 CO 0.71 -2.16 0.79 1.63 -4.62 0.00 0.00 176.95 173.29 2qsh n LYS 215 N 9.06 0.63 -3.91 5.86 5.02 -1.05 -4.82 118.16 128.95 2qsh n LYS 215 Ca 0.13 0.05 -0.22 0.00 -2.02 0.00 0.00 58.31 56.25 2qsh n LYS 215 Cb 0.50 -1.72 -0.17 0.00 -0.02 0.00 0.00 35.03 33.62 2qsh n LYS 215 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 2qsh s ILE 216 N -3.25 0.50 -0.13 -0.18 -1.09 -1.06 -5.08 121.20 110.90 2qsh s ILE 216 Ca -0.04 -0.00 -0.03 0.00 -2.23 0.00 0.00 60.65 58.36 2qsh s ILE 216 Cb 0.10 -0.60 -0.03 0.00 -1.58 0.00 0.00 42.46 40.36 2qsh s ILE 216 CO 0.83 0.26 -0.05 -0.89 -1.23 0.00 0.00 174.94 173.86 2qsh s THR 217 N 1.60 3.84 0.11 2.92 2.01 -1.26 -2.74 115.64 122.12 2qsh s THR 217 Ca -0.00 -0.39 0.00 0.00 0.31 0.00 0.00 61.69 61.61 2qsh s THR 217 Cb -0.13 -2.66 -0.04 0.00 0.01 0.00 0.00 72.50 69.69 2qsh s THR 217 CO -0.04 0.52 0.26 -0.54 -0.69 0.00 0.00 174.62 174.14 2qsh s LYS 218 N 0.05 3.46 0.66 4.92 1.02 -1.07 -4.96 119.74 123.83 2qsh s LYS 218 Ca -0.00 -0.44 -0.15 0.00 0.02 0.00 0.00 55.97 55.40 2qsh s LYS 218 Cb -0.13 -2.98 0.00 0.00 -0.52 0.00 0.00 37.83 34.19 2qsh s LYS 218 CO 0.03 0.55 1.11 0.15 -0.92 0.00 0.00 175.35 176.27 2qsh s LYS 219 N -2.80 2.79 0.13 1.68 -0.14 -1.26 -4.18 119.74 115.97 2qsh s LYS 219 Ca 0.36 1.37 -0.31 0.00 -1.36 0.00 0.00 55.97 56.03 2qsh s LYS 219 Cb -0.12 -1.95 -0.08 0.00 -1.68 0.00 0.00 37.83 34.00 2qsh s LYS 219 CO 0.28 -1.25 1.39 0.71 -0.76 0.00 0.00 175.35 175.71 2qsh s TYR 220 N -2.38 3.23 0.06 3.18 1.51 -1.26 -4.88 117.35 116.81 2qsh s TYR 220 Ca 0.66 0.98 -0.22 0.00 -1.01 0.00 0.00 57.07 57.48 2qsh s TYR 220 Cb -0.20 -3.69 -0.14 0.00 -0.11 0.00 0.00 41.96 37.82 2qsh s TYR 220 CO 0.42 -2.36 1.54 -0.44 -1.11 0.00 0.00 175.55 173.60 2qsh h ASP 221 N 6.53 0.13 -2.14 2.29 3.45 -1.98 -3.41 116.42 121.28 2qsh h ASP 221 Ca -0.43 -0.23 -0.38 0.00 0.43 0.00 0.00 57.03 56.43 2qsh h ASP 221 Cb 1.21 -0.04 -0.33 0.00 -0.56 0.00 0.00 39.33 39.61 2qsh h ASP 221 CO 0.85 0.33 -0.68 0.20 -1.57 0.00 0.00 179.24 178.37 2qsh s ASN 222 N -5.55 1.68 0.00 6.45 0.01 -1.26 -4.96 114.94 111.31 2qsh s ASN 222 Ca -0.14 -1.23 0.00 0.00 -0.71 0.00 0.00 52.86 50.77 2qsh s ASN 222 Cb 0.05 0.41 0.00 0.00 0.41 0.00 0.00 41.25 42.12 2qsh s ASN 222 CO 0.69 -0.33 0.00 -0.62 -1.51 0.00 0.00 177.10 175.33 2qsh n GLU 223 N 4.77 -1.60 0.00 -0.60 4.71 -1.26 -4.79 120.64 121.87 2qsh n GLU 223 Ca 0.04 0.27 0.00 0.00 -0.01 0.00 0.00 57.16 57.46 2qsh n GLU 223 Cb 0.45 -4.00 0.00 0.00 -1.01 0.00 0.00 31.44 26.87 2qsh n GLU 223 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 2qsh n GLY 224 N 0.34 2.58 1.62 0.62 0.00 -1.26 -0.68 105.19 108.40 2qsh n GLY 224 Ca 0.00 0.06 0.05 0.00 0.00 0.00 0.00 46.02 46.13 2qsh n GLY 224 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2qsh n LEU 225 N 0.00 5.27 -4.74 0.99 4.77 -1.26 -4.99 117.00 117.05 2qsh n LEU 225 Ca 0.00 -3.03 -0.30 0.00 -0.03 0.00 0.00 56.01 52.65 2qsh n LEU 225 Cb 0.00 -0.66 0.13 0.00 -2.33 0.00 0.00 43.42 40.56 2qsh n LEU 225 CO 0.00 0.69 0.68 -0.31 -1.33 0.00 0.00 177.39 177.12 2qsh s TYR 226 N -2.84 2.42 0.26 -1.77 1.51 0.14 -4.43 117.35 112.64 2qsh s TYR 226 Ca 0.51 1.24 -0.30 0.00 -1.01 0.00 0.00 57.07 57.51 2qsh s TYR 226 Cb 0.40 -3.15 -0.11 0.00 -0.11 0.00 0.00 41.96 38.99 2qsh s TYR 226 CO 0.13 -2.26 1.53 1.41 -1.11 0.00 0.00 175.55 175.25 2qsh s MET 227 N -4.98 4.20 0.17 -0.62 1.75 -0.56 -4.96 119.30 114.30 2qsh s MET 227 Ca 0.63 2.43 -0.01 0.00 -1.25 0.00 0.00 55.69 57.49 2qsh s MET 227 Cb -0.17 -3.08 -0.04 0.00 2.84 0.00 0.00 34.83 34.38 2qsh s MET 227 CO 0.56 -0.54 0.36 1.03 -0.65 0.00 0.00 175.02 175.78 2qsh s ARG 228 N -0.25 3.52 0.51 4.11 0.52 -1.26 -4.75 118.95 121.35 2qsh s ARG 228 Ca 0.62 -0.34 -0.09 0.00 -0.52 0.00 0.00 55.73 55.40 2qsh s ARG 228 Cb -0.45 -2.88 -0.05 0.00 0.52 0.00 0.00 34.95 32.10 2qsh s ARG 228 CO 0.44 0.45 0.88 0.95 0.02 0.00 0.00 175.30 178.03 2qsh s THR 229 N -1.78 4.78 0.22 0.02 -4.23 -1.26 -4.48 115.64 108.92 2qsh s THR 229 Ca 0.38 0.61 -0.09 0.00 -1.18 0.00 0.00 61.69 61.41 2qsh s THR 229 Cb -0.11 -3.82 0.19 0.00 1.34 0.00 0.00 72.50 70.09 2qsh s THR 229 CO 0.28 -0.84 1.89 -0.50 -0.54 0.00 0.00 174.62 174.91 2qsh h TRP 230 N 0.38 1.06 -0.88 3.99 4.06 -1.96 -1.28 115.95 121.33 2qsh h TRP 230 Ca -0.46 0.02 0.03 0.00 2.06 0.00 0.00 58.89 60.54 2qsh h TRP 230 Cb 1.19 -0.36 -0.05 0.00 -1.00 0.00 0.00 29.16 28.95 2qsh h TRP 230 CO 0.62 0.68 0.57 -0.22 -3.56 0.00 0.00 178.44 176.52 2qsh h LYS 231 N 1.14 1.08 -0.55 0.49 1.63 -1.88 0.10 116.57 118.57 2qsh h LYS 231 Ca 0.31 -0.06 -0.04 0.00 -0.85 0.00 0.00 60.65 60.00 2qsh h LYS 231 Cb -0.11 -0.24 -0.02 0.00 -0.60 0.00 0.00 32.23 31.25 2qsh h LYS 231 CO -0.06 0.71 0.17 0.93 -3.45 0.00 0.00 179.45 177.75 2qsh h GLU 232 N 1.11 0.85 -0.58 1.90 5.08 -1.77 -2.44 114.58 118.73 2qsh h GLU 232 Ca 0.35 -0.18 -0.10 0.00 -1.00 0.00 0.00 59.36 58.42 2qsh h GLU 232 Cb -0.00 -0.12 -0.02 0.00 0.50 0.00 0.00 28.75 29.10 2qsh h GLU 232 CO -0.11 0.78 -0.03 0.82 -1.00 0.00 0.00 179.01 179.46 2qsh h ILE 233 N 0.76 1.27 -0.55 3.13 2.04 -0.75 -0.91 117.51 122.49 2qsh h ILE 233 Ca 0.18 -1.18 0.00 0.00 1.00 0.00 0.00 64.86 64.86 2qsh h ILE 233 Cb 0.28 0.85 -0.03 0.00 -0.74 0.00 0.00 36.82 37.18 2qsh h ILE 233 CO -0.01 0.43 0.36 -0.08 0.00 0.00 0.00 178.15 178.85 2qsh h GLU 234 N 0.94 0.73 0.00 2.37 4.81 -0.63 -2.89 114.58 119.91 2qsh h GLU 234 Ca 0.16 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.34 2qsh h GLU 234 Cb 0.59 -0.16 0.00 0.00 0.63 0.00 0.00 28.75 29.81 2qsh h GLU 234 CO 0.04 0.49 -0.29 -1.33 -0.73 0.00 0.00 179.01 177.19 2qsh n MET 235 N -4.69 0.07 -0.20 1.92 2.81 -0.94 -3.82 117.12 112.26 2qsh n MET 235 Ca 0.03 0.03 -0.09 0.00 -1.81 0.00 0.00 57.70 55.87 2qsh n MET 235 Cb 0.03 -1.56 0.02 0.00 -0.71 0.00 0.00 33.22 31.00 2qsh n MET 235 CO 0.00 0.00 0.00 0.66 1.51 0.00 0.00 175.97 178.14 2qsh h SER 236 N 0.00 0.96 0.01 7.83 4.64 -0.94 -1.12 113.55 124.93 2qsh h SER 236 Ca 0.00 -0.28 -0.00 0.00 -0.47 0.00 0.00 61.79 61.04 2qsh h SER 236 Cb 0.56 -0.26 -0.00 0.00 -0.31 0.00 0.00 62.40 62.40 2qsh h SER 236 CO 0.00 1.00 -0.00 0.00 -0.87 0.00 0.00 176.83 176.96 2qsh h ALA 237 N 0.99 1.79 -0.50 5.18 0.00 -1.66 -3.12 119.26 121.93 2qsh h ALA 237 Ca 0.17 -0.00 -0.03 0.00 0.00 0.00 0.00 54.91 55.05 2qsh h ALA 237 Cb 0.48 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.25 2qsh h ALA 237 CO 0.02 0.00 0.20 -0.97 0.00 0.00 0.00 179.25 178.51 2qsh h ASN 238 N 0.00 0.69 -3.21 0.00 -1.24 -1.36 -3.43 115.58 107.03 2qsh h ASN 238 Ca -0.00 -0.17 -0.67 0.00 0.71 0.00 0.00 56.30 56.18 2qsh h ASN 238 Cb 0.01 -0.18 -0.32 0.00 0.73 0.00 0.00 38.32 38.56 2qsh h ASN 238 CO 0.00 0.67 -0.81 0.20 -1.29 0.00 0.00 177.43 176.20 2qsh s ASN 239 N -5.97 3.56 -0.44 1.15 -0.87 -1.18 -5.08 114.94 106.11 2qsh s ASN 239 Ca -0.13 -0.54 -0.29 0.00 -1.57 0.00 0.00 52.86 50.34 2qsh s ASN 239 Cb 0.12 -1.57 0.02 0.00 -0.02 0.00 0.00 41.25 39.80 2qsh s ASN 239 CO 0.77 0.02 1.32 -0.54 -2.57 0.00 0.00 177.10 176.11 2qsh s LYS 240 N 1.19 3.62 -0.01 -0.60 3.01 -1.26 -4.94 119.74 120.75 2qsh s LYS 240 Ca 0.02 0.80 -0.05 0.00 -1.01 0.00 0.00 55.97 55.73 2qsh s LYS 240 Cb -0.14 -3.99 -0.04 0.00 -1.01 0.00 0.00 37.83 32.65 2qsh s LYS 240 CO -0.07 -1.52 0.23 1.03 0.51 0.00 0.00 175.35 175.53 2qsh s ARG 241 N 4.80 3.52 0.29 1.68 0.52 -1.26 -5.08 118.95 123.42 2qsh s ARG 241 Ca 0.57 -0.17 -0.29 0.00 -0.52 0.00 0.00 55.73 55.31 2qsh s ARG 241 Cb -0.11 -3.09 -0.10 0.00 0.52 0.00 0.00 34.95 32.17 2qsh s ARG 241 CO 0.32 0.67 1.33 0.21 0.02 0.00 0.00 175.30 177.85 2qsh s LYS 242 N -1.79 4.35 -0.13 3.54 2.20 -1.26 -5.03 119.74 121.62 2qsh s LYS 242 Ca 0.27 2.20 -0.00 0.00 -0.36 0.00 0.00 55.97 58.07 2qsh s LYS 242 Cb -0.13 -3.10 0.03 0.00 -1.51 0.00 0.00 37.83 33.12 2qsh s LYS 242 CO 0.16 -0.23 -0.07 -0.06 -0.36 0.00 0.00 175.35 174.79 2qsh s PHE 243 N -0.73 1.58 -0.28 4.03 0.08 -1.26 -5.10 117.98 116.30 2qsh s PHE 243 Ca 0.52 -0.87 -0.29 0.00 0.12 0.00 0.00 56.93 56.41 2qsh s PHE 243 Cb -0.39 -1.28 0.00 0.00 -0.57 0.00 0.00 43.02 40.78 2qsh s PHE 243 CO 0.49 -0.55 1.27 0.21 -0.10 0.00 0.00 175.22 176.53 2qsh s LYS 244 N 1.68 3.98 0.43 0.44 2.47 -1.26 -5.00 119.74 122.47 2qsh s LYS 244 Ca 0.04 1.28 -0.24 0.00 -1.56 0.00 0.00 55.97 55.48 2qsh s LYS 244 Cb -0.13 -3.84 -0.08 0.00 -1.46 0.00 0.00 37.83 32.31 2qsh s LYS 244 CO -0.08 -1.04 1.22 0.99 0.16 0.00 0.00 175.35 176.60 2qsh s THR 245 N 4.16 2.89 -0.29 3.43 2.01 -1.26 -5.03 115.64 121.55 2qsh s THR 245 Ca 0.55 0.73 0.03 0.00 0.31 0.00 0.00 61.69 63.30 2qsh s THR 245 Cb -0.17 -3.40 0.08 0.00 0.01 0.00 0.00 72.50 69.02 2qsh s THR 245 CO 0.21 0.05 -0.03 -0.22 -0.69 0.00 0.00 174.62 173.94 2qsh s LEU 246 N -2.73 3.67 0.62 4.42 2.96 -1.26 -5.08 118.68 121.28 2qsh s LEU 246 Ca 0.60 -1.65 -0.05 0.00 -0.22 0.00 0.00 54.13 52.82 2qsh s LEU 246 Cb -0.33 -1.45 0.03 0.00 0.50 0.00 0.00 46.19 44.94 2qsh s LEU 246 CO 0.41 -0.28 0.91 -0.54 -1.32 0.00 0.00 176.35 175.53 2qsh s LYS 247 N 1.12 2.56 0.29 1.98 1.02 -1.26 -4.95 119.74 120.50 2qsh s LYS 247 Ca 0.00 -0.28 0.03 0.00 0.02 0.00 0.00 55.97 55.74 2qsh s LYS 247 Cb -0.19 -2.29 0.63 0.00 -0.52 0.00 0.00 37.83 35.46 2qsh s LYS 247 CO -0.08 -0.90 1.81 -0.09 -0.92 0.00 0.00 175.35 175.17 2qsh h ARG 248 N -0.27 0.85 -0.50 1.68 2.43 -2.00 -2.20 114.38 114.36 2qsh h ARG 248 Ca -0.44 -0.05 -0.12 0.00 -0.81 0.00 0.00 59.98 58.56 2qsh h ARG 248 Cb 1.29 -0.19 -0.02 0.00 -0.42 0.00 0.00 29.97 30.63 2qsh h ARG 248 CO 0.59 0.56 -0.16 0.77 -1.51 0.00 0.00 179.97 180.23 2qsh h SER 249 N 0.88 0.98 -0.31 -3.80 0.02 -2.00 -2.64 113.55 106.69 2qsh h SER 249 Ca 0.53 -0.34 0.02 0.00 -0.84 0.00 0.00 61.79 61.15 2qsh h SER 249 Cb 0.67 -0.27 -0.02 0.00 0.14 0.00 0.00 62.40 62.91 2qsh h SER 249 CO -0.32 1.12 0.16 0.44 -1.14 0.00 0.00 176.83 177.10 2qsh h ASP 250 N 0.86 0.26 -0.48 3.07 3.32 -1.79 -0.37 116.42 121.29 2qsh h ASP 250 Ca 0.12 0.01 0.09 0.00 0.02 0.00 0.00 57.03 57.27 2qsh h ASP 250 Cb 0.72 -0.04 -0.07 0.00 0.22 0.00 0.00 39.33 40.15 2qsh h ASP 250 CO 0.05 0.19 0.06 0.15 -1.72 0.00 0.00 179.24 177.97 2qsh h PHE 251 N 0.34 0.09 -0.53 4.55 3.57 -1.32 0.16 116.94 123.80 2qsh h PHE 251 Ca 0.12 0.03 -0.04 0.00 3.53 0.00 0.00 57.97 61.62 2qsh h PHE 251 Cb 0.02 0.03 -0.02 0.00 2.79 0.00 0.00 35.95 38.77 2qsh h PHE 251 CO -0.09 -0.04 0.19 -0.07 -2.23 0.00 0.00 178.31 176.07 2qsh h LEU 252 N 0.19 0.75 -0.51 0.59 3.38 -1.05 -0.98 115.31 117.67 2qsh h LEU 252 Ca 0.24 -0.19 -0.04 0.00 0.09 0.00 0.00 57.88 57.99 2qsh h LEU 252 Cb 0.34 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.87 2qsh h LEU 252 CO -0.35 0.74 0.16 -0.09 0.09 0.00 0.00 178.44 178.99 2qsh h ARG 253 N 0.73 0.79 -0.61 1.13 2.43 -0.49 -1.59 114.38 116.77 2qsh h ARG 253 Ca 0.18 -0.17 -0.02 0.00 -0.81 0.00 0.00 59.98 59.15 2qsh h ARG 253 Cb 0.23 -0.12 -0.03 0.00 -0.42 0.00 0.00 29.97 29.64 2qsh h ARG 253 CO -0.01 0.74 0.29 0.00 -1.51 0.00 0.00 179.97 179.48 2qsh h ALA 254 N 1.02 0.79 -0.61 2.80 0.00 -0.42 -0.93 119.26 121.91 2qsh h ALA 254 Ca 0.17 -0.14 -0.09 0.00 0.00 0.00 0.00 54.91 54.85 2qsh h ALA 254 Cb 0.27 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 2qsh h ALA 254 CO -0.01 0.36 0.02 0.28 0.00 0.00 0.00 179.25 179.90 2qsh h VAL 255 N 0.84 1.27 -0.22 0.00 2.07 -0.95 0.59 116.25 119.84 2qsh h VAL 255 Ca 0.21 -1.12 -0.18 0.00 0.82 0.00 0.00 66.70 66.43 2qsh h VAL 255 Cb 0.12 0.79 -0.00 0.00 -1.52 0.00 0.00 31.29 30.68 2qsh h VAL 255 CO -0.03 0.41 -0.57 0.77 0.02 0.00 0.00 177.57 178.17 2qsh h SER 256 N 0.96 0.78 1.70 0.57 4.64 -1.15 -3.03 113.55 118.02 2qsh h SER 256 Ca 0.17 -0.43 0.00 0.00 -0.47 0.00 0.00 61.79 61.07 2qsh h SER 256 Cb 0.53 -0.22 0.00 0.00 -0.31 0.00 0.00 62.40 62.40 2qsh h SER 256 CO 0.03 1.18 0.00 0.11 -0.87 0.00 0.00 176.83 177.28 2qsh h LYS 257 N 0.53 0.00 -1.84 4.77 1.57 -1.12 -3.48 116.57 117.00 2qsh h LYS 257 Ca 0.00 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.75 2qsh h LYS 257 Cb 1.15 0.00 0.01 0.00 0.08 0.00 0.00 32.23 33.47 2qsh h LYS 257 CO 0.12 0.00 -0.06 0.41 -0.57 0.00 0.00 179.45 179.34 2qsh n GLY 258 N 1.02 0.61 2.96 3.86 0.00 0.04 -4.72 105.19 108.97 2qsh n GLY 258 Ca 0.04 -0.52 -0.27 0.00 0.00 0.00 0.00 46.02 45.27 2qsh n GLY 258 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2qsh s HIS 259 N -3.03 1.68 0.00 1.61 4.02 -0.30 -2.51 115.29 116.76 2qsh s HIS 259 Ca 0.03 -0.83 0.00 0.00 1.02 0.00 0.00 55.06 55.27 2qsh s HIS 259 Cb -0.01 -1.31 0.00 0.00 -1.02 0.00 0.00 32.58 30.24 2qsh s HIS 259 CO 0.06 -0.51 0.00 0.41 1.02 0.00 0.00 174.74 175.72 2qsh n GLY 260 N 4.68 1.21 3.63 -2.22 0.00 -1.11 -4.58 105.19 106.81 2qsh n GLY 260 Ca -0.16 -1.35 -0.29 0.00 0.00 0.00 0.00 46.02 44.23 2qsh n GLY 260 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 2qsh s ASP 261 N 0.00 2.32 0.55 1.61 1.47 -1.26 -2.58 116.67 118.77 2qsh s ASP 261 Ca 0.00 1.42 0.25 0.00 1.18 0.00 0.00 52.55 55.40 2qsh s ASP 261 Cb 0.00 -2.11 1.44 0.00 -0.34 0.00 0.00 42.92 41.91 2qsh s ASP 261 CO 0.00 -3.35 2.04 -0.65 0.68 0.00 0.00 175.17 173.89 2qsh h PRO 262 N -2.04 0.00 -0.17 2.11 0.11 -1.94 -2.36 132.00 127.70 2qsh h PRO 262 Ca -0.55 0.00 -0.04 0.00 0.11 0.00 0.00 66.00 65.52 2qsh h PRO 262 Cb 1.32 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.42 2qsh h PRO 262 CO 0.54 0.00 -0.04 -0.44 -0.21 0.00 0.00 178.00 177.84 2qsh h ASP 263 N 0.00 0.33 -0.42 -2.05 5.19 -1.95 -2.75 116.42 114.76 2qsh h ASP 263 Ca 0.17 -0.37 -0.04 0.00 -0.62 0.00 0.00 57.03 56.17 2qsh h ASP 263 Cb 0.73 -0.09 -0.02 0.00 0.18 0.00 0.00 39.33 40.13 2qsh h ASP 263 CO -0.00 0.62 0.13 0.40 -3.12 0.00 0.00 179.24 177.27 2qsh h ILE 264 N 0.03 1.21 0.40 0.35 2.04 -1.82 -2.13 117.51 117.58 2qsh h ILE 264 Ca 0.04 -0.73 -0.01 0.00 1.00 0.00 0.00 64.86 65.16 2qsh h ILE 264 Cb 0.48 0.70 -0.01 0.00 -0.74 0.00 0.00 36.82 37.25 2qsh h ILE 264 CO 0.02 0.27 -0.33 -1.28 0.00 0.00 0.00 178.15 176.82 2qsh h SER 265 N 0.71 -0.90 -0.85 1.72 0.87 -1.29 -0.27 113.55 113.54 2qsh h SER 265 Ca 0.16 0.07 0.14 0.00 -1.23 0.00 0.00 61.79 60.93 2qsh h SER 265 Cb 0.25 0.29 -0.06 0.00 -0.44 0.00 0.00 62.40 62.43 2qsh h SER 265 CO -0.00 -0.46 0.55 -0.37 -0.53 0.00 0.00 176.83 176.02 2qsh h VAL 266 N -0.72 0.83 -0.27 2.23 -1.51 -1.41 -0.34 116.25 115.06 2qsh h VAL 266 Ca -0.05 -0.22 -0.00 0.00 -1.23 0.00 0.00 66.70 65.20 2qsh h VAL 266 Cb 0.60 0.15 -0.01 0.00 -2.13 0.00 0.00 31.29 29.90 2qsh h VAL 266 CO -0.01 0.12 0.15 1.56 -1.23 0.00 0.00 177.57 178.16 2qsh h GLN 267 N 0.63 0.38 -0.98 5.19 4.20 -1.13 -0.16 115.11 123.23 2qsh h GLN 267 Ca 0.42 -0.04 0.13 0.00 0.06 0.00 0.00 58.65 59.22 2qsh h GLN 267 Cb 0.73 -0.07 -0.09 0.00 0.30 0.00 0.00 27.48 28.35 2qsh h GLN 267 CO -0.18 0.32 0.60 0.78 -0.67 0.00 0.00 178.83 179.69 2qsh h GLY 268 N 0.33 1.62 0.81 3.46 0.00 0.33 -1.94 103.07 107.69 2qsh h GLY 268 Ca 0.10 -0.40 -0.00 0.00 0.00 0.00 0.00 47.33 47.02 2qsh h GLY 268 CO -0.02 0.12 0.01 -2.75 0.00 0.00 0.00 176.54 173.91 2qsh h PHE 269 N 0.93 0.07 -0.87 5.60 3.57 -0.06 -1.11 116.94 125.07 2qsh h PHE 269 Ca 0.50 -0.01 0.12 0.00 3.53 0.00 0.00 57.97 62.11 2qsh h PHE 269 Cb 0.54 -0.02 -0.08 0.00 2.79 0.00 0.00 35.95 39.17 2qsh h PHE 269 CO -0.01 0.25 0.50 0.28 -2.23 0.00 0.00 178.31 177.09 2qsh h VAL 270 N -0.12 0.84 -0.76 1.41 2.07 -0.66 0.78 116.25 119.81 2qsh h VAL 270 Ca 0.01 -0.26 0.02 0.00 0.82 0.00 0.00 66.70 67.29 2qsh h VAL 270 Cb 0.21 0.00 -0.04 0.00 -1.52 0.00 0.00 31.29 29.94 2qsh h VAL 270 CO -0.00 0.14 0.50 0.00 0.02 0.00 0.00 177.57 178.23 2qsh h ALA 271 N 1.51 1.51 -0.09 1.67 0.00 -0.81 -1.60 119.26 121.45 2qsh h ALA 271 Ca 0.45 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 55.30 2qsh h ALA 271 Cb 0.51 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 18.01 2qsh h ALA 271 CO -0.30 0.43 -0.01 1.98 0.00 0.00 0.00 179.25 181.36 2qsh h MET 272 N 0.97 0.16 -0.72 0.00 -1.53 0.39 -1.78 114.93 112.42 2qsh h MET 272 Ca 0.29 -0.05 0.05 0.00 -3.44 0.00 0.00 59.70 56.54 2qsh h MET 272 Cb -0.02 -0.01 -0.04 0.00 -0.55 0.00 0.00 31.60 30.97 2qsh h MET 272 CO -0.08 0.44 0.47 -0.07 0.14 0.00 0.00 176.91 177.82 2qsh h LEU 273 N -0.13 0.71 -0.55 3.39 3.38 -1.01 -1.68 115.31 119.42 2qsh h LEU 273 Ca 0.02 -0.00 -0.16 0.00 0.09 0.00 0.00 57.88 57.83 2qsh h LEU 273 Cb 0.37 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.95 2qsh h LEU 273 CO 0.01 0.48 -0.55 0.03 0.09 0.00 0.00 178.44 178.49 2qsh h ARG 274 N 0.82 0.50 -0.49 1.13 3.08 -1.20 -0.75 114.38 117.47 2qsh h ARG 274 Ca 0.30 -0.32 0.08 0.00 0.07 0.00 0.00 59.98 60.11 2qsh h ARG 274 Cb 0.14 0.04 -0.03 0.00 0.08 0.00 0.00 29.97 30.20 2qsh h ARG 274 CO -0.09 0.92 0.33 0.00 -1.07 0.00 0.00 179.97 180.06 2qsh h ALA 275 N 1.01 2.01 -0.37 0.04 0.00 -0.41 0.32 119.26 121.86 2qsh h ALA 275 Ca 0.01 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2qsh h ALA 275 Cb 1.08 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.80 2qsh h ALA 275 CO 0.10 -0.11 0.00 0.00 0.00 0.00 0.00 179.25 179.24 2qsh n ASN 277 N 0.48 -5.98 -4.90 0.00 2.85 0.11 -4.99 115.26 102.84 2qsh n ASN 277 Ca 0.16 -0.28 -0.33 0.00 -0.11 0.00 0.00 54.58 54.03 2qsh n ASN 277 Cb 0.70 -4.84 -0.05 0.00 1.24 0.00 0.00 39.78 36.83 2qsh n ASN 277 CO 0.00 0.00 0.00 0.68 -2.11 0.00 0.00 177.26 175.83 2qsh s VAL 278 N -3.16 5.38 -1.24 3.44 -7.23 -0.37 -5.01 120.40 112.21 2qsh s VAL 278 Ca 0.29 -0.14 -0.19 0.00 -1.81 0.00 0.00 61.98 60.13 2qsh s VAL 278 Cb -0.13 -3.58 0.05 0.00 0.56 0.00 0.00 36.38 33.28 2qsh s VAL 278 CO 0.36 0.26 1.72 0.21 -0.31 0.00 0.00 175.10 177.34 2qsh s ASN 279 N -2.09 6.56 -0.22 4.85 3.84 -1.26 -4.19 114.94 122.44 2qsh s ASN 279 Ca 0.31 -2.19 -0.07 0.00 0.21 0.00 0.00 52.86 51.12 2qsh s ASN 279 Cb -0.13 -2.58 -0.03 0.00 -0.55 0.00 0.00 41.25 37.96 2qsh s ASN 279 CO 0.21 -1.45 0.05 0.00 -2.79 0.00 0.00 177.10 173.11 2qsh s ALA 280 N 5.18 3.17 0.14 1.71 0.00 -1.26 -2.49 121.76 128.21 2qsh s ALA 280 Ca 0.55 -1.00 -0.13 0.00 0.00 0.00 0.00 51.96 51.37 2qsh s ALA 280 Cb 0.03 -1.95 -0.07 0.00 0.00 0.00 0.00 23.12 21.13 2qsh s ALA 280 CO 0.06 -0.23 0.53 1.03 0.00 0.00 0.00 175.76 177.15 2qsh s ARG 281 N 1.15 3.94 -0.02 0.00 0.52 0.12 -4.43 118.95 120.24 2qsh s ARG 281 Ca 0.04 0.44 -0.24 0.00 -0.52 0.00 0.00 55.73 55.45 2qsh s ARG 281 Cb -0.14 -2.92 -0.04 0.00 0.52 0.00 0.00 34.95 32.36 2qsh s ARG 281 CO 0.03 0.48 0.71 -1.17 0.02 0.00 0.00 175.30 175.37 2qsh s LEU 282 N -2.00 4.38 -0.13 2.53 2.96 -0.27 -2.22 118.68 123.93 2qsh s LEU 282 Ca 0.38 1.28 -0.01 0.00 -0.22 0.00 0.00 54.13 55.56 2qsh s LEU 282 Cb -0.15 -3.12 -0.02 0.00 0.50 0.00 0.00 46.19 43.41 2qsh s LEU 282 CO 0.19 -0.04 -0.12 -0.63 -1.32 0.00 0.00 176.35 174.43 2qsh s ILE 283 N 0.37 3.17 -0.14 6.68 -1.09 0.69 -0.78 121.20 130.10 2qsh s ILE 283 Ca 0.37 -0.62 0.01 0.00 -2.23 0.00 0.00 60.65 58.18 2qsh s ILE 283 Cb -0.19 -2.34 0.02 0.00 -1.58 0.00 0.00 42.46 38.37 2qsh s ILE 283 CO 0.20 0.52 -0.17 -0.32 -1.23 0.00 0.00 174.94 173.94 2qsh s MET 284 N 0.36 2.51 -0.71 2.79 -2.45 0.22 -1.60 119.30 120.42 2qsh s MET 284 Ca -0.10 -0.65 -0.20 0.00 -1.25 0.00 0.00 55.69 53.49 2qsh s MET 284 Cb -0.16 -2.17 0.10 0.00 1.25 0.00 0.00 34.83 33.86 2qsh s MET 284 CO 0.05 -0.14 0.90 0.45 1.05 0.00 0.00 175.02 177.33 2qsh s SER 285 N 1.19 6.31 0.05 1.11 0.15 0.86 -0.77 113.70 122.60 2qsh s SER 285 Ca -0.01 -1.49 -0.31 0.00 0.70 0.00 0.00 55.95 54.85 2qsh s SER 285 Cb -0.14 -2.36 -0.07 0.00 -1.71 0.00 0.00 66.02 61.74 2qsh s SER 285 CO -0.07 -1.19 1.39 0.00 1.20 0.00 0.00 173.24 174.58 2qsh n GLN 287 N 4.69 2.83 -1.03 0.00 1.13 -1.26 -4.40 117.38 119.34 2qsh n GLN 287 Ca 0.12 -4.75 -0.30 0.00 -1.94 0.00 0.00 57.00 50.13 2qsh n GLN 287 Cb 0.43 -2.25 0.15 0.00 0.11 0.00 0.00 30.24 28.68 2qsh n GLN 287 CO 0.00 0.00 0.00 -1.25 -1.44 0.00 0.00 177.06 174.37 2qsh s PRO 288 N -2.89 1.16 0.57 -1.09 0.04 -1.26 -4.18 135.00 127.35 2qsh s PRO 288 Ca 0.44 1.05 -0.19 0.00 0.04 0.00 0.00 61.00 62.33 2qsh s PRO 288 Cb 0.20 -1.78 -0.04 0.00 0.04 0.00 0.00 34.50 32.92 2qsh s PRO 288 CO -0.06 -2.38 1.17 -1.25 0.04 0.00 0.00 177.00 174.52 2qsh s PRO 289 N -4.81 3.13 -0.54 0.56 0.04 -1.26 -4.79 135.00 127.33 2qsh s PRO 289 Ca 0.64 1.72 -0.27 0.00 0.04 0.00 0.00 61.00 63.14 2qsh s PRO 289 Cb -0.20 -1.96 0.03 0.00 0.04 0.00 0.00 34.50 32.41 2qsh s PRO 289 CO 0.58 -1.05 1.07 0.34 0.04 0.00 0.00 177.00 177.98 2qsh s ASP 290 N -1.69 6.45 0.00 6.66 2.15 -1.26 -4.74 116.67 124.24 2qsh s ASP 290 Ca 0.75 0.03 0.19 0.00 0.43 0.00 0.00 52.55 53.95 2qsh s ASP 290 Cb -0.27 -2.50 0.85 0.00 -0.30 0.00 0.00 42.92 40.70 2qsh s ASP 290 CO 0.31 -1.31 1.59 2.22 -0.17 0.00 0.00 175.17 177.80 2qsh n PHE 291 N 7.88 0.00 0.12 -5.34 1.16 -1.26 -1.44 117.46 118.58 2qsh n PHE 291 Ca 0.07 0.00 0.01 0.00 -1.87 0.00 0.00 57.45 55.66 2qsh n PHE 291 Cb 0.48 -0.41 -0.00 0.00 -1.61 0.00 0.00 39.48 37.94 2qsh n PHE 291 CO 0.00 0.00 0.00 1.15 -1.87 0.00 0.00 176.76 176.04 2qsh h THR 292 N 0.00 0.95 -2.51 1.97 2.02 -1.91 -3.44 112.91 110.00 2qsh h THR 292 Ca 0.00 -2.37 -0.54 0.00 0.77 0.00 0.00 66.41 64.27 2qsh h THR 292 Cb 0.26 2.45 -0.04 0.00 -1.74 0.00 0.00 68.15 69.08 2qsh h THR 292 CO 0.00 0.54 1.22 0.21 0.37 0.00 0.00 175.52 177.87 2qsh s ASN 293 N -6.44 5.79 -0.02 4.18 3.84 -0.52 -4.83 114.94 116.94 2qsh s ASN 293 Ca 0.03 0.54 0.18 0.00 0.21 0.00 0.00 52.86 53.82 2qsh s ASN 293 Cb 0.08 -2.54 0.55 0.00 -0.55 0.00 0.00 41.25 38.79 2qsh s ASN 293 CO 0.76 -1.93 1.45 0.23 -2.79 0.00 0.00 177.10 174.82 2qsh n MET 294 N 8.78 2.56 -2.35 0.43 2.81 -1.26 -4.99 117.12 123.10 2qsh n MET 294 Ca 0.17 -2.21 -0.34 0.00 -1.81 0.00 0.00 57.70 53.51 2qsh n MET 294 Cb 0.50 -1.53 -0.01 0.00 -0.71 0.00 0.00 33.22 31.46 2qsh n MET 294 CO 0.00 0.00 0.00 0.15 1.51 0.00 0.00 175.97 177.63 2qsh s LYS 295 N -1.30 3.54 -0.05 0.03 1.02 -1.25 -0.89 119.74 120.84 2qsh s LYS 295 Ca 0.41 1.44 -0.01 0.00 0.02 0.00 0.00 55.97 57.82 2qsh s LYS 295 Cb 0.22 -2.05 -0.01 0.00 -0.52 0.00 0.00 37.83 35.48 2qsh s LYS 295 CO 0.26 -0.66 0.07 0.82 -0.92 0.00 0.00 175.35 174.93 2qsh h ILE 296 N 1.24 0.00 -3.04 2.17 2.04 -1.85 -3.42 117.51 114.66 2qsh h ILE 296 Ca -0.49 -0.53 -0.57 0.00 1.00 0.00 0.00 64.86 64.26 2qsh h ILE 296 Cb 1.24 0.00 -0.05 0.00 -0.74 0.00 0.00 36.82 37.27 2qsh h ILE 296 CO 0.58 0.00 0.88 -0.62 0.00 0.00 0.00 178.15 178.99 2qsh s ASP 297 N -4.36 6.94 -0.37 1.72 -1.08 -1.26 -4.85 116.67 113.41 2qsh s ASP 297 Ca -0.01 1.46 0.07 0.00 -0.52 0.00 0.00 52.55 53.56 2qsh s ASP 297 Cb 0.00 -2.54 0.44 0.00 -1.46 0.00 0.00 42.92 39.36 2qsh s ASP 297 CO 0.02 -0.80 1.13 0.35 0.52 0.00 0.00 175.17 176.39 2qsh n THR 298 N 5.55 2.29 -2.12 1.71 -2.24 -1.26 -5.08 114.28 113.13 2qsh n THR 298 Ca 0.13 -4.48 -0.34 0.00 -2.27 0.00 0.00 64.05 57.09 2qsh n THR 298 Cb 0.46 -0.99 0.01 0.00 -2.10 0.00 0.00 70.33 67.71 2qsh n THR 298 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 2qsh s SER 299 N -3.54 5.66 0.18 3.42 0.01 -1.26 -4.79 113.70 113.37 2qsh s SER 299 Ca 0.47 2.01 0.11 0.00 1.31 0.00 0.00 55.95 59.85 2qsh s SER 299 Cb 0.40 -2.56 -0.04 0.00 0.21 0.00 0.00 66.02 64.03 2qsh s SER 299 CO -0.09 -1.25 -0.24 -0.76 0.41 0.00 0.00 173.24 171.30 2qsh s LEU 300 N -4.20 2.41 -0.04 2.44 1.43 -1.26 -5.11 118.68 114.34 2qsh s LEU 300 Ca 0.68 -0.84 -0.30 0.00 -1.03 0.00 0.00 54.13 52.65 2qsh s LEU 300 Cb -0.20 -1.16 -0.04 0.00 0.03 0.00 0.00 46.19 44.82 2qsh s LEU 300 CO 0.32 0.13 1.35 0.21 0.23 0.00 0.00 176.35 178.59 2qsh s ASN 301 N -2.52 6.90 0.28 2.29 3.04 -1.26 -4.94 114.94 118.73 2qsh s ASN 301 Ca 0.19 1.99 0.14 0.00 0.04 0.00 0.00 52.86 55.21 2qsh s ASN 301 Cb -0.08 -2.55 0.27 0.00 -1.54 0.00 0.00 41.25 37.35 2qsh s ASN 301 CO 0.09 -0.71 1.54 1.23 -3.04 0.00 0.00 177.10 176.21 2qsh h GLY 302 N 8.65 0.00 -5.52 1.21 0.00 -2.00 -3.42 103.07 101.99 2qsh h GLY 302 Ca -0.35 0.00 -0.65 0.00 0.00 0.00 0.00 47.33 46.32 2qsh h GLY 302 CO 0.91 0.00 0.72 -2.01 0.00 0.00 0.00 176.54 176.16 2qsh n ASN 303 N -3.47 2.44 -4.47 0.19 4.05 -1.26 -1.83 115.26 110.91 2qsh n ASN 303 Ca 0.00 1.08 -0.41 0.00 0.45 0.00 0.00 54.58 55.70 2qsh n ASN 303 Cb 0.68 -1.27 -0.07 0.00 1.23 0.00 0.00 39.78 40.34 2qsh n ASN 303 CO 0.00 0.00 0.00 0.59 -3.05 0.00 0.00 177.26 174.80 2qsh n ASN 304 N 3.87 -1.94 0.28 1.20 3.02 -1.26 -4.85 115.26 115.57 2qsh n ASN 304 Ca 0.20 -1.21 -0.16 0.00 -0.03 0.00 0.00 54.58 53.38 2qsh n ASN 304 Cb 0.22 -1.82 -0.08 0.00 -0.61 0.00 0.00 39.78 37.48 2qsh n ASN 304 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2qsh h ALA 305 N 0.87 -0.66 0.26 5.41 0.00 -1.61 -2.64 119.26 120.90 2qsh h ALA 305 Ca -0.60 -0.15 -0.01 0.00 0.00 0.00 0.00 54.91 54.14 2qsh h ALA 305 Cb 1.39 0.25 0.00 0.00 0.00 0.00 0.00 17.79 19.44 2qsh h ALA 305 CO 0.87 -0.85 -0.13 -0.92 0.00 0.00 0.00 179.25 178.22 2qsh h TYR 306 N -0.69 -0.33 -0.95 0.00 3.20 -1.89 -2.09 116.97 114.23 2qsh h TYR 306 Ca -0.07 -0.01 0.07 0.00 3.14 0.00 0.00 58.73 61.86 2qsh h TYR 306 Cb 0.52 0.11 -0.06 0.00 1.54 0.00 0.00 36.73 38.84 2qsh h TYR 306 CO -0.03 -0.20 0.61 0.87 -1.64 0.00 0.00 178.16 177.77 2qsh h LYS 307 N -0.36 1.05 -0.09 1.82 6.56 -1.96 -1.20 116.57 122.40 2qsh h LYS 307 Ca -0.04 -0.06 -0.14 0.00 -1.06 0.00 0.00 60.65 59.35 2qsh h LYS 307 Cb 0.27 -0.24 -0.01 0.00 -0.57 0.00 0.00 32.23 31.68 2qsh h LYS 307 CO 0.06 0.70 -0.58 -0.44 -2.06 0.00 0.00 179.45 177.13 2qsh h ASP 308 N 1.09 0.31 -0.34 0.86 3.32 -1.42 -3.09 116.42 117.15 2qsh h ASP 308 Ca 0.41 -0.17 -0.11 0.00 0.02 0.00 0.00 57.03 57.18 2qsh h ASP 308 Cb 0.19 -0.09 -0.02 0.00 0.22 0.00 0.00 39.33 39.64 2qsh h ASP 308 CO -0.16 0.82 -0.19 -0.03 -1.72 0.00 0.00 179.24 177.96 2qsh h MET 309 N 0.21 0.82 -0.56 3.56 4.05 -0.52 -3.07 114.93 119.41 2qsh h MET 309 Ca -0.00 -0.32 0.00 0.00 -0.28 0.00 0.00 59.70 59.10 2qsh h MET 309 Cb 1.08 -0.04 0.00 0.00 -0.80 0.00 0.00 31.60 31.84 2qsh h MET 309 CO 0.09 0.94 0.00 1.33 0.23 0.00 0.00 176.91 179.50 2qsh n VAL 310 N -4.12 0.80 0.15 -5.77 0.24 -0.77 -4.24 118.33 104.62 2qsh n VAL 310 Ca 0.00 -0.75 0.02 0.00 -2.04 0.00 0.00 64.34 61.58 2qsh n VAL 310 Cb 0.42 0.34 0.37 0.00 -1.47 0.00 0.00 33.84 33.50 2qsh n VAL 310 CO 0.00 0.00 0.00 0.50 -2.14 0.00 0.00 176.83 175.19 2qsh h LYS 311 N 3.21 0.12 -5.47 7.34 3.64 -1.45 -3.43 116.57 120.53 2qsh h LYS 311 Ca 0.00 -0.04 -0.44 0.00 -1.27 0.00 0.00 60.65 58.90 2qsh h LYS 311 Cb 0.78 -0.01 -0.22 0.00 -0.41 0.00 0.00 32.23 32.36 2qsh h LYS 311 CO 0.02 0.38 -0.79 0.71 -2.27 0.00 0.00 179.45 177.49 2qsh s TYR 312 N -4.45 1.31 0.51 1.91 1.51 -1.26 -4.88 117.35 112.01 2qsh s TYR 312 Ca -0.04 -0.43 -0.06 0.00 -1.01 0.00 0.00 57.07 55.53 2qsh s TYR 312 Cb 0.15 -0.74 -0.03 0.00 -0.11 0.00 0.00 41.96 41.22 2qsh s TYR 312 CO 0.73 0.07 0.83 -1.25 -1.11 0.00 0.00 175.55 174.82 2qsh s PRO 313 N -1.62 3.48 -0.15 -1.71 0.04 -1.26 -5.02 135.00 128.76 2qsh s PRO 313 Ca 0.00 0.25 -0.06 0.00 0.04 0.00 0.00 61.00 61.24 2qsh s PRO 313 Cb -0.10 -2.33 -0.24 0.00 0.04 0.00 0.00 34.50 31.88 2qsh s PRO 313 CO 0.02 -0.31 0.26 -0.89 0.04 0.00 0.00 177.00 176.13 2qsh n ILE 314 N -2.36 1.73 -4.47 0.56 2.08 -1.26 -4.89 119.36 110.74 2qsh n ILE 314 Ca 0.02 -0.63 -0.34 0.00 0.56 0.00 0.00 62.75 62.36 2qsh n ILE 314 Cb 0.55 -1.69 -0.10 0.00 -0.75 0.00 0.00 39.64 37.65 2qsh n ILE 314 CO 0.00 0.00 0.00 -0.36 0.56 0.00 0.00 176.55 176.75 2qsh s PHE 315 N -2.55 3.01 0.00 1.39 0.40 -1.26 -0.10 117.98 118.88 2qsh s PHE 315 Ca -0.25 0.07 0.00 0.00 -0.60 0.00 0.00 56.93 56.15 2qsh s PHE 315 Cb 0.07 -1.71 0.00 0.00 0.51 0.00 0.00 43.02 41.89 2qsh s PHE 315 CO 0.74 0.40 0.00 -2.67 0.70 0.00 0.00 175.22 174.38 2qsh n TRP 316 N 1.96 -0.29 -4.33 0.36 2.14 -0.63 -4.97 117.44 111.69 2qsh n TRP 316 Ca -0.17 0.00 -0.20 0.00 2.07 0.00 0.00 57.50 59.20 2qsh n TRP 316 Cb 0.53 0.00 -0.13 0.00 -0.81 0.00 0.00 31.31 30.90 2qsh n TRP 316 CO 0.00 0.00 0.00 0.00 2.07 0.00 0.00 177.69 179.76 2qsh s GLU 318 N -1.23 1.21 -0.06 0.00 2.02 -0.94 -0.13 118.70 119.57 2qsh s GLU 318 Ca 0.01 -0.58 0.03 0.00 0.02 0.00 0.00 54.97 54.46 2qsh s GLU 318 Cb -0.08 -1.18 0.00 0.00 0.10 0.00 0.00 34.13 32.97 2qsh s GLU 318 CO 0.01 0.32 -0.16 0.08 0.02 0.00 0.00 175.26 175.54 2qsh s VAL 319 N -0.42 1.39 0.03 2.63 1.01 0.53 0.14 120.40 125.72 2qsh s VAL 319 Ca 0.06 -0.65 -0.30 0.00 0.00 0.00 0.00 61.98 61.08 2qsh s VAL 319 Cb -0.06 -1.23 -0.04 0.00 0.00 0.00 0.00 36.38 35.05 2qsh s VAL 319 CO -0.00 0.41 1.02 0.86 0.00 0.00 0.00 175.10 177.39 2qsh s TRP 320 N 0.38 3.63 -0.42 5.22 -0.11 -1.04 0.11 118.94 126.72 2qsh s TRP 320 Ca -0.11 1.63 -0.08 0.00 1.22 0.00 0.00 56.10 58.76 2qsh s TRP 320 Cb -0.15 -3.17 0.08 0.00 -1.50 0.00 0.00 33.47 28.73 2qsh s TRP 320 CO 0.04 -0.24 0.25 0.34 -4.62 0.00 0.00 176.95 172.71 2qsh s ASP 321 N 0.90 5.55 0.39 5.86 3.68 -0.75 -4.83 116.67 127.47 2qsh s ASP 321 Ca 0.53 -1.59 0.28 0.00 2.13 0.00 0.00 52.55 53.90 2qsh s ASP 321 Cb -0.23 -1.95 1.24 0.00 -1.45 0.00 0.00 42.92 40.52 2qsh s ASP 321 CO 0.29 -0.54 1.85 0.07 0.13 0.00 0.00 175.17 176.97 2qsh h LYS 322 N 8.34 0.00 0.14 4.34 2.10 -1.95 0.29 116.57 129.83 2qsh h LYS 322 Ca -0.21 0.00 -0.28 0.00 -2.00 0.00 0.00 60.65 58.16 2qsh h LYS 322 Cb 1.08 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.41 2qsh h LYS 322 CO 0.75 0.00 -1.37 0.74 -2.00 0.00 0.00 179.45 177.57 2qsh h PHE 323 N 0.00 0.52 0.00 0.07 -1.00 -1.93 -3.34 116.94 111.26 2qsh h PHE 323 Ca 0.00 -0.38 0.00 0.00 2.81 0.00 0.00 57.97 60.40 2qsh h PHE 323 Cb 0.35 -0.02 0.00 0.00 3.61 0.00 0.00 35.95 39.89 2qsh h PHE 323 CO 0.00 1.53 -0.87 -1.13 -1.61 0.00 0.00 178.31 176.23 2qsh n SER 324 N -3.90 0.82 -3.08 2.17 3.41 -1.23 -4.91 113.62 106.90 2qsh n SER 324 Ca -0.23 -0.73 -0.14 0.00 -0.26 0.00 0.00 58.87 57.50 2qsh n SER 324 Cb 0.92 0.79 0.07 0.00 -0.26 0.00 0.00 64.21 65.74 2qsh n SER 324 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2qsh n LYS 325 N -1.53 -5.11 -3.86 4.33 4.01 0.07 -5.05 118.16 111.03 2qsh n LYS 325 Ca 0.04 0.73 -0.11 0.00 -0.51 0.00 0.00 58.31 58.46 2qsh n LYS 325 Cb 0.34 -5.38 -0.10 0.00 -0.51 0.00 0.00 35.03 29.39 2qsh n LYS 325 CO 0.00 0.00 0.00 0.15 -1.11 0.00 0.00 177.40 176.44 2qsh s LYS 326 N -5.02 0.53 0.05 1.97 -0.14 -1.10 -4.89 119.74 111.14 2qsh s LYS 326 Ca 0.06 -0.41 -0.30 0.00 -1.36 0.00 0.00 55.97 53.96 2qsh s LYS 326 Cb -0.01 0.22 -0.05 0.00 -1.68 0.00 0.00 37.83 36.31 2qsh s LYS 326 CO 0.63 -0.13 1.16 -1.58 -0.76 0.00 0.00 175.35 174.67 2qsh s TRP 327 N -1.52 3.48 -0.12 3.18 0.52 -1.26 -1.82 118.94 121.40 2qsh s TRP 327 Ca -0.14 1.37 -0.12 0.00 0.02 0.00 0.00 56.10 57.24 2qsh s TRP 327 Cb -0.07 -3.37 -0.05 0.00 -1.15 0.00 0.00 33.47 28.84 2qsh s TRP 327 CO 0.01 -1.05 0.26 0.42 0.02 0.00 0.00 176.95 176.61 2qsh s ILE 328 N 1.03 5.31 -0.07 2.03 1.01 0.12 -4.68 121.20 125.95 2qsh s ILE 328 Ca 0.57 0.48 -0.18 0.00 0.00 0.00 0.00 60.65 61.52 2qsh s ILE 328 Cb -0.28 -3.57 -0.05 0.00 0.01 0.00 0.00 42.46 38.57 2qsh s ILE 328 CO 0.29 0.50 0.49 -0.89 0.00 0.00 0.00 174.94 175.33 2qsh s THR 329 N -0.27 5.10 -0.12 2.92 2.01 -0.12 -0.35 115.64 124.82 2qsh s THR 329 Ca 0.17 0.99 -0.02 0.00 0.31 0.00 0.00 61.69 63.14 2qsh s THR 329 Cb -0.13 -3.82 0.04 0.00 0.01 0.00 0.00 72.50 68.60 2qsh s THR 329 CO 0.05 0.39 0.03 -0.69 -0.69 0.00 0.00 174.62 173.71 2qsh s VAL 330 N 0.13 0.32 -0.36 3.82 1.01 0.82 -0.71 120.40 125.43 2qsh s VAL 330 Ca 0.27 -0.08 0.04 0.00 0.00 0.00 0.00 61.98 62.20 2qsh s VAL 330 Cb -0.16 -0.65 0.10 0.00 0.00 0.00 0.00 36.38 35.67 2qsh s VAL 330 CO 0.12 0.05 0.08 -0.62 0.00 0.00 0.00 175.10 174.73 2qsh s ASP 331 N 1.98 4.66 0.00 3.32 3.68 -0.11 -1.15 116.67 129.06 2qsh s ASP 331 Ca 0.03 -2.24 0.28 0.00 2.13 0.00 0.00 52.55 52.76 2qsh s ASP 331 Cb -0.14 -1.58 1.16 0.00 -1.45 0.00 0.00 42.92 40.91 2qsh s ASP 331 CO -0.06 -0.36 1.81 -0.81 0.13 0.00 0.00 175.17 175.87 2qsh n PRO 332 N 4.14 1.34 -0.00 4.34 -0.04 -1.26 -1.39 135.00 142.12 2qsh n PRO 332 Ca 0.04 -0.67 -0.04 0.00 -0.04 0.00 0.00 63.50 62.79 2qsh n PRO 332 Cb 0.41 -1.49 -0.01 0.00 -0.04 0.00 0.00 33.50 32.37 2qsh n PRO 332 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 2qsh n VAL 333 N -0.25 1.08 0.00 0.52 0.31 -1.26 -4.63 118.33 114.11 2qsh n VAL 333 Ca 0.18 0.22 0.00 0.00 -0.01 0.00 0.00 64.34 64.74 2qsh n VAL 333 Cb 0.31 -1.75 0.00 0.00 -0.91 0.00 0.00 33.84 31.49 2qsh n VAL 333 CO 0.00 0.00 0.00 -3.20 -1.32 0.00 0.00 176.83 172.31 2qsh n ASN 334 N -3.66 0.00 0.04 4.52 2.85 -1.26 -4.47 115.26 113.28 2qsh n ASN 334 Ca -0.07 0.25 0.14 0.00 -0.11 0.00 0.00 54.58 54.78 2qsh n ASN 334 Cb 0.26 -0.27 0.53 0.00 1.24 0.00 0.00 39.78 41.53 2qsh n ASN 334 CO 0.00 0.00 0.00 0.18 -2.11 0.00 0.00 177.26 175.33 2qsh n LEU 335 N -1.40 0.32 -3.91 1.20 4.77 -1.26 -4.97 117.00 111.76 2qsh n LEU 335 Ca 0.00 0.52 -0.27 0.00 -0.03 0.00 0.00 56.01 56.23 2qsh n LEU 335 Cb 0.00 -0.42 -0.01 0.00 -2.33 0.00 0.00 43.42 40.66 2qsh n LEU 335 CO 0.00 -0.07 -0.20 0.29 -1.33 0.00 0.00 177.39 176.08 2qsh n LYS 336 N -1.80 -2.97 -4.22 3.23 5.02 -0.65 -4.99 118.16 111.78 2qsh n LYS 336 Ca 0.06 0.41 -0.13 0.00 -2.02 0.00 0.00 58.31 56.64 2qsh n LYS 336 Cb 0.38 -4.44 -0.10 0.00 -0.02 0.00 0.00 35.03 30.84 2qsh n LYS 336 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 2qsh s THR 337 N -3.87 0.56 -0.10 -0.18 -4.23 -0.49 -4.96 115.64 102.36 2qsh s THR 337 Ca 0.08 -1.96 0.03 0.00 -1.18 0.00 0.00 61.69 58.65 2qsh s THR 337 Cb -0.03 -2.10 0.01 0.00 1.34 0.00 0.00 72.50 71.71 2qsh s THR 337 CO 0.88 -0.47 -0.18 -0.63 -0.54 0.00 0.00 174.62 173.68 2qsh s ILE 338 N -3.74 1.66 0.05 2.99 1.01 -1.26 -0.93 121.20 120.98 2qsh s ILE 338 Ca 0.24 -0.76 0.01 0.00 0.00 0.00 0.00 60.65 60.13 2qsh s ILE 338 Cb 0.06 -1.48 -0.03 0.00 0.01 0.00 0.00 42.46 41.03 2qsh s ILE 338 CO 0.03 0.47 -0.05 -1.83 0.00 0.00 0.00 174.94 173.56 2qsh s GLU 339 N 0.70 0.59 -0.63 2.79 -1.05 0.12 -5.00 118.70 116.21 2qsh s GLU 339 Ca -0.12 -1.01 -0.01 0.00 -0.15 0.00 0.00 54.97 53.68 2qsh s GLU 339 Cb -0.16 -0.04 0.16 0.00 -0.44 0.00 0.00 34.13 33.65 2qsh s GLU 339 CO 0.03 -0.03 0.43 -0.65 0.95 0.00 0.00 175.26 175.98 2qsh s GLN 340 N -2.81 2.50 0.04 -4.83 -0.21 -1.26 -0.94 119.66 112.16 2qsh s GLN 340 Ca -0.01 -2.63 -0.30 0.00 0.02 0.00 0.00 55.36 52.44 2qsh s GLN 340 Cb -0.01 -3.66 -0.08 0.00 1.00 0.00 0.00 33.01 30.26 2qsh s GLN 340 CO -0.04 -1.17 1.77 0.08 -2.12 0.00 0.00 175.29 173.80 2qsh s VAL 341 N -0.24 3.06 0.00 1.09 1.01 -1.26 -4.93 120.40 119.13 2qsh s VAL 341 Ca 0.18 0.34 0.00 0.00 0.00 0.00 0.00 61.98 62.50 2qsh s VAL 341 Cb -0.20 -3.22 0.00 0.00 0.00 0.00 0.00 36.38 32.96 2qsh s VAL 341 CO -0.03 -0.01 0.00 0.54 0.00 0.00 0.00 175.10 175.59 2qsh n ARG 342 N 6.45 0.00 -0.06 2.72 5.12 -1.26 -4.97 116.66 124.66 2qsh n ARG 342 Ca 0.18 0.00 -0.07 0.00 -1.93 0.00 0.00 57.85 56.02 2qsh n ARG 342 Cb 0.41 0.00 -0.08 0.00 -1.16 0.00 0.00 32.46 31.62 2qsh n ARG 342 CO 0.00 0.00 0.00 1.28 -1.93 0.00 0.00 177.63 176.98 2qsh n LEU 343 N -1.34 0.92 -4.38 0.55 7.99 -1.26 -5.03 117.00 114.45 2qsh n LEU 343 Ca 0.00 -0.02 -0.31 0.00 -0.01 0.00 0.00 56.01 55.67 2qsh n LEU 343 Cb 0.00 0.04 -0.14 0.00 -0.11 0.00 0.00 43.42 43.21 2qsh n LEU 343 CO 0.00 0.43 -0.54 -2.28 -1.51 0.00 0.00 177.39 173.49 2qsh s HIS 344 N -2.28 2.43 -0.05 -1.77 2.46 -1.26 -4.64 115.29 110.17 2qsh s HIS 344 Ca -0.10 -0.35 0.04 0.00 0.47 0.00 0.00 55.06 55.12 2qsh s HIS 344 Cb 0.04 -1.47 -0.00 0.00 -0.13 0.00 0.00 32.58 31.02 2qsh s HIS 344 CO 0.43 0.12 -0.18 0.45 -2.47 0.00 0.00 174.74 173.10 2qsh s SER 345 N -1.05 2.22 0.00 9.88 0.15 -1.26 -4.76 113.70 118.88 2qsh s SER 345 Ca 0.12 -0.37 0.14 0.00 0.70 0.00 0.00 55.95 56.54 2qsh s SER 345 Cb -0.10 -0.67 0.63 0.00 -1.71 0.00 0.00 66.02 64.17 2qsh s SER 345 CO 0.02 0.15 1.45 0.29 1.20 0.00 0.00 173.24 176.34 2qsh n LYS 346 N 3.21 0.04 -0.01 5.44 5.02 -1.26 -3.16 118.16 127.44 2qsh n LYS 346 Ca -0.18 0.23 0.10 0.00 -2.02 0.00 0.00 58.31 56.44 2qsh n LYS 346 Cb 0.53 -1.50 -0.15 0.00 -0.02 0.00 0.00 35.03 33.89 2qsh n LYS 346 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 2qsh n LEU 347 N -1.46 0.33 -4.68 -0.35 4.32 -1.26 -4.85 117.00 109.05 2qsh n LEU 347 Ca 0.04 -0.17 -0.42 0.00 -0.02 0.00 0.00 56.01 55.44 2qsh n LEU 347 Cb 0.16 0.00 -0.03 0.00 -1.62 0.00 0.00 43.42 41.93 2qsh n LEU 347 CO 0.13 0.08 1.22 0.00 -1.22 0.00 0.00 177.39 177.60 2qsh s ALA 348 N -3.28 3.62 0.41 -1.18 0.00 -1.19 -4.73 121.76 115.41 2qsh s ALA 348 Ca -0.02 0.93 -0.27 0.00 0.00 0.00 0.00 51.96 52.60 2qsh s ALA 348 Cb 0.14 -3.66 -0.09 0.00 0.00 0.00 0.00 23.12 19.51 2qsh s ALA 348 CO 0.86 -1.09 1.39 -1.25 0.00 0.00 0.00 175.76 175.67 2qsh s PRO 349 N 2.94 3.95 -0.01 0.00 0.04 -1.26 -5.01 135.00 135.65 2qsh s PRO 349 Ca 0.68 2.36 0.03 0.00 0.04 0.00 0.00 61.00 64.11 2qsh s PRO 349 Cb -0.33 -2.81 -0.01 0.00 0.04 0.00 0.00 34.50 31.40 2qsh s PRO 349 CO 0.28 -0.58 -0.10 0.15 0.04 0.00 0.00 177.00 176.78 2qsh s LYS 350 N -2.23 0.90 0.00 4.56 3.01 -1.26 -4.97 119.74 119.75 2qsh s LYS 350 Ca 0.56 -0.37 0.00 0.00 -1.01 0.00 0.00 55.97 55.15 2qsh s LYS 350 Cb -0.42 -0.86 0.00 0.00 -1.01 0.00 0.00 37.83 35.54 2qsh s LYS 350 CO 0.56 0.21 0.00 0.41 0.51 0.00 0.00 175.35 177.03 2qsh n GLY 351 N 2.91 2.45 0.27 -3.33 0.00 -1.26 -4.62 105.19 101.61 2qsh n GLY 351 Ca -0.15 -1.47 0.03 0.00 0.00 0.00 0.00 46.02 44.43 2qsh n GLY 351 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2qsh h VAL 352 N 0.00 0.76 -0.07 1.61 2.07 -1.98 -2.09 116.25 116.54 2qsh h VAL 352 Ca 0.00 -0.18 0.04 0.00 0.82 0.00 0.00 66.70 67.38 2qsh h VAL 352 Cb 0.00 0.20 -0.06 0.00 -1.52 0.00 0.00 31.29 29.91 2qsh h VAL 352 CO 0.00 0.09 -0.35 0.00 0.02 0.00 0.00 177.57 177.34 2qsh h ALA 353 N 1.48 -0.47 0.00 1.67 0.00 -2.00 -2.94 119.26 116.99 2qsh h ALA 353 Ca 0.37 -0.00 -0.04 0.00 0.00 0.00 0.00 54.91 55.24 2qsh h ALA 353 Cb 0.48 0.64 -0.01 0.00 0.00 0.00 0.00 17.79 18.90 2qsh h ALA 353 CO -0.33 -0.85 -0.18 0.00 0.00 0.00 0.00 179.25 177.89 2qsh h GLU 356 N 1.76 0.00 -0.00 0.00 4.57 -1.43 -3.33 114.58 116.15 2qsh h GLU 356 Ca 0.00 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.18 2qsh h GLU 356 Cb 0.39 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.98 2qsh h GLU 356 CO 0.00 0.40 0.00 0.54 -1.18 0.00 0.00 179.01 178.77 2qsh n ARG 357 N -3.11 -0.28 -3.30 1.92 1.74 -1.18 -4.85 116.66 107.60 2qsh n ARG 357 Ca -0.01 -0.70 -0.19 0.00 -0.77 0.00 0.00 57.85 56.18 2qsh n ARG 357 Cb 0.74 -1.02 -0.08 0.00 -1.02 0.00 0.00 32.46 31.09 2qsh n ARG 357 CO 0.00 0.00 0.00 1.21 -1.52 0.00 0.00 177.63 177.32 2qsh s ASN 358 N -0.21 1.06 -0.44 0.55 3.84 -0.98 -1.50 114.94 117.26 2qsh s ASN 358 Ca 0.01 -2.02 -0.12 0.00 0.21 0.00 0.00 52.86 50.94 2qsh s ASN 358 Cb 0.01 0.40 0.07 0.00 -0.55 0.00 0.00 41.25 41.18 2qsh s ASN 358 CO 0.01 -0.21 0.31 -0.32 -2.79 0.00 0.00 177.10 174.10 2qsh s MET 359 N 0.99 2.78 -0.38 0.43 -2.45 -1.26 -4.21 119.30 115.20 2qsh s MET 359 Ca 0.22 -1.38 -0.29 0.00 -1.25 0.00 0.00 55.69 53.00 2qsh s MET 359 Cb -0.10 -3.93 0.00 0.00 1.25 0.00 0.00 34.83 32.06 2qsh s MET 359 CO -0.06 -0.96 1.46 -1.17 1.05 0.00 0.00 175.02 175.33 2qsh s LEU 360 N 1.53 3.63 0.00 4.11 0.20 -1.26 -4.70 118.68 122.19 2qsh s LEU 360 Ca 0.03 0.98 0.00 0.00 0.69 0.00 0.00 54.13 55.83 2qsh s LEU 360 Cb -0.23 -3.54 0.00 0.00 -0.43 0.00 0.00 46.19 41.99 2qsh s LEU 360 CO 0.04 -1.41 0.00 -2.11 -0.29 0.00 0.00 176.35 172.58 2qsh n ARG 361 N 8.00 2.97 -3.58 1.98 0.00 -1.26 -4.88 116.66 119.89 2qsh n ARG 361 Ca 0.17 0.00 -0.28 0.00 -0.00 0.00 0.00 57.85 57.74 2qsh n ARG 361 Cb 0.47 -0.35 -0.11 0.00 -0.00 0.00 0.00 32.46 32.47 2qsh n ARG 361 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.63 178.34 2qsh s TYR 362 N -0.30 1.83 -0.40 2.89 2.02 -1.26 -4.93 117.35 117.20 2qsh s TYR 362 Ca 0.00 -2.55 -0.21 0.00 -0.37 0.00 0.00 57.07 53.95 2qsh s TYR 362 Cb 0.00 -1.53 0.01 0.00 -0.40 0.00 0.00 41.96 40.05 2qsh s TYR 362 CO 0.00 -0.75 0.64 0.08 -1.57 0.00 0.00 175.55 173.96 2qsh s VAL 363 N -0.20 4.85 -0.09 0.71 1.01 -1.26 -1.71 120.40 123.70 2qsh s VAL 363 Ca 0.27 0.34 0.00 0.00 0.00 0.00 0.00 61.98 62.59 2qsh s VAL 363 Cb -0.05 -4.15 -0.02 0.00 0.00 0.00 0.00 36.38 32.16 2qsh s VAL 363 CO -0.14 -0.48 -0.09 -0.63 0.00 0.00 0.00 175.10 173.76 2qsh s ILE 364 N 2.79 3.44 -0.17 2.22 1.09 0.05 0.29 121.20 130.90 2qsh s ILE 364 Ca 0.24 -0.56 -0.05 0.00 -1.10 0.00 0.00 60.65 59.18 2qsh s ILE 364 Cb -0.14 -2.42 -0.03 0.00 -1.06 0.00 0.00 42.46 38.81 2qsh s ILE 364 CO 0.17 0.56 -0.01 0.00 -0.10 0.00 0.00 174.94 175.57 2qsh s ALA 365 N -0.31 3.10 -0.09 9.38 0.00 0.92 -0.61 121.76 134.15 2qsh s ALA 365 Ca 0.04 -0.84 0.03 0.00 0.00 0.00 0.00 51.96 51.19 2qsh s ALA 365 Cb -0.13 -1.68 -0.01 0.00 0.00 0.00 0.00 23.12 21.31 2qsh s ALA 365 CO 0.03 0.14 -0.20 0.71 0.00 0.00 0.00 175.76 176.43 2qsh s TYR 366 N 0.48 2.61 0.46 0.00 1.51 0.04 -1.22 117.35 121.24 2qsh s TYR 366 Ca -0.02 -0.76 0.06 0.00 -1.01 0.00 0.00 57.07 55.35 2qsh s TYR 366 Cb -0.14 -1.71 -0.02 0.00 -0.11 0.00 0.00 41.96 39.98 2qsh s TYR 366 CO 0.02 -0.25 0.27 0.16 -1.11 0.00 0.00 175.55 174.64 2qsh s ASP 367 N 0.11 4.57 0.29 2.29 1.47 -1.12 -1.11 116.67 123.17 2qsh s ASP 367 Ca -0.10 -1.12 0.04 0.00 1.18 0.00 0.00 52.55 52.55 2qsh s ASP 367 Cb -0.16 -0.13 0.74 0.00 -0.34 0.00 0.00 42.92 43.03 2qsh s ASP 367 CO 0.06 -0.76 1.68 0.03 0.68 0.00 0.00 175.17 176.85 2qsh h ARG 368 N 1.14 0.31 -0.87 2.11 3.08 -1.93 -2.39 114.38 115.83 2qsh h ARG 368 Ca -0.41 -0.02 -0.27 0.00 0.07 0.00 0.00 59.98 59.35 2qsh h ARG 368 Cb 1.28 -0.07 -0.16 0.00 0.08 0.00 0.00 29.97 31.09 2qsh h ARG 368 CO 0.64 0.21 0.34 1.63 -1.07 0.00 0.00 179.97 181.72 2qsh n LYS 369 N -5.11 2.83 -2.55 0.04 4.76 -1.26 -4.87 118.16 112.00 2qsh n LYS 369 Ca 0.22 -2.51 -0.17 0.00 -2.87 0.00 0.00 58.31 52.98 2qsh n LYS 369 Cb 0.68 -2.03 0.01 0.00 -1.84 0.00 0.00 35.03 31.85 2qsh n LYS 369 CO 0.00 0.00 0.00 0.66 -1.37 0.00 0.00 177.40 176.69 2qsh n TYR 370 N -0.35 -1.13 -1.84 2.13 4.02 -0.90 -4.44 117.16 114.66 2qsh n TYR 370 Ca 0.39 0.18 -0.31 0.00 -0.01 0.00 0.00 57.90 58.15 2qsh n TYR 370 Cb 1.31 -3.57 0.02 0.00 -0.02 0.00 0.00 39.34 37.07 2qsh n TYR 370 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 176.86 176.05 2qsh s GLY 371 N -2.46 1.67 -0.15 2.72 0.00 -1.26 -0.89 107.32 106.95 2qsh s GLY 371 Ca 0.10 -0.06 -0.04 0.00 0.00 0.00 0.00 44.72 44.72 2qsh s GLY 371 CO 0.13 0.22 0.19 0.00 0.00 0.00 0.00 173.10 173.63 2qsh s ARG 373 N 2.31 1.10 -0.36 0.00 0.52 -0.35 -4.74 118.95 117.42 2qsh s ARG 373 Ca 0.04 -0.44 -0.29 0.00 -0.52 0.00 0.00 55.73 54.52 2qsh s ARG 373 Cb -0.14 -1.04 0.02 0.00 0.52 0.00 0.00 34.95 34.31 2qsh s ARG 373 CO -0.09 0.24 1.08 0.34 0.02 0.00 0.00 175.30 176.89 2qsh s ASP 374 N -0.17 6.85 -0.03 0.23 3.68 -1.26 -0.05 116.67 125.92 2qsh s ASP 374 Ca 0.02 0.89 0.05 0.00 2.13 0.00 0.00 52.55 55.65 2qsh s ASP 374 Cb -0.06 -2.54 0.12 0.00 -1.45 0.00 0.00 42.92 38.99 2qsh s ASP 374 CO -0.00 -0.97 1.09 0.55 0.13 0.00 0.00 175.17 175.97 2qsh n VAL 375 N 6.10 1.18 -0.32 1.11 3.14 0.15 -4.71 118.33 124.98 2qsh n VAL 375 Ca 0.12 -1.22 0.14 0.00 -2.96 0.00 0.00 64.34 60.42 2qsh n VAL 375 Cb 0.48 0.36 0.33 0.00 -1.06 0.00 0.00 33.84 33.94 2qsh n VAL 375 CO 0.00 0.00 0.00 0.74 -6.46 0.00 0.00 176.83 171.11 2qsh h THR 376 N 0.45 0.50 -1.22 1.55 2.02 -1.83 -2.24 112.91 112.15 2qsh h THR 376 Ca 0.00 -0.16 0.36 0.00 0.77 0.00 0.00 66.41 67.38 2qsh h THR 376 Cb 0.65 0.00 -0.10 0.00 -1.74 0.00 0.00 68.15 66.96 2qsh h THR 376 CO 0.01 0.08 0.80 -0.09 0.37 0.00 0.00 175.52 176.69 2qsh h ARG 377 N 0.46 0.19 -0.36 6.66 1.12 -1.89 0.27 114.38 120.83 2qsh h ARG 377 Ca 0.58 -0.01 -0.12 0.00 -1.11 0.00 0.00 59.98 59.32 2qsh h ARG 377 Cb 1.09 -0.04 -0.01 0.00 -0.01 0.00 0.00 29.97 31.00 2qsh h ARG 377 CO -0.51 0.13 -0.27 -0.09 -3.11 0.00 0.00 179.97 176.12 2qsh h ARG 378 N 0.20 0.74 0.00 0.20 2.43 -1.80 -3.34 114.38 112.81 2qsh h ARG 378 Ca 0.70 -0.32 0.00 0.00 -0.81 0.00 0.00 59.98 59.55 2qsh h ARG 378 Cb 2.15 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 31.67 2qsh h ARG 378 CO -0.30 0.93 -1.64 0.66 -1.51 0.00 0.00 179.97 178.11 2qsh n TYR 379 N -4.09 0.00 -3.50 2.20 4.02 0.83 -4.81 117.16 111.81 2qsh n TYR 379 Ca -0.00 0.00 -0.41 0.00 -0.01 0.00 0.00 57.90 57.48 2qsh n TYR 379 Cb 0.46 -0.32 -0.10 0.00 -0.02 0.00 0.00 39.34 39.35 2qsh n TYR 379 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2qsh s ALA 380 N -3.32 3.50 0.23 -0.72 0.00 -0.52 -4.66 121.76 116.27 2qsh s ALA 380 Ca -0.02 -1.45 -0.07 0.00 0.00 0.00 0.00 51.96 50.42 2qsh s ALA 380 Cb 0.15 -2.74 0.20 0.00 0.00 0.00 0.00 23.12 20.72 2qsh s ALA 380 CO 0.88 -1.11 1.81 0.37 0.00 0.00 0.00 175.76 177.72 2qsh h GLN 381 N 8.53 1.20 -1.81 0.00 4.15 -1.87 -3.21 115.11 122.10 2qsh h GLN 381 Ca -0.30 -0.19 -0.65 0.00 0.77 0.00 0.00 58.65 58.28 2qsh h GLN 381 Cb 1.15 -0.21 -0.37 0.00 0.21 0.00 0.00 27.48 28.25 2qsh h GLN 381 CO 0.67 0.94 -0.14 0.91 -1.93 0.00 0.00 178.83 179.27 2qsh n TRP 382 N -4.30 3.36 -0.15 3.99 7.02 -1.26 -4.86 117.44 121.25 2qsh n TRP 382 Ca 0.08 -3.02 -0.04 0.00 -1.02 0.00 0.00 57.50 53.51 2qsh n TRP 382 Cb 0.15 -0.50 0.03 0.00 -2.42 0.00 0.00 31.31 28.57 2qsh n TRP 382 CO 0.00 0.00 0.00 0.52 -2.02 0.00 0.00 177.69 176.19 2qsh h MET 383 N 2.86 -0.02 0.00 -0.99 2.86 -1.93 -1.08 114.93 116.64 2qsh h MET 383 Ca 0.36 0.00 -0.08 0.00 -2.06 0.00 0.00 59.70 57.91 2qsh h MET 383 Cb 0.59 0.01 -0.01 0.00 0.06 0.00 0.00 31.60 32.24 2qsh h MET 383 CO 1.02 -0.02 -0.40 -0.91 1.06 0.00 0.00 176.91 177.66 2qsh h ASN 384 N -0.02 0.00 0.00 1.22 2.35 -1.91 -0.23 115.58 116.98 2qsh h ASN 384 Ca 0.23 0.00 -0.24 0.00 -0.55 0.00 0.00 56.30 55.73 2qsh h ASN 384 Cb 0.37 0.00 -0.04 0.00 0.05 0.00 0.00 38.32 38.70 2qsh h ASN 384 CO -0.50 0.40 -1.73 -1.54 -1.65 0.00 0.00 177.43 172.42 2qsh n SER 385 N -3.31 1.63 -0.00 5.81 3.41 -1.11 -4.49 113.62 115.56 2qsh n SER 385 Ca 0.01 0.28 -0.00 0.00 -0.26 0.00 0.00 58.87 58.90 2qsh n SER 385 Cb 0.63 -0.65 -0.00 0.00 -0.26 0.00 0.00 64.21 63.92 2qsh n SER 385 CO 0.00 0.00 0.00 0.11 -0.16 0.00 0.00 175.04 174.99 2qsh h LYS 386 N -0.79 0.00 -0.59 4.33 1.57 -1.40 -3.39 116.57 116.29 2qsh h LYS 386 Ca -0.36 0.00 0.12 0.00 -1.87 0.00 0.00 60.65 58.53 2qsh h LYS 386 Cb 1.24 0.00 -0.09 0.00 0.08 0.00 0.00 32.23 33.46 2qsh h LYS 386 CO -0.22 0.00 0.08 0.28 -0.57 0.00 0.00 179.45 179.02 2qsh h VAL 387 N -0.06 0.59 -0.82 0.50 2.07 -1.54 -2.23 116.25 114.76 2qsh h VAL 387 Ca 0.00 -0.07 0.20 0.00 0.82 0.00 0.00 66.70 67.65 2qsh h VAL 387 Cb 0.01 0.38 -0.13 0.00 -1.52 0.00 0.00 31.29 30.03 2qsh h VAL 387 CO 0.00 0.04 0.23 -0.09 0.02 0.00 0.00 177.57 177.76 2qsh h ARG 388 N 0.20 0.26 -0.70 1.57 9.65 -1.28 0.19 114.38 124.28 2qsh h ARG 388 Ca 0.31 -0.02 0.13 0.00 -1.10 0.00 0.00 59.98 59.31 2qsh h ARG 388 Cb 0.48 -0.06 -0.04 0.00 -1.39 0.00 0.00 29.97 28.96 2qsh h ARG 388 CO -0.44 0.17 0.47 0.87 2.80 0.00 0.00 179.97 183.84 2qsh h LYS 389 N 0.26 0.39 -0.53 0.20 1.57 -1.60 -2.29 116.57 114.58 2qsh h LYS 389 Ca 0.49 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 59.25 2qsh h LYS 389 Cb 0.92 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 33.14 2qsh h LYS 389 CO -0.58 0.26 0.00 0.54 -0.57 0.00 0.00 179.45 179.10 2qsh n ARG 390 N -4.47 2.27 -4.15 3.15 5.12 0.67 -4.91 116.66 114.34 2qsh n ARG 390 Ca 0.13 -1.97 -0.29 0.00 -1.93 0.00 0.00 57.85 53.78 2qsh n ARG 390 Cb 0.48 -1.44 -0.08 0.00 -1.16 0.00 0.00 32.46 30.26 2qsh n ARG 390 CO 0.00 0.00 0.00 1.03 -1.93 0.00 0.00 177.63 176.73 2qsh s ARG 391 N -1.30 2.47 0.24 5.56 0.52 -0.86 -4.92 118.95 120.66 2qsh s ARG 391 Ca 0.37 -0.93 0.18 0.00 -0.52 0.00 0.00 55.73 54.84 2qsh s ARG 391 Cb 0.19 -2.47 0.91 0.00 0.52 0.00 0.00 34.95 34.10 2qsh s ARG 391 CO 0.26 0.51 1.55 1.51 0.02 0.00 0.00 175.30 179.15 2qsh n ILE 392 N 0.38 1.15 1.41 1.52 0.13 -1.26 -2.00 119.36 120.68 2qsh n ILE 392 Ca -0.11 0.56 0.15 0.00 -1.10 0.00 0.00 62.75 62.25 2qsh n ILE 392 Cb 0.53 -1.53 0.70 0.00 -0.84 0.00 0.00 39.64 38.50 2qsh n ILE 392 CO 0.00 0.00 0.00 0.41 2.80 0.00 0.00 176.55 179.76 2qsh n THR 393 N -2.09 0.00 0.15 9.51 -1.04 -1.26 -4.09 114.28 115.46 2qsh n THR 393 Ca -0.00 -0.02 0.10 0.00 -2.04 0.00 0.00 64.05 62.09 2qsh n THR 393 Cb 0.08 -0.35 0.54 0.00 -1.82 0.00 0.00 70.33 68.77 2qsh n THR 393 CO 0.00 0.00 0.00 2.29 -0.64 0.00 0.00 175.07 176.72 2qsh n LYS 394 N -1.19 0.13 -4.26 -2.82 2.85 -0.85 -4.19 118.16 107.82 2qsh n LYS 394 Ca 0.14 0.62 -0.14 0.00 -1.05 0.00 0.00 58.31 57.88 2qsh n LYS 394 Cb 0.26 -1.94 -0.10 0.00 -0.65 0.00 0.00 35.03 32.60 2qsh n LYS 394 CO 0.00 0.00 0.00 0.16 -0.05 0.00 0.00 177.40 177.51 2qsh s ASP 395 N -3.92 1.41 0.23 -5.58 -4.77 -1.26 -5.05 116.67 97.72 2qsh s ASP 395 Ca -0.02 -1.17 -0.06 0.00 -3.30 0.00 0.00 52.55 47.99 2qsh s ASP 395 Cb 0.06 0.08 0.35 0.00 -1.09 0.00 0.00 42.92 42.32 2qsh s ASP 395 CO 0.18 -0.54 1.79 -0.78 0.70 0.00 0.00 175.17 176.52 2qsh h ASP 396 N 2.64 0.54 0.16 2.11 -0.00 -1.93 -1.23 116.42 118.70 2qsh h ASP 396 Ca -0.37 0.06 -0.01 0.00 -0.00 0.00 0.00 57.03 56.71 2qsh h ASP 396 Cb 1.21 -0.04 0.00 0.00 -0.00 0.00 0.00 39.33 40.50 2qsh h ASP 396 CO 0.63 0.31 -0.08 0.15 -0.00 0.00 0.00 179.24 180.25 2qsh h PHE 397 N 0.67 -0.20 -0.25 0.28 3.57 -1.94 -2.70 116.94 116.37 2qsh h PHE 397 Ca 0.36 -0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.84 2qsh h PHE 397 Cb 0.36 0.07 -0.01 0.00 2.79 0.00 0.00 35.95 39.15 2qsh h PHE 397 CO -0.09 -0.10 0.07 0.78 -2.23 0.00 0.00 178.31 176.73 2qsh h GLY 398 N -0.24 0.38 0.69 2.40 0.00 -1.57 0.08 103.07 104.81 2qsh h GLY 398 Ca -0.02 -0.18 -0.00 0.00 0.00 0.00 0.00 47.33 47.13 2qsh h GLY 398 CO 0.04 0.17 -0.30 -2.09 0.00 0.00 0.00 176.54 174.36 2qsh h GLU 399 N 0.35 -0.61 -0.75 4.80 4.57 -1.06 0.22 114.58 122.10 2qsh h GLU 399 Ca 0.09 0.04 -0.03 0.00 -1.18 0.00 0.00 59.36 58.28 2qsh h GLU 399 Cb 0.13 0.14 -0.03 0.00 -0.16 0.00 0.00 28.75 28.82 2qsh h GLU 399 CO -0.00 -0.40 0.35 0.87 -1.18 0.00 0.00 179.01 178.64 2qsh h LYS 400 N -0.63 1.09 -0.71 1.92 1.79 -1.14 -2.06 116.57 116.82 2qsh h LYS 400 Ca -0.02 -0.17 0.00 0.00 -2.18 0.00 0.00 60.65 58.29 2qsh h LYS 400 Cb 0.57 -0.19 -0.03 0.00 -1.58 0.00 0.00 32.23 30.99 2qsh h LYS 400 CO -0.05 0.85 0.45 2.35 -1.08 0.00 0.00 179.45 181.97 2qsh h TRP 401 N 1.06 0.90 -0.17 -1.35 7.01 -0.80 -1.92 115.95 120.68 2qsh h TRP 401 Ca 0.26 0.01 -0.16 0.00 2.11 0.00 0.00 58.89 61.11 2qsh h TRP 401 Cb 0.13 -0.30 -0.01 0.00 -2.10 0.00 0.00 29.16 26.88 2qsh h TRP 401 CO 0.01 0.58 -0.56 0.35 -2.79 0.00 0.00 178.44 176.03 2qsh h PHE 402 N 0.96 0.66 -0.34 2.65 3.57 -0.71 -2.70 116.94 121.04 2qsh h PHE 402 Ca 0.26 -0.24 -0.03 0.00 3.53 0.00 0.00 57.97 61.49 2qsh h PHE 402 Cb -0.08 -0.12 -0.02 0.00 2.79 0.00 0.00 35.95 38.51 2qsh h PHE 402 CO -0.02 0.96 0.08 -0.09 -2.23 0.00 0.00 178.31 177.01 2qsh h ARG 403 N 0.40 0.49 -0.59 1.11 9.65 -1.05 -1.79 114.38 122.61 2qsh h ARG 403 Ca 0.01 -0.08 -0.10 0.00 -1.10 0.00 0.00 59.98 58.71 2qsh h ARG 403 Cb 1.10 -0.09 -0.02 0.00 -1.39 0.00 0.00 29.97 29.57 2qsh h ARG 403 CO 0.10 0.46 -0.02 0.87 2.80 0.00 0.00 179.97 184.18 2qsh h LYS 404 N 0.49 1.06 0.16 0.20 1.57 -1.04 -1.36 116.57 117.64 2qsh h LYS 404 Ca 0.11 -0.35 -0.01 0.00 -1.87 0.00 0.00 60.65 58.54 2qsh h LYS 404 Cb 0.20 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 32.42 2qsh h LYS 404 CO -0.00 1.05 -0.08 0.28 -0.57 0.00 0.00 179.45 180.13 2qsh h VAL 405 N 0.95 0.97 -0.22 0.50 2.07 -1.19 -2.56 116.25 116.76 2qsh h VAL 405 Ca 0.16 -0.63 0.06 0.00 0.82 0.00 0.00 66.70 67.11 2qsh h VAL 405 Cb 0.59 1.35 -0.07 0.00 -1.52 0.00 0.00 31.29 31.63 2qsh h VAL 405 CO 0.03 0.15 -0.37 0.40 0.02 0.00 0.00 177.57 177.80 2qsh h ILE 406 N -0.52 0.21 -1.00 4.57 1.08 -1.33 -1.55 117.51 118.97 2qsh h ILE 406 Ca -0.02 0.00 0.15 0.00 -0.39 0.00 0.00 64.86 64.60 2qsh h ILE 406 Cb 0.40 0.21 -0.10 0.00 -3.07 0.00 0.00 36.82 34.26 2qsh h ILE 406 CO 0.04 0.00 0.61 0.74 -0.69 0.00 0.00 178.15 178.85 2qsh h THR 407 N -0.39 0.81 0.00 -0.27 2.02 -1.25 0.95 112.91 114.78 2qsh h THR 407 Ca 0.11 -0.30 -0.03 0.00 0.77 0.00 0.00 66.41 66.96 2qsh h THR 407 Cb 0.58 -0.14 -0.00 0.00 -1.74 0.00 0.00 68.15 66.84 2qsh h THR 407 CO -0.43 0.16 -0.14 0.00 0.37 0.00 0.00 175.52 175.48 2qsh h ALA 408 N 1.59 1.35 -0.02 6.16 0.00 -0.86 -2.49 119.26 124.99 2qsh h ALA 408 Ca 0.53 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 55.32 2qsh h ALA 408 Cb 0.69 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.45 2qsh h ALA 408 CO -0.32 0.17 -0.22 1.28 0.00 0.00 0.00 179.25 180.16 2qsh n LEU 409 N -3.76 2.44 -4.28 0.00 7.99 0.22 -4.85 117.00 114.77 2qsh n LEU 409 Ca -0.02 -0.88 -0.45 0.00 -0.01 0.00 0.00 56.01 54.65 2qsh n LEU 409 Cb 0.25 0.00 -0.04 0.00 -0.11 0.00 0.00 43.42 43.52 2qsh n LEU 409 CO 0.31 0.43 0.32 -2.28 -1.51 0.00 0.00 177.39 174.66 2qsh s HIS 410 N -2.12 3.66 -0.61 -1.77 2.46 -0.58 -4.23 115.29 112.10 2qsh s HIS 410 Ca 0.22 -2.12 -0.02 0.00 0.47 0.00 0.00 55.06 53.61 2qsh s HIS 410 Cb 0.18 -3.68 0.39 0.00 -0.13 0.00 0.00 32.58 29.35 2qsh s HIS 410 CO 0.41 -0.96 2.05 0.72 -2.47 0.00 0.00 174.74 174.49 2qsh n HIS 411 N 3.93 2.87 -3.82 3.88 8.25 -0.07 -4.90 115.22 125.36 2qsh n HIS 411 Ca 0.11 -2.78 -0.10 0.00 -0.26 0.00 0.00 57.72 54.70 2qsh n HIS 411 Cb 0.45 -1.35 -0.05 0.00 1.12 0.00 0.00 29.99 30.16 2qsh n HIS 411 CO 0.00 0.00 0.00 -0.98 0.64 0.00 0.00 176.34 176.00 2qsh s ARG 412 N -3.43 1.24 0.62 -0.41 1.70 -1.26 -4.80 118.95 112.61 2qsh s ARG 412 Ca 0.58 -0.98 -0.13 0.00 -0.47 0.00 0.00 55.73 54.73 2qsh s ARG 412 Cb 0.45 0.45 -0.03 0.00 -0.57 0.00 0.00 34.95 35.25 2qsh s ARG 412 CO -0.04 -0.49 1.04 0.15 -1.08 0.00 0.00 175.30 174.88 2qsh s LYS 413 N -3.90 3.38 0.40 3.89 3.01 -1.26 -5.02 119.74 120.23 2qsh s LYS 413 Ca 0.11 0.96 -0.26 0.00 -1.01 0.00 0.00 55.97 55.78 2qsh s LYS 413 Cb 0.01 -2.05 -0.09 0.00 -1.01 0.00 0.00 37.83 34.69 2qsh s LYS 413 CO -0.03 -0.74 1.30 0.50 0.51 0.00 0.00 175.35 176.89 2qsh s ARG 414 N -4.66 4.02 0.44 1.68 3.52 -1.26 -5.06 118.95 117.63 2qsh s ARG 414 Ca 0.59 2.16 0.06 0.00 -0.13 0.00 0.00 55.73 58.40 2qsh s ARG 414 Cb -0.13 -2.79 -0.05 0.00 -1.56 0.00 0.00 34.95 30.42 2qsh s ARG 414 CO 0.46 -0.45 0.10 0.95 -0.81 0.00 0.00 175.30 175.55 2qsh s THR 415 N -1.25 1.92 0.40 4.11 -4.23 -1.26 -5.02 115.64 110.30 2qsh s THR 415 Ca 0.56 -1.85 0.11 0.00 -1.18 0.00 0.00 61.69 59.32 2qsh s THR 415 Cb -0.38 -2.77 0.16 0.00 1.34 0.00 0.00 72.50 70.84 2qsh s THR 415 CO 0.49 0.00 1.92 0.50 -0.54 0.00 0.00 174.62 177.00 2qsh h LYS 416 N 1.49 0.18 -0.19 3.99 3.11 -2.00 -2.68 116.57 120.46 2qsh h LYS 416 Ca -0.43 -0.04 0.02 0.00 -2.81 0.00 0.00 60.65 57.39 2qsh h LYS 416 Cb 1.26 -0.02 -0.02 0.00 -1.00 0.00 0.00 32.23 32.45 2qsh h LYS 416 CO 0.74 0.34 0.06 0.82 -2.81 0.00 0.00 179.45 178.60 2qsh h ILE 417 N 0.17 0.95 -0.82 2.00 2.04 -2.00 -1.73 117.51 118.13 2qsh h ILE 417 Ca 0.03 -0.05 0.20 0.00 1.00 0.00 0.00 64.86 66.04 2qsh h ILE 417 Cb 0.38 0.78 -0.12 0.00 -0.74 0.00 0.00 36.82 37.12 2qsh h ILE 417 CO 0.02 0.03 0.24 0.44 0.00 0.00 0.00 178.15 178.88 2qsh h ASP 418 N 0.16 0.07 -0.63 1.72 3.32 -1.88 -0.19 116.42 118.99 2qsh h ASP 418 Ca 0.08 0.17 0.06 0.00 0.02 0.00 0.00 57.03 57.36 2qsh h ASP 418 Cb 0.05 0.21 -0.05 0.00 0.22 0.00 0.00 39.33 39.76 2qsh h ASP 418 CO -0.09 -0.07 0.34 0.44 -1.72 0.00 0.00 179.24 178.14 2qsh h ASP 419 N 0.28 0.49 -0.20 6.45 3.32 -1.29 0.10 116.42 125.57 2qsh h ASP 419 Ca 0.49 0.03 -0.01 0.00 0.02 0.00 0.00 57.03 57.56 2qsh h ASP 419 Cb 0.91 -0.06 -0.01 0.00 0.22 0.00 0.00 39.33 40.39 2qsh h ASP 419 CO -0.57 0.32 0.07 1.88 -1.72 0.00 0.00 179.24 179.22 2qsh h TYR 420 N 0.63 0.31 -0.36 4.55 0.99 -0.44 -1.46 116.97 121.19 2qsh h TYR 420 Ca 0.28 -0.03 -0.07 0.00 2.00 0.00 0.00 58.73 60.91 2qsh h TYR 420 Cb 0.18 -0.09 -0.02 0.00 1.00 0.00 0.00 36.73 37.81 2qsh h TYR 420 CO -0.09 0.39 -0.07 1.49 -0.00 0.00 0.00 178.16 179.88 2qsh h GLU 421 N 0.15 0.59 -0.55 4.88 4.81 -0.94 -0.85 114.58 122.68 2qsh h GLU 421 Ca 0.06 -0.16 -0.11 0.00 -0.13 0.00 0.00 59.36 59.02 2qsh h GLU 421 Cb 0.22 -0.07 -0.02 0.00 0.63 0.00 0.00 28.75 29.51 2qsh h GLU 421 CO -0.00 0.67 -0.09 -0.44 -0.73 0.00 0.00 179.01 178.41 2qsh h ASP 422 N 0.55 1.03 -0.67 1.04 3.45 -0.85 0.36 116.42 121.33 2qsh h ASP 422 Ca 0.11 -0.33 -0.00 0.00 0.43 0.00 0.00 57.03 57.23 2qsh h ASP 422 Cb 0.46 -0.28 -0.03 0.00 -0.56 0.00 0.00 39.33 38.92 2qsh h ASP 422 CO 0.02 1.13 0.42 1.56 -1.57 0.00 0.00 179.24 180.79 2qsh h GLN 423 N 0.92 0.90 -0.24 3.56 4.20 -0.80 0.34 115.11 123.99 2qsh h GLN 423 Ca 0.15 -0.07 0.03 0.00 0.06 0.00 0.00 58.65 58.81 2qsh h GLN 423 Cb 0.66 -0.19 -0.03 0.00 0.30 0.00 0.00 27.48 28.22 2qsh h GLN 423 CO 0.05 0.63 0.07 -0.92 -0.67 0.00 0.00 178.83 177.99 2qsh h TYR 424 N 0.91 0.13 -0.73 2.96 5.03 -0.84 -1.68 116.97 122.75 2qsh h TYR 424 Ca 0.24 0.01 -0.03 0.00 2.58 0.00 0.00 58.73 61.54 2qsh h TYR 424 Cb -0.05 -0.02 -0.03 0.00 1.55 0.00 0.00 36.73 38.17 2qsh h TYR 424 CO -0.02 0.06 0.35 0.74 -1.32 0.00 0.00 178.16 177.97 2qsh h PHE 425 N 0.18 1.04 -0.64 -3.82 0.05 -0.46 -0.87 116.94 112.42 2qsh h PHE 425 Ca 0.11 -0.04 -0.06 0.00 3.82 0.00 0.00 57.97 61.79 2qsh h PHE 425 Cb 0.08 -0.33 -0.03 0.00 2.00 0.00 0.00 35.95 37.68 2qsh h PHE 425 CO -0.13 0.76 0.15 0.35 -0.18 0.00 0.00 178.31 179.26 2qsh h PHE 426 N 1.04 1.05 -0.17 -0.55 3.57 0.00 -1.44 116.94 120.43 2qsh h PHE 426 Ca 0.25 -0.11 -0.13 0.00 3.53 0.00 0.00 57.97 61.51 2qsh h PHE 426 Cb 0.11 -0.30 0.00 0.00 2.79 0.00 0.00 35.95 38.55 2qsh h PHE 426 CO 0.01 0.86 -0.40 1.96 -2.23 0.00 0.00 178.31 178.51 2qsh h GLN 427 N 0.96 0.58 -0.86 1.11 4.20 -0.96 -1.95 115.11 118.19 2qsh h GLN 427 Ca 0.20 -0.39 0.10 0.00 0.06 0.00 0.00 58.65 58.63 2qsh h GLN 427 Cb 0.34 0.06 -0.06 0.00 0.30 0.00 0.00 27.48 28.12 2qsh h GLN 427 CO 0.00 1.01 0.56 0.00 -0.67 0.00 0.00 178.83 179.72 2qsh h ARG 428 N 0.23 0.79 -0.56 1.46 2.47 -1.00 -0.85 114.38 116.93 2qsh h ARG 428 Ca -0.00 -0.05 -0.07 0.00 -1.26 0.00 0.00 59.98 58.60 2qsh h ARG 428 Cb 1.01 -0.18 -0.02 0.00 -1.65 0.00 0.00 29.97 29.13 2qsh h ARG 428 CO 0.09 0.52 0.08 -0.44 0.56 0.00 0.00 179.97 180.78 2qsh h ASP 429 N 0.81 0.89 0.18 7.04 5.19 -1.17 -2.33 116.42 127.03 2qsh h ASP 429 Ca 0.40 -0.26 -0.05 0.00 -0.62 0.00 0.00 57.03 56.50 2qsh h ASP 429 Cb 0.46 -0.24 -0.01 0.00 0.18 0.00 0.00 39.33 39.72 2qsh h ASP 429 CO -0.17 0.93 -0.20 -0.33 -3.12 0.00 0.00 179.24 176.35 2qsh h GLU 430 N 0.81 0.04 -0.01 3.56 5.08 -0.38 -3.28 114.58 120.40 2qsh h GLU 430 Ca 0.17 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.52 2qsh h GLU 430 Cb 0.42 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.67 2qsh h GLU 430 CO 0.01 0.24 -0.29 -1.13 -1.00 0.00 0.00 179.01 176.84 2qsh n SER 431 N -4.28 1.41 -0.26 1.42 3.41 -0.65 -4.25 113.62 110.40 2qsh n SER 431 Ca -0.02 -1.20 -0.01 0.00 -0.26 0.00 0.00 58.87 57.38 2qsh n SER 431 Cb 0.27 0.49 0.11 0.00 -0.26 0.00 0.00 64.21 64.82 2qsh n SER 431 CO 0.00 0.00 0.00 -0.08 -0.16 0.00 0.00 175.04 174.80 2qsh h GLU 432 N 1.43 0.80 0.00 4.33 4.81 -1.48 -3.48 114.58 120.98 2qsh h GLU 432 Ca 0.00 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.18 2qsh h GLU 432 Cb 0.45 -0.18 0.00 0.00 0.63 0.00 0.00 28.75 29.65 2qsh h GLU 432 CO 0.00 0.53 0.00 0.41 -0.73 0.00 0.00 179.01 179.22 2qsh n GLY 433 N -1.30 -0.91 3.76 1.92 0.00 -1.26 -4.79 105.19 102.60 2qsh n GLY 433 Ca 0.10 -1.06 -0.41 0.00 0.00 0.00 0.00 46.02 44.65 2qsh n GLY 433 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2qsh s ILE 434 N 0.00 2.45 0.60 -0.61 1.09 -1.26 -5.01 121.20 118.47 2qsh s ILE 434 Ca 0.00 0.41 -0.14 0.00 -1.10 0.00 0.00 60.65 59.82 2qsh s ILE 434 Cb 0.00 -3.26 -0.04 0.00 -1.06 0.00 0.00 42.46 38.10 2qsh s ILE 434 CO 0.00 0.08 1.04 -2.84 -0.10 0.00 0.00 174.94 173.12 2qsh s PRO 435 N -1.03 3.41 0.02 2.79 0.02 -1.26 -4.97 135.00 133.97 2qsh s PRO 435 Ca 0.56 1.05 0.23 0.00 0.02 0.00 0.00 61.00 62.87 2qsh s PRO 435 Cb -0.43 -2.05 0.97 0.00 0.02 0.00 0.00 34.50 33.01 2qsh s PRO 435 CO 0.50 -0.73 1.73 -0.25 -0.33 0.00 0.00 177.00 177.93 2qsh n ASP 436 N -2.22 0.05 -4.02 2.53 8.00 -1.26 -4.89 116.55 114.74 2qsh n ASP 436 Ca 0.08 0.51 -0.11 0.00 0.71 0.00 0.00 54.79 55.97 2qsh n ASP 436 Cb 0.53 -0.52 -0.11 0.00 -0.02 0.00 0.00 41.12 41.00 2qsh n ASP 436 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 2qsh s SER 437 N -3.09 0.58 0.17 -2.24 1.04 -1.26 -4.74 113.70 104.16 2qsh s SER 437 Ca 0.11 -0.52 -0.15 0.00 0.48 0.00 0.00 55.95 55.87 2qsh s SER 437 Cb 0.15 0.06 0.09 0.00 0.10 0.00 0.00 66.02 66.41 2qsh s SER 437 CO 0.42 -0.24 1.78 0.58 0.98 0.00 0.00 173.24 176.76 2qsh h VAL 438 N 4.58 0.95 -0.69 5.02 2.07 -1.92 -2.66 116.25 123.60 2qsh h VAL 438 Ca -0.34 -0.14 0.06 0.00 0.82 0.00 0.00 66.70 67.10 2qsh h VAL 438 Cb 1.21 0.51 -0.05 0.00 -1.52 0.00 0.00 31.29 31.43 2qsh h VAL 438 CO 0.41 0.08 0.39 0.06 0.02 0.00 0.00 177.57 178.52 2qsh h GLN 439 N 0.41 0.70 0.00 1.57 3.07 -1.98 -1.39 115.11 117.49 2qsh h GLN 439 Ca 0.19 -0.04 0.00 0.00 0.09 0.00 0.00 58.65 58.88 2qsh h GLN 439 Cb 0.11 -0.16 0.00 0.00 0.08 0.00 0.00 27.48 27.51 2qsh h GLN 439 CO -0.14 0.46 0.00 -0.25 0.09 0.00 0.00 178.83 178.99 2qsh n ASP 440 N -4.77 0.09 -1.00 0.06 8.00 -1.01 -1.39 116.55 116.52 2qsh n ASP 440 Ca 0.09 0.52 0.12 0.00 0.71 0.00 0.00 54.79 56.23 2qsh n ASP 440 Cb 0.17 -0.54 0.13 0.00 -0.02 0.00 0.00 41.12 40.86 2qsh n ASP 440 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 2qsh n LEU 441 N -1.60 3.11 -4.65 0.64 4.77 -0.53 -4.65 117.00 114.09 2qsh n LEU 441 Ca 0.03 -1.13 -0.43 0.00 -0.03 0.00 0.00 56.01 54.45 2qsh n LEU 441 Cb 0.15 -0.06 -0.02 0.00 -2.33 0.00 0.00 43.42 41.15 2qsh n LEU 441 CO 0.12 0.56 1.14 -0.75 -1.33 0.00 0.00 177.39 177.13 2qsh s LYS 442 N -1.85 4.12 -1.35 3.23 2.47 -0.49 -3.66 119.74 122.21 2qsh s LYS 442 Ca 0.30 1.60 0.00 0.00 -1.56 0.00 0.00 55.97 56.31 2qsh s LYS 442 Cb 0.21 -3.83 0.00 0.00 -1.46 0.00 0.00 37.83 32.75 2qsh s LYS 442 CO 0.30 -0.86 0.00 0.09 0.16 0.00 0.00 175.35 175.04 2qsh n ASN 443 N 7.03 -4.50 -4.76 1.43 3.02 -1.26 -4.99 115.26 111.22 2qsh n ASN 443 Ca 0.15 0.18 -0.39 0.00 -0.03 0.00 0.00 54.58 54.48 2qsh n ASN 443 Cb 0.45 -3.42 0.01 0.00 -0.61 0.00 0.00 39.78 36.21 2qsh n ASN 443 CO 0.00 0.00 0.00 -2.28 -2.62 0.00 0.00 177.26 172.36 2qsh s HIS 444 N -2.60 2.55 -0.21 3.10 2.46 -1.24 -4.93 115.29 114.42 2qsh s HIS 444 Ca 0.00 1.33 0.29 0.00 0.47 0.00 0.00 55.06 57.14 2qsh s HIS 444 Cb 0.00 -3.82 1.06 0.00 -0.13 0.00 0.00 32.58 29.69 2qsh s HIS 444 CO 0.00 -2.65 1.84 -1.00 -2.47 0.00 0.00 174.74 170.45 2qsh h PRO 445 N 2.31 0.00 0.00 2.88 0.13 -1.95 -3.36 132.00 132.01 2qsh h PRO 445 Ca -0.50 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 64.59 2qsh h PRO 445 Cb 1.26 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.39 2qsh h PRO 445 CO 0.61 0.00 -1.14 0.66 -0.23 0.00 0.00 178.00 177.90 2qsh n TYR 446 N -2.78 0.00 -4.39 1.56 0.53 -1.26 -4.89 117.16 105.92 2qsh n TYR 446 Ca 0.02 0.00 -0.23 0.00 -1.02 0.00 0.00 57.90 56.67 2qsh n TYR 446 Cb 0.33 -0.10 -0.11 0.00 -1.03 0.00 0.00 39.34 38.44 2qsh n TYR 446 CO 0.00 0.00 0.00 0.71 -1.02 0.00 0.00 176.86 176.55 2qsh s TYR 447 N -2.07 2.02 -0.00 -0.72 1.51 -1.26 -0.13 117.35 116.69 2qsh s TYR 447 Ca -0.01 -0.43 0.00 0.00 -1.01 0.00 0.00 57.07 55.62 2qsh s TYR 447 Cb 0.01 -0.95 0.00 0.00 -0.11 0.00 0.00 41.96 40.91 2qsh s TYR 447 CO 0.09 0.47 -0.01 0.08 -1.11 0.00 0.00 175.55 175.07 2qsh s VAL 448 N -2.29 0.10 0.36 0.71 1.01 0.10 -4.34 120.40 116.05 2qsh s VAL 448 Ca 0.22 -0.03 -0.27 0.00 0.00 0.00 0.00 61.98 61.90 2qsh s VAL 448 Cb -0.05 -0.11 -0.09 0.00 0.00 0.00 0.00 36.38 36.13 2qsh s VAL 448 CO 0.10 0.04 1.21 -0.76 0.00 0.00 0.00 175.10 175.69 2qsh s LEU 449 N 0.11 4.31 0.27 3.92 1.43 -1.26 0.04 118.68 127.50 2qsh s LEU 449 Ca -0.01 2.46 -0.05 0.00 -1.03 0.00 0.00 54.13 55.51 2qsh s LEU 449 Cb -0.02 -3.85 0.53 0.00 0.03 0.00 0.00 46.19 42.88 2qsh s LEU 449 CO -0.00 -0.58 1.60 -0.08 0.23 0.00 0.00 176.35 177.51 2qsh h GLU 450 N 3.01 0.04 0.00 1.70 4.81 -1.53 0.20 114.58 122.81 2qsh h GLU 450 Ca -0.49 -0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.74 2qsh h GLU 450 Cb 1.23 -0.01 0.00 0.00 0.63 0.00 0.00 28.75 30.60 2qsh h GLU 450 CO 0.64 0.03 0.00 0.00 -0.73 0.00 0.00 179.01 178.95 2qsh n GLN 451 N -5.46 0.19 0.00 1.92 10.64 -1.26 -2.52 117.38 120.88 2qsh n GLN 451 Ca 0.17 0.13 0.09 0.00 -1.83 0.00 0.00 57.00 55.56 2qsh n GLN 451 Cb 0.56 -1.50 0.02 0.00 -0.86 0.00 0.00 30.24 28.46 2qsh n GLN 451 CO 0.00 0.00 0.00 -0.25 -1.83 0.00 0.00 177.06 174.98 2qsh n ASP 452 N -1.35 1.95 -4.68 2.61 8.00 0.68 -4.92 116.55 118.83 2qsh n ASP 452 Ca 0.08 -1.47 -0.42 0.00 0.71 0.00 0.00 54.79 53.68 2qsh n ASP 452 Cb 0.17 0.35 -0.03 0.00 -0.02 0.00 0.00 41.12 41.58 2qsh n ASP 452 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 2qsh s ILE 453 N -1.92 2.90 0.63 0.53 1.01 -1.05 -4.95 121.20 118.35 2qsh s ILE 453 Ca 0.16 0.24 -0.17 0.00 0.00 0.00 0.00 60.65 60.88 2qsh s ILE 453 Cb 0.15 -3.15 -0.02 0.00 0.01 0.00 0.00 42.46 39.45 2qsh s ILE 453 CO 0.39 -0.01 1.19 -0.54 0.00 0.00 0.00 174.94 175.97 2qsh s LYS 454 N 3.24 2.81 0.66 2.79 -0.14 -1.26 -4.88 119.74 122.96 2qsh s LYS 454 Ca 0.80 1.73 0.33 0.00 -1.36 0.00 0.00 55.97 57.47 2qsh s LYS 454 Cb -0.42 -1.92 1.80 0.00 -1.68 0.00 0.00 37.83 35.61 2qsh s LYS 454 CO 0.36 -1.31 2.03 0.37 -0.76 0.00 0.00 175.35 176.04 2qsh h GLN 455 N 0.55 0.00 -0.67 1.68 4.15 -1.99 -1.25 115.11 117.59 2qsh h GLN 455 Ca -0.49 0.00 -0.22 0.00 0.77 0.00 0.00 58.65 58.70 2qsh h GLN 455 Cb 1.29 0.00 -0.13 0.00 0.21 0.00 0.00 27.48 28.84 2qsh h GLN 455 CO 0.54 0.00 0.24 0.25 -1.93 0.00 0.00 178.83 177.93 2qsh n THR 456 N -3.03 2.85 -4.17 2.39 -2.24 -1.26 -4.95 114.28 103.87 2qsh n THR 456 Ca -0.01 -1.85 -0.15 0.00 -2.27 0.00 0.00 64.05 59.76 2qsh n THR 456 Cb 0.32 -0.36 -0.11 0.00 -2.10 0.00 0.00 70.33 68.09 2qsh n THR 456 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 2qsh s GLN 457 N -3.05 0.82 0.10 -0.78 -0.21 -0.47 -1.85 119.66 114.21 2qsh s GLN 457 Ca 0.53 -1.07 0.03 0.00 0.02 0.00 0.00 55.36 54.86 2qsh s GLN 457 Cb 0.43 -0.59 -0.04 0.00 1.00 0.00 0.00 33.01 33.81 2qsh s GLN 457 CO 0.11 0.11 -0.09 0.96 -2.12 0.00 0.00 175.29 174.25 2qsh s ILE 458 N -2.05 0.90 -0.02 1.08 -4.36 -0.78 -4.84 121.20 111.13 2qsh s ILE 458 Ca 0.02 -1.74 -0.30 0.00 -0.26 0.00 0.00 60.65 58.37 2qsh s ILE 458 Cb -0.05 -1.46 -0.04 0.00 1.25 0.00 0.00 42.46 42.15 2qsh s ILE 458 CO 0.01 -0.65 1.18 -0.69 0.24 0.00 0.00 174.94 175.03 2qsh s VAL 459 N -2.78 4.24 0.31 8.37 1.01 -1.26 -0.43 120.40 129.85 2qsh s VAL 459 Ca 0.08 1.59 -0.30 0.00 0.00 0.00 0.00 61.98 63.35 2qsh s VAL 459 Cb -0.01 -4.02 -0.12 0.00 0.00 0.00 0.00 36.38 32.23 2qsh s VAL 459 CO -0.01 0.05 1.49 0.29 0.00 0.00 0.00 175.10 176.91 2qsh n LYS 460 N 4.72 2.46 -1.56 2.72 5.02 0.00 -4.87 118.16 126.66 2qsh n LYS 460 Ca 0.10 0.87 -0.47 0.00 -2.02 0.00 0.00 58.31 56.80 2qsh n LYS 460 Cb 0.47 -2.59 -0.03 0.00 -0.02 0.00 0.00 35.03 32.86 2qsh n LYS 460 CO 0.00 0.00 0.00 -0.35 -0.52 0.00 0.00 177.40 176.53 2qsh n PRO 461 N 1.54 1.10 -0.30 1.97 -0.04 -1.26 -1.63 135.00 136.37 2qsh n PRO 461 Ca 0.07 0.39 0.00 0.00 -0.04 0.00 0.00 63.50 63.92 2qsh n PRO 461 Cb 0.36 -1.75 0.00 0.00 -0.04 0.00 0.00 33.50 32.07 2qsh n PRO 461 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2qsh n GLY 462 N 1.59 1.97 3.92 0.55 0.00 -1.26 -5.02 105.19 106.94 2qsh n GLY 462 Ca 0.13 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.89 2qsh n GLY 462 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qsh n LYS 464 N -1.49 0.13 -0.79 0.00 5.02 -1.26 -4.91 118.16 114.85 2qsh n LYS 464 Ca -0.03 0.00 -0.32 0.00 -2.02 0.00 0.00 58.31 55.94 2qsh n LYS 464 Cb 0.55 0.00 0.14 0.00 -0.02 0.00 0.00 35.03 35.70 2qsh n LYS 464 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 2qsh n GLU 465 N 0.00 -0.29 -0.03 1.97 4.71 -1.26 -4.77 120.64 120.97 2qsh n GLU 465 Ca 0.00 -0.03 0.03 0.00 -0.01 0.00 0.00 57.16 57.16 2qsh n GLU 465 Cb 0.00 -2.15 0.05 0.00 -1.01 0.00 0.00 31.44 28.33 2qsh n GLU 465 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 2qsh n GLY 467 N -0.74 -0.27 3.35 0.00 0.00 -1.13 -5.01 105.19 101.39 2qsh n GLY 467 Ca 0.05 -1.22 -0.18 0.00 0.00 0.00 0.00 46.02 44.68 2qsh n GLY 467 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2qsh s TYR 468 N -2.00 1.64 -0.10 1.61 1.51 -1.26 -0.37 117.35 118.38 2qsh s TYR 468 Ca 0.00 -0.90 0.00 0.00 -1.01 0.00 0.00 57.07 55.16 2qsh s TYR 468 Cb 0.00 -0.96 0.02 0.00 -0.11 0.00 0.00 41.96 40.91 2qsh s TYR 468 CO 0.00 -0.00 -0.08 -1.17 -1.11 0.00 0.00 175.55 173.19 2qsh s LEU 469 N -3.34 1.26 -0.08 -1.29 0.20 -0.21 -4.87 118.68 110.35 2qsh s LEU 469 Ca 0.29 -0.29 -0.30 0.00 0.69 0.00 0.00 54.13 54.53 2qsh s LEU 469 Cb 0.06 -0.81 -0.03 0.00 -0.43 0.00 0.00 46.19 44.98 2qsh s LEU 469 CO 0.10 -0.09 1.23 -0.75 -0.29 0.00 0.00 176.35 176.54 2qsh s LYS 470 N 1.48 4.32 -0.34 1.98 2.20 -1.26 -0.92 119.74 127.20 2qsh s LYS 470 Ca 0.00 1.68 -0.22 0.00 -0.36 0.00 0.00 55.97 57.08 2qsh s LYS 470 Cb -0.13 -3.61 0.00 0.00 -1.51 0.00 0.00 37.83 32.58 2qsh s LYS 470 CO -0.05 -0.52 0.73 0.08 -0.36 0.00 0.00 175.35 175.23 2qsh s VAL 471 N 2.54 4.81 -0.01 4.02 1.01 -0.43 -4.85 120.40 127.49 2qsh s VAL 471 Ca 0.56 0.89 -0.30 0.00 0.00 0.00 0.00 61.98 63.14 2qsh s VAL 471 Cb -0.24 -4.14 -0.07 0.00 0.00 0.00 0.00 36.38 31.93 2qsh s VAL 471 CO 0.20 -0.32 1.85 -2.28 0.00 0.00 0.00 175.10 174.55 2qsh s HIS 472 N 2.91 1.55 0.00 5.22 2.46 -1.26 -2.87 115.29 123.31 2qsh s HIS 472 Ca 0.29 -0.18 0.00 0.00 0.47 0.00 0.00 55.06 55.64 2qsh s HIS 472 Cb -0.14 -4.11 0.00 0.00 -0.13 0.00 0.00 32.58 28.20 2qsh s HIS 472 CO 0.15 -4.86 0.00 0.41 -2.47 0.00 0.00 174.74 167.97 2qsh n GLY 473 N 4.41 2.19 2.85 1.59 0.00 -1.26 -5.07 105.19 109.90 2qsh n GLY 473 Ca 0.19 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.95 2qsh n GLY 473 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qsh s LYS 474 N -0.11 1.18 -0.05 1.61 -0.14 -1.14 -5.10 119.74 115.99 2qsh s LYS 474 Ca 0.00 -0.20 -0.36 0.00 -1.36 0.00 0.00 55.97 54.05 2qsh s LYS 474 Cb 0.00 -1.51 -0.14 0.00 -1.68 0.00 0.00 37.83 34.49 2qsh s LYS 474 CO 0.00 -0.33 1.68 0.28 -0.76 0.00 0.00 175.35 176.21 2qsh n VAL 475 N 5.00 0.27 -0.97 3.17 0.31 -1.26 -1.93 118.33 122.92 2qsh n VAL 475 Ca -0.10 -0.05 0.00 0.00 -0.01 0.00 0.00 64.34 64.18 2qsh n VAL 475 Cb 0.49 -1.44 0.00 0.00 -0.91 0.00 0.00 33.84 31.99 2qsh n VAL 475 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2qsh n GLY 476 N 3.77 0.10 3.72 2.92 0.00 -1.26 -4.95 105.19 109.50 2qsh n GLY 476 Ca 0.21 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.82 2qsh n GLY 476 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2qsh s LYS 477 N -1.59 4.62 -0.04 1.61 2.20 -0.81 -5.01 119.74 120.72 2qsh s LYS 477 Ca 0.00 1.51 -0.04 0.00 -0.36 0.00 0.00 55.97 57.09 2qsh s LYS 477 Cb 0.00 -3.38 0.01 0.00 -1.51 0.00 0.00 37.83 32.95 2qsh s LYS 477 CO 0.00 0.08 0.11 0.08 -0.36 0.00 0.00 175.35 175.26 2qsh s VAL 478 N 0.32 -0.00 0.00 4.02 1.01 -1.26 -1.32 120.40 123.17 2qsh s VAL 478 Ca 0.50 0.01 0.06 0.00 0.00 0.00 0.00 61.98 62.54 2qsh s VAL 478 Cb -0.24 -0.16 -0.03 0.00 0.00 0.00 0.00 36.38 35.95 2qsh s VAL 478 CO 0.30 0.00 -0.17 -0.76 0.00 0.00 0.00 175.10 174.47 2qsh s LEU 479 N 0.10 2.60 -0.03 3.92 1.43 -0.10 -4.93 118.68 121.66 2qsh s LEU 479 Ca -0.00 -0.35 -0.29 0.00 -1.03 0.00 0.00 54.13 52.46 2qsh s LEU 479 Cb -0.01 -1.52 -0.03 0.00 0.03 0.00 0.00 46.19 44.66 2qsh s LEU 479 CO -0.00 0.29 0.93 -0.54 0.23 0.00 0.00 176.35 177.27 2qsh s LYS 480 N -1.10 4.51 -0.13 1.70 1.02 -1.26 -1.04 119.74 123.43 2qsh s LYS 480 Ca 0.13 1.31 -0.02 0.00 0.02 0.00 0.00 55.97 57.42 2qsh s LYS 480 Cb -0.10 -3.47 -0.02 0.00 -0.52 0.00 0.00 37.83 33.71 2qsh s LYS 480 CO 0.03 -0.08 -0.09 0.08 -0.92 0.00 0.00 175.35 174.37 2qsh s VAL 481 N 1.17 3.46 0.03 3.17 1.01 0.50 -1.19 120.40 128.55 2qsh s VAL 481 Ca 0.49 -0.52 0.05 0.00 0.00 0.00 0.00 61.98 61.99 2qsh s VAL 481 Cb -0.20 -2.48 -0.03 0.00 0.00 0.00 0.00 36.38 33.67 2qsh s VAL 481 CO 0.24 0.52 -0.09 -0.31 0.00 0.00 0.00 175.10 175.46 2qsh s TYR 482 N 0.25 2.81 0.25 5.22 1.51 0.11 -0.33 117.35 127.15 2qsh s TYR 482 Ca -0.06 -0.10 -0.30 0.00 -1.01 0.00 0.00 57.07 55.60 2qsh s TYR 482 Cb -0.15 -1.55 -0.09 0.00 -0.11 0.00 0.00 41.96 40.06 2qsh s TYR 482 CO 0.04 0.36 1.02 0.00 -1.11 0.00 0.00 175.55 175.86 2qsh s ALA 483 N -1.04 3.37 0.35 3.71 0.00 -1.26 0.02 121.76 126.91 2qsh s ALA 483 Ca 0.18 0.75 0.20 0.00 0.00 0.00 0.00 51.96 53.09 2qsh s ALA 483 Cb -0.11 -3.27 1.05 0.00 0.00 0.00 0.00 23.12 20.79 2qsh s ALA 483 CO 0.09 0.02 1.93 0.87 0.00 0.00 0.00 175.76 178.67 2qsh h LYS 484 N 4.11 0.00 0.00 0.00 1.57 -0.85 -2.22 116.57 119.18 2qsh h LYS 484 Ca -0.46 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.32 2qsh h LYS 484 Cb 1.21 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.52 2qsh h LYS 484 CO 0.68 0.24 0.00 0.07 -0.57 0.00 0.00 179.45 179.87 2qsh h ARG 485 N 0.00 0.00 -0.27 3.15 -0.00 -1.93 -1.73 114.38 113.60 2qsh h ARG 485 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 59.98 59.98 2qsh h ARG 485 Cb 0.53 0.00 0.00 0.00 -0.00 0.00 0.00 29.97 30.50 2qsh h ARG 485 CO 0.03 0.00 0.00 -0.25 -0.00 0.00 0.00 179.97 179.75 2qsh n ASP 486 N -3.01 3.11 -4.63 0.08 8.00 -0.83 -4.88 116.55 114.39 2qsh n ASP 486 Ca -0.02 -1.95 -0.34 0.00 0.71 0.00 0.00 54.79 53.18 2qsh n ASP 486 Cb 0.11 -0.17 -0.10 0.00 -0.02 0.00 0.00 41.12 40.94 2qsh n ASP 486 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 2qsh s ILE 487 N -1.67 4.78 -0.08 0.53 -1.09 -0.65 -0.82 121.20 122.19 2qsh s ILE 487 Ca 0.35 -0.04 -0.02 0.00 -2.23 0.00 0.00 60.65 58.71 2qsh s ILE 487 Cb 0.22 -3.15 -0.03 0.00 -1.58 0.00 0.00 42.46 37.91 2qsh s ILE 487 CO 0.31 0.46 0.02 0.00 -1.23 0.00 0.00 174.94 174.50 2qsh s ALA 488 N 0.38 3.37 -0.15 9.38 0.00 0.42 -4.92 121.76 130.24 2qsh s ALA 488 Ca 0.03 -0.79 -0.15 0.00 0.00 0.00 0.00 51.96 51.05 2qsh s ALA 488 Cb -0.12 -1.54 -0.05 0.00 0.00 0.00 0.00 23.12 21.41 2qsh s ALA 488 CO 0.00 0.60 0.33 -0.51 0.00 0.00 0.00 175.76 176.18 2qsh s ASP 489 N -0.95 6.48 0.12 0.00 1.01 -1.26 -1.87 116.67 120.20 2qsh s ASP 489 Ca 0.14 0.56 0.08 0.00 0.71 0.00 0.00 52.55 54.04 2qsh s ASP 489 Cb -0.11 -2.20 -0.04 0.00 1.01 0.00 0.00 42.92 41.57 2qsh s ASP 489 CO 0.03 0.08 -0.13 -0.76 0.21 0.00 0.00 175.17 174.60 2qsh s LEU 490 N 0.51 2.89 0.08 1.23 1.43 -0.77 -4.47 118.68 119.57 2qsh s LEU 490 Ca 0.18 -0.49 0.02 0.00 -1.03 0.00 0.00 54.13 52.81 2qsh s LEU 490 Cb -0.13 -1.69 -0.04 0.00 0.03 0.00 0.00 46.19 44.36 2qsh s LEU 490 CO 0.05 0.17 -0.06 -0.54 0.23 0.00 0.00 176.35 176.19 2qsh s LYS 491 N -2.28 0.72 0.87 1.70 1.02 -0.77 -4.86 119.74 116.14 2qsh s LYS 491 Ca 0.20 -1.16 -0.12 0.00 0.02 0.00 0.00 55.97 54.91 2qsh s LYS 491 Cb -0.11 -0.18 0.11 0.00 -0.52 0.00 0.00 37.83 37.14 2qsh s LYS 491 CO 0.12 -0.01 1.14 -1.54 -0.92 0.00 0.00 175.35 174.15 2qsh s SER 492 N -2.63 3.89 0.12 2.83 1.04 -1.26 -0.55 113.70 117.15 2qsh s SER 492 Ca 0.05 0.96 -0.23 0.00 0.48 0.00 0.00 55.95 57.21 2qsh s SER 492 Cb 0.01 -1.54 -0.05 0.00 0.10 0.00 0.00 66.02 64.54 2qsh s SER 492 CO -0.04 -2.31 1.67 0.00 0.98 0.00 0.00 173.24 173.55 2qsh h ALA 493 N -1.33 -0.12 -0.12 5.32 0.00 -1.98 0.26 119.26 121.29 2qsh h ALA 493 Ca -0.49 0.02 0.03 0.00 0.00 0.00 0.00 54.91 54.48 2qsh h ALA 493 Cb 1.32 0.27 -0.03 0.00 0.00 0.00 0.00 17.79 19.35 2qsh h ALA 493 CO 0.63 -0.62 -0.08 -0.09 0.00 0.00 0.00 179.25 179.09 2qsh h ARG 494 N -0.21 -0.08 -0.92 0.00 9.65 -1.94 -1.75 114.38 119.12 2qsh h ARG 494 Ca 0.07 0.01 0.12 0.00 -1.10 0.00 0.00 59.98 59.08 2qsh h ARG 494 Cb 0.30 0.02 -0.07 0.00 -1.39 0.00 0.00 29.97 28.83 2qsh h ARG 494 CO -0.18 -0.05 0.59 1.96 2.80 0.00 0.00 179.97 185.09 2qsh h GLN 495 N -0.08 0.81 -0.47 0.20 4.20 -1.83 -0.73 115.11 117.20 2qsh h GLN 495 Ca 0.07 -0.05 -0.13 0.00 0.06 0.00 0.00 58.65 58.60 2qsh h GLN 495 Cb 0.19 -0.18 -0.01 0.00 0.30 0.00 0.00 27.48 27.77 2qsh h GLN 495 CO -0.17 0.54 -0.22 -1.49 -0.67 0.00 0.00 178.83 176.82 2qsh h TRP 496 N 0.83 1.11 -0.89 2.96 4.06 -0.46 -3.04 115.95 120.53 2qsh h TRP 496 Ca 0.45 -0.27 0.03 0.00 2.06 0.00 0.00 58.89 61.17 2qsh h TRP 496 Cb 0.57 -0.26 -0.05 0.00 -1.00 0.00 0.00 29.16 28.42 2qsh h TRP 496 CO -0.00 1.09 0.58 -0.92 -3.56 0.00 0.00 178.44 175.63 2qsh h TYR 497 N 0.84 1.08 0.00 0.49 3.20 -0.29 0.30 116.97 122.58 2qsh h TYR 497 Ca 0.11 0.03 0.00 0.00 3.14 0.00 0.00 58.73 62.00 2qsh h TYR 497 Cb 0.79 -0.36 0.00 0.00 1.54 0.00 0.00 36.73 38.70 2qsh h TYR 497 CO 0.05 0.63 0.00 0.52 -1.64 0.00 0.00 178.16 177.72 2qsh h MET 498 N 1.12 0.00 -0.36 1.82 2.86 -1.24 0.23 114.93 119.37 2qsh h MET 498 Ca 0.35 0.00 -0.02 0.00 -2.06 0.00 0.00 59.70 57.97 2qsh h MET 498 Cb -0.00 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.64 2qsh h MET 498 CO -0.10 0.00 0.01 0.09 1.06 0.00 0.00 176.91 177.97 2qsh n ASN 499 N -2.69 4.26 -3.14 1.22 4.13 0.90 -4.77 115.26 115.18 2qsh n ASN 499 Ca -0.02 -3.05 -0.19 0.00 1.68 0.00 0.00 54.58 52.99 2qsh n ASN 499 Cb 0.06 -0.59 0.07 0.00 -1.54 0.00 0.00 39.78 37.78 2qsh n ASN 499 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2qsh n GLY 500 N -0.29 -0.31 3.00 7.41 0.00 0.81 -4.94 105.19 110.87 2qsh n GLY 500 Ca 0.24 0.10 -0.19 0.00 0.00 0.00 0.00 46.02 46.18 2qsh n GLY 500 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2qsh s ARG 501 N -5.91 0.73 0.44 1.61 0.52 -0.38 -2.21 118.95 113.75 2qsh s ARG 501 Ca 0.39 -0.28 0.07 0.00 -0.52 0.00 0.00 55.73 55.38 2qsh s ARG 501 Cb -0.17 -0.71 -0.03 0.00 0.52 0.00 0.00 34.95 34.56 2qsh s ARG 501 CO 0.62 0.15 0.24 0.96 0.02 0.00 0.00 175.30 177.30 2qsh s ILE 502 N -0.04 2.23 0.20 1.52 -5.25 -0.76 -2.28 121.20 116.82 2qsh s ILE 502 Ca 0.01 -1.61 -0.19 0.00 -0.99 0.00 0.00 60.65 57.88 2qsh s ILE 502 Cb -0.05 -2.84 -0.08 0.00 2.95 0.00 0.00 42.46 42.44 2qsh s ILE 502 CO -0.00 0.00 0.68 -0.76 -1.79 0.00 0.00 174.94 173.07 2qsh s LEU 503 N -4.00 4.36 0.86 0.37 1.43 -1.26 -0.55 118.68 119.89 2qsh s LEU 503 Ca 0.40 1.34 -0.11 0.00 -1.03 0.00 0.00 54.13 54.74 2qsh s LEU 503 Cb 0.01 -3.48 0.11 0.00 0.03 0.00 0.00 46.19 42.87 2qsh s LEU 503 CO 0.23 0.06 1.11 -0.54 0.23 0.00 0.00 176.35 177.43 2qsh s LYS 504 N -1.91 1.48 0.17 1.70 1.02 0.41 -4.79 119.74 117.81 2qsh s LYS 504 Ca 0.41 1.21 -0.31 0.00 0.02 0.00 0.00 55.97 57.31 2qsh s LYS 504 Cb -0.17 -1.80 -0.09 0.00 -0.52 0.00 0.00 37.83 35.25 2qsh s LYS 504 CO 0.21 -2.20 1.40 0.99 -0.92 0.00 0.00 175.35 174.82 2qsh s THR 505 N -2.80 3.05 -1.50 2.17 2.01 -1.26 -2.93 115.64 114.38 2qsh s THR 505 Ca 0.64 0.81 -0.06 0.00 0.31 0.00 0.00 61.69 63.39 2qsh s THR 505 Cb -0.20 -3.52 0.01 0.00 0.01 0.00 0.00 72.50 68.81 2qsh s THR 505 CO 0.57 0.09 0.74 0.61 -0.69 0.00 0.00 174.62 175.95 2qsh n GLY 506 N 2.91 -0.53 3.74 4.40 0.00 -1.26 -4.98 105.19 109.47 2qsh n GLY 506 Ca 0.09 0.16 -0.41 0.00 0.00 0.00 0.00 46.02 45.86 2qsh n GLY 506 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2qsh s SER 507 N -2.86 7.48 -0.10 1.61 0.01 -1.15 -5.06 113.70 113.64 2qsh s SER 507 Ca 0.38 1.90 -0.02 0.00 1.31 0.00 0.00 55.95 59.52 2qsh s SER 507 Cb -0.17 -2.60 -0.03 0.00 0.21 0.00 0.00 66.02 63.43 2qsh s SER 507 CO 0.47 -0.04 -0.02 -0.60 0.41 0.00 0.00 173.24 173.46 2qsh s ARG 508 N -0.38 3.13 0.47 12.44 3.52 -1.26 -5.04 118.95 131.83 2qsh s ARG 508 Ca 0.46 -0.45 -0.22 0.00 -0.13 0.00 0.00 55.73 55.39 2qsh s ARG 508 Cb -0.25 -2.80 -0.08 0.00 -1.56 0.00 0.00 34.95 30.26 2qsh s ARG 508 CO 0.32 0.58 1.09 0.00 -0.81 0.00 0.00 175.30 176.48 2qsh n LYS 510 N -0.69 0.46 -3.57 0.00 4.01 -0.55 -4.98 118.16 112.83 2qsh n LYS 510 Ca 0.08 -0.04 -0.14 0.00 -0.51 0.00 0.00 58.31 57.70 2qsh n LYS 510 Cb 0.50 -1.62 -0.05 0.00 -0.51 0.00 0.00 35.03 33.35 2qsh n LYS 510 CO 0.00 0.00 0.00 0.21 -1.11 0.00 0.00 177.40 176.50 2qsh s LYS 511 N -3.32 1.03 -0.05 1.97 2.20 -1.23 -5.04 119.74 115.30 2qsh s LYS 511 Ca -0.01 -0.18 0.02 0.00 -0.36 0.00 0.00 55.97 55.45 2qsh s LYS 511 Cb 0.13 0.47 0.01 0.00 -1.51 0.00 0.00 37.83 36.93 2qsh s LYS 511 CO 0.84 -0.36 -0.11 0.08 -0.36 0.00 0.00 175.35 175.44 2qsh s VAL 512 N -2.27 0.97 0.03 4.02 1.01 -1.26 -1.38 120.40 121.52 2qsh s VAL 512 Ca -0.06 -0.42 0.00 0.00 0.00 0.00 0.00 61.98 61.50 2qsh s VAL 512 Cb -0.01 -0.88 -0.03 0.00 0.00 0.00 0.00 36.38 35.46 2qsh s VAL 512 CO -0.00 0.31 -0.04 -0.63 0.00 0.00 0.00 175.10 174.74 2qsh s ILE 513 N 0.47 0.22 0.93 2.22 1.09 -0.50 -4.98 121.20 120.65 2qsh s ILE 513 Ca -0.09 -1.17 -0.12 0.00 -1.10 0.00 0.00 60.65 58.16 2qsh s ILE 513 Cb -0.13 -0.64 0.15 0.00 -1.06 0.00 0.00 42.46 40.78 2qsh s ILE 513 CO 0.02 -0.61 1.13 -0.54 -0.10 0.00 0.00 174.94 174.84 2qsh s LYS 514 N -2.11 0.99 0.00 2.79 -0.14 -1.26 -0.55 119.74 119.46 2qsh s LYS 514 Ca -0.09 0.33 0.00 0.00 -1.36 0.00 0.00 55.97 54.85 2qsh s LYS 514 Cb -0.05 -1.82 0.00 0.00 -1.68 0.00 0.00 37.83 34.28 2qsh s LYS 514 CO -0.03 -2.31 0.00 -2.13 -0.76 0.00 0.00 175.35 170.12 2qsh n ARG 515 N -3.85 0.00 -4.55 1.68 0.63 -0.22 -4.72 116.66 105.63 2qsh n ARG 515 Ca 0.06 0.00 -0.26 0.00 -0.92 0.00 0.00 57.85 56.74 2qsh n ARG 515 Cb 0.59 0.00 -0.11 0.00 0.45 0.00 0.00 32.46 33.39 2qsh n ARG 515 CO 0.00 0.00 0.00 0.99 -2.51 0.00 0.00 177.63 176.11 2qsh s THR 516 N 1.92 1.83 -0.72 5.15 2.01 -1.26 -4.62 115.64 119.95 2qsh s THR 516 Ca 0.00 -2.05 -0.26 0.00 0.31 0.00 0.00 61.69 59.69 2qsh s THR 516 Cb 0.00 -2.84 -0.11 0.00 0.01 0.00 0.00 72.50 69.57 2qsh s THR 516 CO 0.00 -0.07 2.34 -0.69 -0.69 0.00 0.00 174.62 175.51 2qsh s VAL 517 N -2.85 3.07 0.00 3.82 1.01 -1.26 -4.38 120.40 119.81 2qsh s VAL 517 Ca 0.34 -0.03 0.00 0.00 0.00 0.00 0.00 61.98 62.29 2qsh s VAL 517 Cb 0.08 -3.16 0.00 0.00 0.00 0.00 0.00 36.38 33.30 2qsh s VAL 517 CO 0.17 -0.15 0.00 -0.62 0.00 0.00 0.00 175.10 174.49 2qsh n GLU 526 N 8.89 0.00 -3.76 2.72 -0.58 -1.26 -5.28 120.64 121.37 2qsh n GLU 526 Ca 0.42 0.00 -0.12 0.00 -0.42 0.00 0.00 57.16 57.04 2qsh n GLU 526 Cb 0.47 0.00 -0.12 0.00 -0.57 0.00 0.00 31.44 31.22 2qsh n GLU 526 CO 0.00 0.00 0.00 -2.00 -0.48 0.00 0.00 177.13 174.65 2qsh s GLU 527 N 2.52 0.27 -0.59 3.49 2.56 -1.26 -4.93 118.70 120.75 2qsh s GLU 527 Ca 0.00 0.43 -0.19 0.00 0.00 0.00 0.00 54.97 55.21 2qsh s GLU 527 Cb 0.00 0.04 0.10 0.00 2.00 0.00 0.00 34.13 36.27 2qsh s GLU 527 CO 0.00 -0.09 0.70 -0.51 -0.56 0.00 0.00 175.26 174.80 2qsh s ASP 528 N 0.59 6.18 -0.06 -1.70 -0.00 -1.26 -1.05 116.67 119.37 2qsh s ASP 528 Ca -0.04 -1.43 -0.17 0.00 -0.00 0.00 0.00 52.55 50.91 2qsh s ASP 528 Cb -0.05 -2.30 -0.05 0.00 -0.00 0.00 0.00 42.92 40.52 2qsh s ASP 528 CO -0.03 -1.10 0.45 -1.83 -0.00 0.00 0.00 175.17 172.66 2qsh s GLU 529 N 2.66 4.19 0.18 8.23 -1.05 0.29 -4.88 118.70 128.31 2qsh s GLU 529 Ca 0.11 0.45 -0.12 0.00 -0.15 0.00 0.00 54.97 55.26 2qsh s GLU 529 Cb -0.24 -3.35 -0.07 0.00 -0.44 0.00 0.00 34.13 30.03 2qsh s GLU 529 CO 0.06 0.38 0.55 1.03 0.95 0.00 0.00 175.26 178.23 2qsh s ARG 530 N -0.10 3.91 0.04 -4.83 0.52 -1.26 -1.41 118.95 115.81 2qsh s ARG 530 Ca 0.25 0.41 0.08 0.00 -0.52 0.00 0.00 55.73 55.94 2qsh s ARG 530 Cb -0.16 -2.82 -0.03 0.00 0.52 0.00 0.00 34.95 32.47 2qsh s ARG 530 CO 0.12 0.42 -0.22 -0.51 0.02 0.00 0.00 175.30 175.12 2qsh s LEU 531 N -2.29 2.15 0.13 2.53 1.43 -0.48 -4.21 118.68 117.95 2qsh s LEU 531 Ca 0.41 -0.53 0.06 0.00 -1.03 0.00 0.00 54.13 53.05 2qsh s LEU 531 Cb -0.13 -1.07 -0.04 0.00 0.03 0.00 0.00 46.19 44.98 2qsh s LEU 531 CO 0.20 0.20 -0.13 -0.31 0.23 0.00 0.00 176.35 176.53 2qsh s TYR 532 N -0.77 1.39 0.50 0.29 1.51 0.29 -1.49 117.35 119.08 2qsh s TYR 532 Ca 0.09 -0.60 -0.04 0.00 -1.01 0.00 0.00 57.07 55.51 2qsh s TYR 532 Cb -0.09 -0.72 -0.02 0.00 -0.11 0.00 0.00 41.96 41.03 2qsh s TYR 532 CO 0.02 0.15 0.80 -1.54 -1.11 0.00 0.00 175.55 173.86 2qsh s SER 533 N -2.67 6.01 0.45 2.29 1.04 -1.26 -1.86 113.70 117.71 2qsh s SER 533 Ca 0.12 0.76 0.18 0.00 0.48 0.00 0.00 55.95 57.49 2qsh s SER 533 Cb -0.03 -1.99 1.14 0.00 0.10 0.00 0.00 66.02 65.24 2qsh s SER 533 CO 0.03 -0.73 1.93 0.15 0.98 0.00 0.00 173.24 175.60 2qsh h PHE 534 N 0.15 0.37 0.00 5.02 3.57 -1.96 -1.54 116.94 122.54 2qsh h PHE 534 Ca -0.46 0.01 -0.07 0.00 3.53 0.00 0.00 57.97 60.98 2qsh h PHE 534 Cb 1.23 -0.12 -0.01 0.00 2.79 0.00 0.00 35.95 39.84 2qsh h PHE 534 CO 0.53 0.14 -0.31 0.93 -2.23 0.00 0.00 178.31 177.36 2qsh h GLU 535 N 0.31 0.00 0.00 1.11 3.07 -1.98 -2.15 114.58 114.95 2qsh h GLU 535 Ca 0.35 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.21 2qsh h GLU 535 Cb 0.94 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.85 2qsh h GLU 535 CO -0.09 0.31 0.00 -0.25 -1.40 0.00 0.00 179.01 177.58 2qsh n ASP 536 N -3.54 0.00 -4.79 1.42 8.00 -0.58 -4.87 116.55 112.19 2qsh n ASP 536 Ca -0.00 -0.41 -0.23 0.00 0.71 0.00 0.00 54.79 54.86 2qsh n ASP 536 Cb 0.46 -0.19 -0.05 0.00 -0.02 0.00 0.00 41.12 41.32 2qsh n ASP 536 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 2qsh s THR 537 N -2.38 4.29 0.09 -3.53 -4.23 -0.81 -0.45 115.64 108.62 2qsh s THR 537 Ca 0.34 -1.44 0.05 0.00 -1.18 0.00 0.00 61.69 59.46 2qsh s THR 537 Cb 0.20 -3.30 -0.03 0.00 1.34 0.00 0.00 72.50 70.71 2qsh s THR 537 CO 0.42 -0.32 -0.12 -0.70 -0.54 0.00 0.00 174.62 173.36 2qsh s GLU 538 N -3.71 0.84 -0.05 3.99 2.12 0.29 -4.77 118.70 117.41 2qsh s GLU 538 Ca 0.32 -1.06 -0.30 0.00 0.36 0.00 0.00 54.97 54.30 2qsh s GLU 538 Cb -0.08 -0.71 -0.04 0.00 0.26 0.00 0.00 34.13 33.56 2qsh s GLU 538 CO 0.24 0.14 1.28 -1.17 -0.54 0.00 0.00 175.26 175.21 2qsh s LEU 539 N -2.08 4.28 -0.14 2.70 2.96 -1.26 -1.83 118.68 123.31 2qsh s LEU 539 Ca 0.02 1.90 -0.29 0.00 -0.22 0.00 0.00 54.13 55.53 2qsh s LEU 539 Cb -0.07 -3.56 -0.02 0.00 0.50 0.00 0.00 46.19 43.04 2qsh s LEU 539 CO 0.02 -0.66 1.30 -0.47 -1.32 0.00 0.00 176.35 175.22 2qsh s TYR 540 N 2.48 2.80 -0.26 5.38 5.04 -0.94 -4.85 117.35 127.00 2qsh s TYR 540 Ca 0.59 0.94 -0.06 0.00 -2.44 0.00 0.00 57.07 56.09 2qsh s TYR 540 Cb -0.27 -3.54 -0.01 0.00 0.35 0.00 0.00 41.96 38.50 2qsh s TYR 540 CO 0.23 -1.90 0.05 0.42 -1.34 0.00 0.00 175.55 173.00 2qsh s ILE 541 N 3.36 3.95 0.49 3.14 1.01 -1.26 -4.64 121.20 127.25 2qsh s ILE 541 Ca 0.57 -0.48 -0.19 0.00 0.00 0.00 0.00 60.65 60.56 2qsh s ILE 541 Cb -0.24 -2.92 -0.09 0.00 0.01 0.00 0.00 42.46 39.23 2qsh s ILE 541 CO 0.17 0.24 0.99 -2.16 0.00 0.00 0.00 174.94 174.19 2qsh s PRO 542 N 1.53 3.94 0.67 2.79 0.04 -1.26 -5.04 135.00 137.68 2qsh s PRO 542 Ca 0.05 1.13 -0.17 0.00 0.04 0.00 0.00 61.00 62.04 2qsh s PRO 542 Cb -0.16 -2.13 0.01 0.00 0.04 0.00 0.00 34.50 32.26 2qsh s PRO 542 CO 0.02 -0.29 1.24 -1.25 0.04 0.00 0.00 177.00 176.76 2qsh s PRO 543 N -3.59 2.46 0.68 0.56 0.04 -1.26 -4.63 135.00 129.25 2qsh s PRO 543 Ca 0.62 1.88 -0.13 0.00 0.04 0.00 0.00 61.00 63.42 2qsh s PRO 543 Cb -0.12 -1.86 0.00 0.00 0.04 0.00 0.00 34.50 32.57 2qsh s PRO 543 CO 0.23 -1.62 1.07 -0.51 0.04 0.00 0.00 177.00 176.21 2qsh s LEU 544 N -4.65 3.25 0.50 -3.56 2.01 -1.26 -4.73 118.68 110.25 2qsh s LEU 544 Ca 0.78 1.76 -0.20 0.00 0.01 0.00 0.00 54.13 56.48 2qsh s LEU 544 Cb -0.32 -4.52 -0.08 0.00 0.01 0.00 0.00 46.19 41.28 2qsh s LEU 544 CO 0.41 -1.50 1.06 0.00 1.01 0.00 0.00 176.35 177.33 2qsh s ALA 545 N -2.76 2.82 1.02 4.21 0.00 -1.26 -4.82 121.76 120.97 2qsh s ALA 545 Ca 0.61 0.65 -0.14 0.00 0.00 0.00 0.00 51.96 53.09 2qsh s ALA 545 Cb -0.16 -3.28 0.20 0.00 0.00 0.00 0.00 23.12 19.88 2qsh s ALA 545 CO 0.48 -0.45 1.13 -1.54 0.00 0.00 0.00 175.76 175.38 2qsh s SER 546 N -1.96 2.51 0.17 0.00 1.04 -0.70 -4.83 113.70 109.92 2qsh s SER 546 Ca 0.69 0.91 -0.20 0.00 0.48 0.00 0.00 55.95 57.82 2qsh s SER 546 Cb -0.18 -1.41 0.09 0.00 0.10 0.00 0.00 66.02 64.63 2qsh s SER 546 CO 0.22 -3.17 1.62 0.00 0.98 0.00 0.00 173.24 172.89 2qsh h ALA 547 N -1.92 0.01 0.00 5.32 0.00 -1.97 0.15 119.26 120.85 2qsh h ALA 547 Ca -0.51 0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.54 2qsh h ALA 547 Cb 1.32 0.56 0.00 0.00 0.00 0.00 0.00 17.79 19.66 2qsh h ALA 547 CO 0.52 -0.61 0.00 -1.13 0.00 0.00 0.00 179.25 178.03 2qsh n SER 548 N -5.40 0.00 0.00 0.00 3.41 -1.26 -4.83 113.62 105.54 2qsh n SER 548 Ca 0.02 0.22 0.00 0.00 -0.26 0.00 0.00 58.87 58.86 2qsh n SER 548 Cb 0.31 -0.33 0.00 0.00 -0.26 0.00 0.00 64.21 63.93 2qsh n SER 548 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2qsh n GLY 549 N -0.50 0.81 3.70 5.00 0.00 0.52 -4.61 105.19 110.10 2qsh n GLY 549 Ca 0.04 -0.41 -0.42 0.00 0.00 0.00 0.00 46.02 45.23 2qsh n GLY 549 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2qsh s GLU 550 N -0.86 4.50 0.08 1.61 2.12 -1.25 -4.45 118.70 120.45 2qsh s GLU 550 Ca 0.00 1.40 -0.08 0.00 0.36 0.00 0.00 54.97 56.65 2qsh s GLU 550 Cb 0.00 -3.49 -0.05 0.00 0.26 0.00 0.00 34.13 30.84 2qsh s GLU 550 CO 0.00 -0.16 0.36 0.42 -0.54 0.00 0.00 175.26 175.34 2qsh s ILE 551 N 1.42 5.17 -0.13 -3.70 1.09 -1.26 -1.72 121.20 122.07 2qsh s ILE 551 Ca 0.50 0.26 -0.19 0.00 -1.10 0.00 0.00 60.65 60.13 2qsh s ILE 551 Cb -0.20 -3.62 -0.04 0.00 -1.06 0.00 0.00 42.46 37.54 2qsh s ILE 551 CO 0.24 0.24 0.51 0.42 -0.10 0.00 0.00 174.94 176.25 2qsh s THR 552 N -1.44 5.16 0.19 2.92 -4.23 -1.26 -5.01 115.64 111.97 2qsh s THR 552 Ca 0.34 1.02 0.07 0.00 -1.18 0.00 0.00 61.69 61.94 2qsh s THR 552 Cb -0.13 -3.85 -0.05 0.00 1.34 0.00 0.00 72.50 69.81 2qsh s THR 552 CO 0.19 0.29 -0.14 -1.59 -0.54 0.00 0.00 174.62 172.83 2qsh s LYS 553 N 0.85 1.28 0.62 3.99 0.00 -1.26 -4.84 119.74 120.38 2qsh s LYS 553 Ca 0.27 -1.55 -0.10 0.00 0.00 0.00 0.00 55.97 54.59 2qsh s LYS 553 Cb -0.15 -1.07 0.16 0.00 0.00 0.00 0.00 37.83 36.76 2qsh s LYS 553 CO 0.11 0.18 0.52 0.27 0.00 0.00 0.00 175.35 176.43 2qsh n ASN 554 N -0.27 -1.80 0.28 0.03 0.23 0.87 -4.80 115.26 109.80 2qsh n ASN 554 Ca -0.09 -0.76 0.12 0.00 -0.53 0.00 0.00 54.58 53.33 2qsh n ASN 554 Cb 0.60 -0.49 0.80 0.00 -2.08 0.00 0.00 39.78 38.60 2qsh n ASN 554 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2qsh h THR 555 N -2.23 0.69 -0.02 5.53 1.03 -2.02 -1.00 112.91 114.90 2qsh h THR 555 Ca -0.20 -0.13 0.00 0.00 -0.01 0.00 0.00 66.41 66.07 2qsh h THR 555 Cb 0.62 1.08 0.00 0.00 -1.07 0.00 0.00 68.15 68.78 2qsh h THR 555 CO 0.13 0.03 0.00 0.49 -0.01 0.00 0.00 175.52 176.16 2qsh n PHE 556 N -4.01 0.00 -0.56 0.00 3.01 -1.26 -4.92 117.46 109.72 2qsh n PHE 556 Ca -0.03 -0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.43 2qsh n PHE 556 Cb 0.12 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.59 2qsh n PHE 556 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2qsh n GLY 557 N 1.18 0.67 3.51 1.37 0.00 -0.38 -5.07 105.19 106.48 2qsh n GLY 557 Ca 0.19 -0.41 -0.24 0.00 0.00 0.00 0.00 46.02 45.55 2qsh n GLY 557 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2qsh s ASN 558 N -2.37 3.74 -0.13 1.61 0.01 -1.26 -4.46 114.94 112.08 2qsh s ASN 558 Ca 0.00 -1.03 -0.04 0.00 -0.71 0.00 0.00 52.86 51.08 2qsh s ASN 558 Cb 0.00 -0.37 -0.03 0.00 0.41 0.00 0.00 41.25 41.25 2qsh s ASN 558 CO 0.00 -0.03 0.01 -0.51 -1.51 0.00 0.00 177.10 175.06 2qsh s ILE 559 N -2.51 4.33 -0.21 0.60 2.07 -0.35 -0.09 121.20 125.03 2qsh s ILE 559 Ca 0.31 -0.22 -0.19 0.00 -1.41 0.00 0.00 60.65 59.14 2qsh s ILE 559 Cb -0.03 -2.87 -0.03 0.00 0.13 0.00 0.00 42.46 39.66 2qsh s ILE 559 CO 0.16 0.54 0.55 -1.61 -1.91 0.00 0.00 174.94 172.68 2qsh s GLU 560 N -0.27 4.17 -0.47 3.50 2.02 -1.26 -1.27 118.70 125.12 2qsh s GLU 560 Ca 0.06 0.46 0.03 0.00 0.02 0.00 0.00 54.97 55.54 2qsh s GLU 560 Cb -0.12 -3.59 0.16 0.00 0.10 0.00 0.00 34.13 30.68 2qsh s GLU 560 CO 0.02 -0.22 0.33 0.08 0.02 0.00 0.00 175.26 175.49 2qsh s VAL 561 N 1.88 1.05 -1.38 2.63 1.01 -0.86 -4.88 120.40 119.85 2qsh s VAL 561 Ca 0.25 -2.82 0.24 0.00 0.00 0.00 0.00 61.98 59.64 2qsh s VAL 561 Cb -0.16 -1.72 -0.00 0.00 0.00 0.00 0.00 36.38 34.50 2qsh s VAL 561 CO 0.10 -1.08 1.24 0.49 0.00 0.00 0.00 175.10 175.84 2qsh n PHE 562 N 2.99 0.00 -3.75 5.22 3.01 -1.26 -4.40 117.46 119.27 2qsh n PHE 562 Ca 0.21 0.00 -0.13 0.00 1.01 0.00 0.00 57.45 58.54 2qsh n PHE 562 Cb 0.41 -0.10 -0.10 0.00 -0.01 0.00 0.00 39.48 39.68 2qsh n PHE 562 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2qsh s ALA 563 N -2.78 -0.90 0.31 4.37 0.00 -1.26 -4.87 121.76 116.63 2qsh s ALA 563 Ca 0.15 0.93 0.03 0.00 0.00 0.00 0.00 51.96 53.07 2qsh s ALA 563 Cb 0.18 -0.49 0.80 0.00 0.00 0.00 0.00 23.12 23.61 2qsh s ALA 563 CO 0.68 -0.19 1.57 -1.00 0.00 0.00 0.00 175.76 176.82 2qsh h PRO 564 N 5.25 0.00 -1.28 0.00 0.13 -1.98 1.67 132.00 135.79 2qsh h PRO 564 Ca -0.27 -0.00 0.44 0.00 -0.87 0.00 0.00 66.00 65.29 2qsh h PRO 564 Cb 1.18 -0.00 -0.14 0.00 0.13 0.00 0.00 31.00 32.17 2qsh h PRO 564 CO 0.30 0.00 0.81 1.15 -0.23 0.00 0.00 178.00 180.03 2qsh h THR 565 N 0.00 0.10 0.00 1.56 2.02 -1.96 -1.95 112.91 112.68 2qsh h THR 565 Ca 0.62 -0.03 0.00 0.00 0.77 0.00 0.00 66.41 67.78 2qsh h THR 565 Cb 1.31 0.01 0.00 0.00 -1.74 0.00 0.00 68.15 67.74 2qsh h THR 565 CO -0.92 0.01 0.00 0.23 0.37 0.00 0.00 175.52 175.21 2qsh n MET 566 N -4.78 0.24 -2.57 6.66 2.81 0.57 -4.60 117.12 115.45 2qsh n MET 566 Ca 0.38 0.00 -0.42 0.00 -1.81 0.00 0.00 57.70 55.85 2qsh n MET 566 Cb 1.42 -1.50 -0.03 0.00 -0.71 0.00 0.00 33.22 32.40 2qsh n MET 566 CO 0.00 0.00 0.00 0.42 1.51 0.00 0.00 175.97 177.90 2qsh s ILE 567 N -2.75 4.47 0.46 2.02 1.01 -0.74 -4.77 121.20 120.90 2qsh s ILE 567 Ca 0.22 1.77 -0.23 0.00 0.00 0.00 0.00 60.65 62.41 2qsh s ILE 567 Cb 0.20 -4.14 -0.09 0.00 0.01 0.00 0.00 42.46 38.44 2qsh s ILE 567 CO 0.49 0.10 1.10 -2.65 0.00 0.00 0.00 174.94 173.98 2qsh n PRO 568 N 4.21 1.46 -0.36 2.79 -0.02 -1.26 -4.82 135.00 137.01 2qsh n PRO 568 Ca 0.08 0.53 0.05 0.00 -2.02 0.00 0.00 63.50 62.14 2qsh n PRO 568 Cb 0.48 -2.21 0.21 0.00 -0.02 0.00 0.00 33.50 31.96 2qsh n PRO 568 CO 0.00 0.00 0.00 0.78 1.98 0.00 0.00 175.50 178.26 2qsh h GLY 569 N 1.50 1.57 -1.99 -1.23 0.00 -1.86 -1.23 103.07 99.82 2qsh h GLY 569 Ca -0.47 -0.44 0.00 0.00 0.00 0.00 0.00 47.33 46.43 2qsh h GLY 569 CO 0.57 0.23 0.00 1.16 0.00 0.00 0.00 176.54 178.49 2qsh n ASN 570 N -4.58 2.95 -4.58 0.19 2.04 -1.26 -4.95 115.26 105.07 2qsh n ASN 570 Ca 0.17 -2.29 -0.29 0.00 -0.44 0.00 0.00 54.58 51.73 2qsh n ASN 570 Cb 0.28 -0.46 -0.09 0.00 -2.53 0.00 0.00 39.78 36.98 2qsh n ASN 570 CO 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 177.26 176.82 2qsh s LEU 573 N -1.97 4.15 -0.27 0.00 2.96 -1.26 -2.43 118.68 119.86 2qsh s LEU 573 Ca -0.08 0.25 -0.01 0.00 -0.22 0.00 0.00 54.13 54.08 2qsh s LEU 573 Cb -0.03 -2.21 0.04 0.00 0.50 0.00 0.00 46.19 44.49 2qsh s LEU 573 CO -0.04 0.06 -0.05 -0.69 -1.32 0.00 0.00 176.35 174.32 2qsh s VAL 574 N 0.91 2.80 -0.31 1.68 1.01 0.95 -4.99 120.40 122.45 2qsh s VAL 574 Ca 0.11 -1.23 -0.12 0.00 0.00 0.00 0.00 61.98 60.73 2qsh s VAL 574 Cb -0.13 -2.51 -0.03 0.00 0.00 0.00 0.00 36.38 33.70 2qsh s VAL 574 CO 0.04 0.07 0.22 -1.61 0.00 0.00 0.00 175.10 173.81 2qsh s GLU 575 N 1.27 3.71 -0.29 2.72 2.02 -1.26 -0.89 118.70 125.98 2qsh s GLU 575 Ca -0.03 -0.49 -0.21 0.00 0.02 0.00 0.00 54.97 54.26 2qsh s GLU 575 Cb -0.18 -3.74 0.13 0.00 0.10 0.00 0.00 34.13 30.44 2qsh s GLU 575 CO -0.04 -0.32 1.02 1.21 0.02 0.00 0.00 175.26 177.16 2qsh s ASN 576 N 1.74 -0.47 0.59 -0.19 3.84 -1.16 -5.01 114.94 114.27 2qsh s ASN 576 Ca 0.07 0.83 0.30 0.00 0.21 0.00 0.00 52.86 54.27 2qsh s ASN 576 Cb -0.17 0.99 1.35 0.00 -0.55 0.00 0.00 41.25 42.87 2qsh s ASN 576 CO 0.11 -0.14 1.71 -0.65 -2.79 0.00 0.00 177.10 175.34 2qsh h PRO 577 N 4.94 0.00 -0.11 0.43 0.11 -1.96 -2.38 132.00 133.02 2qsh h PRO 577 Ca -0.28 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.83 2qsh h PRO 577 Cb 1.18 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.29 2qsh h PRO 577 CO 0.15 0.00 0.00 1.33 -0.21 0.00 0.00 178.00 179.27 2qsh n VAL 578 N -3.67 0.72 0.19 3.15 0.24 -1.26 -4.71 118.33 112.99 2qsh n VAL 578 Ca 0.17 -0.86 0.11 0.00 -2.04 0.00 0.00 64.34 61.72 2qsh n VAL 578 Cb 1.05 0.67 0.65 0.00 -1.47 0.00 0.00 33.84 34.73 2qsh n VAL 578 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2qsh h ALA 579 N 0.92 2.13 0.14 2.33 0.00 -1.78 -1.20 119.26 121.80 2qsh h ALA 579 Ca 0.00 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 2qsh h ALA 579 Cb 0.49 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.29 2qsh h ALA 579 CO 0.00 -0.17 -0.07 0.82 0.00 0.00 0.00 179.25 179.83 2qsh h ILE 580 N 0.01 0.97 -0.98 0.00 5.03 -1.84 -1.94 117.51 118.76 2qsh h ILE 580 Ca 0.07 -1.10 0.19 0.00 -0.12 0.00 0.00 64.86 63.90 2qsh h ILE 580 Cb 0.26 1.59 -0.09 0.00 -3.03 0.00 0.00 36.82 35.55 2qsh h ILE 580 CO -0.00 0.24 0.61 0.50 -0.68 0.00 0.00 178.15 178.82 2qsh h LYS 581 N -0.77 0.65 0.55 2.37 3.64 -1.78 -0.72 116.57 120.50 2qsh h LYS 581 Ca -0.02 -0.04 -0.03 0.00 -1.27 0.00 0.00 60.65 59.29 2qsh h LYS 581 Cb 0.53 -0.15 0.01 0.00 -0.41 0.00 0.00 32.23 32.21 2qsh h LYS 581 CO 0.03 0.43 -0.26 0.00 -2.27 0.00 0.00 179.45 177.38 2qsh h ALA 582 N 1.63 -0.73 -0.67 5.00 0.00 -1.23 -2.41 119.26 120.85 2qsh h ALA 582 Ca 0.55 -0.19 0.04 0.00 0.00 0.00 0.00 54.91 55.31 2qsh h ALA 582 Cb 0.97 0.28 -0.04 0.00 0.00 0.00 0.00 17.79 19.01 2qsh h ALA 582 CO -0.32 -0.81 0.44 0.00 0.00 0.00 0.00 179.25 178.56 2qsh h ALA 583 N -0.61 1.67 -0.34 0.00 0.00 -0.51 -0.77 119.26 118.69 2qsh h ALA 583 Ca -0.07 -0.03 -0.10 0.00 0.00 0.00 0.00 54.91 54.70 2qsh h ALA 583 Cb 0.63 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.20 2qsh h ALA 583 CO 0.12 0.25 -0.21 0.00 0.00 0.00 0.00 179.25 179.41 2qsh h ARG 584 N 0.76 0.66 -0.48 0.00 3.08 -1.18 -2.37 114.38 114.85 2qsh h ARG 584 Ca 0.27 -0.25 -0.13 0.00 0.07 0.00 0.00 59.98 59.94 2qsh h ARG 584 Cb 0.14 -0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.13 2qsh h ARG 584 CO -0.08 0.82 -0.21 0.35 -1.07 0.00 0.00 179.97 179.78 2qsh h PHE 585 N 0.58 1.12 0.00 3.04 3.04 -0.64 -2.54 116.94 121.54 2qsh h PHE 585 Ca 0.09 -0.27 0.00 0.00 3.98 0.00 0.00 57.97 61.77 2qsh h PHE 585 Cb 0.68 -0.26 0.00 0.00 2.56 0.00 0.00 35.95 38.93 2qsh h PHE 585 CO 0.03 1.09 0.00 -0.07 -2.02 0.00 0.00 178.31 177.34 2qsh h LEU 586 N 0.85 0.00 0.42 0.59 3.38 -1.29 -3.46 115.31 115.79 2qsh h LEU 586 Ca 0.11 0.00 -0.18 0.00 0.09 0.00 0.00 57.88 57.90 2qsh h LEU 586 Cb 0.79 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 41.46 2qsh h LEU 586 CO 0.07 0.00 -0.16 0.61 0.09 0.00 0.00 178.44 179.04 2qsh n GLY 587 N 0.54 0.97 3.92 0.83 0.00 -0.90 -4.99 105.19 105.57 2qsh n GLY 587 Ca 0.03 -0.22 -0.27 0.00 0.00 0.00 0.00 46.02 45.55 2qsh n GLY 587 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qsh s VAL 588 N -2.07 2.12 -0.19 1.61 0.11 -1.17 -5.04 120.40 115.78 2qsh s VAL 588 Ca 0.00 -0.15 -0.20 0.00 -2.93 0.00 0.00 61.98 58.70 2qsh s VAL 588 Cb 0.00 -2.97 -0.03 0.00 -1.53 0.00 0.00 36.38 31.85 2qsh s VAL 588 CO 0.00 0.00 0.57 -0.70 -3.33 0.00 0.00 175.10 171.64 2qsh s GLU 589 N -5.46 4.22 0.23 1.54 2.56 -1.26 -4.84 118.70 115.69 2qsh s GLU 589 Ca 0.63 0.52 -0.01 0.00 0.00 0.00 0.00 54.97 56.11 2qsh s GLU 589 Cb -0.09 -3.56 0.01 0.00 2.00 0.00 0.00 34.13 32.49 2qsh s GLU 589 CO 0.48 -0.16 0.33 1.97 -0.56 0.00 0.00 175.26 177.32 2qsh n PHE 590 N 4.78 -1.13 -3.68 5.30 1.16 -1.26 -4.54 117.46 118.08 2qsh n PHE 590 Ca -0.03 -1.54 -0.09 0.00 -1.87 0.00 0.00 57.45 53.91 2qsh n PHE 590 Cb 0.50 0.37 -0.10 0.00 -1.61 0.00 0.00 39.48 38.64 2qsh n PHE 590 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 2qsh s ALA 591 N -2.34 -1.17 0.37 1.98 0.00 -0.75 -4.68 121.76 115.16 2qsh s ALA 591 Ca 0.19 1.63 -0.28 0.00 0.00 0.00 0.00 51.96 53.50 2qsh s ALA 591 Cb -0.01 -1.09 -0.10 0.00 0.00 0.00 0.00 23.12 21.92 2qsh s ALA 591 CO 0.14 -0.40 1.38 -2.14 0.00 0.00 0.00 175.76 174.74 2qsh s PRO 592 N 1.73 4.16 -0.32 0.00 0.02 -1.26 -0.94 135.00 138.39 2qsh s PRO 592 Ca -0.08 2.36 -0.10 0.00 0.02 0.00 0.00 61.00 63.20 2qsh s PRO 592 Cb -0.09 -2.96 -0.01 0.00 0.02 0.00 0.00 34.50 31.46 2qsh s PRO 592 CO -0.14 -0.41 0.17 0.00 -0.33 0.00 0.00 177.00 176.30 2qsh s ALA 593 N -1.15 3.34 -0.55 -1.55 0.00 0.01 -1.21 121.76 120.65 2qsh s ALA 593 Ca 0.52 -1.37 -0.22 0.00 0.00 0.00 0.00 51.96 50.90 2qsh s ALA 593 Cb -0.42 -2.45 0.06 0.00 0.00 0.00 0.00 23.12 20.30 2qsh s ALA 593 CO 0.57 -0.90 0.81 0.08 0.00 0.00 0.00 175.76 176.32 2qsh s VAL 594 N 1.65 4.59 -0.32 0.00 1.01 -0.40 -1.92 120.40 125.00 2qsh s VAL 594 Ca 0.05 -0.19 0.22 0.00 0.00 0.00 0.00 61.98 62.06 2qsh s VAL 594 Cb -0.17 -4.47 -0.18 0.00 0.00 0.00 0.00 36.38 31.56 2qsh s VAL 594 CO 0.07 -1.05 0.81 0.35 0.00 0.00 0.00 175.10 175.29 2qsh n THR 595 N 5.90 0.21 -3.75 3.92 -2.24 -0.85 -2.02 114.28 115.45 2qsh n THR 595 Ca -0.03 -0.40 -0.00 0.00 -2.27 0.00 0.00 64.05 61.35 2qsh n THR 595 Cb 0.46 0.04 0.01 0.00 -2.10 0.00 0.00 70.33 68.74 2qsh n THR 595 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 2qsh n SER 596 N -2.22 -0.68 -3.97 3.42 3.41 -1.25 -4.53 113.62 107.80 2qsh n SER 596 Ca -0.01 -1.29 -0.26 0.00 -0.26 0.00 0.00 58.87 57.05 2qsh n SER 596 Cb 0.51 1.09 -0.17 0.00 -0.26 0.00 0.00 64.21 65.38 2qsh n SER 596 CO 0.00 0.00 0.00 -0.36 -0.16 0.00 0.00 175.04 174.52 2qsh s PHE 597 N -3.62 1.58 -0.20 7.33 0.40 -1.26 -0.80 117.98 121.41 2qsh s PHE 597 Ca 0.12 -0.73 -0.23 0.00 -0.60 0.00 0.00 56.93 55.48 2qsh s PHE 597 Cb -0.01 -1.23 -0.02 0.00 0.51 0.00 0.00 43.02 42.28 2qsh s PHE 597 CO 0.01 -0.45 0.75 0.21 0.70 0.00 0.00 175.22 176.44 2qsh s LYS 598 N 1.28 4.22 -0.21 0.44 2.47 -0.67 -4.95 119.74 122.32 2qsh s LYS 598 Ca -0.03 0.83 -0.09 0.00 -1.56 0.00 0.00 55.97 55.12 2qsh s LYS 598 Cb -0.14 -3.60 -0.04 0.00 -1.46 0.00 0.00 37.83 32.59 2qsh s LYS 598 CO -0.04 -0.35 0.11 -0.06 0.16 0.00 0.00 175.35 175.16 2qsh s PHE 599 N 2.27 3.28 0.19 4.03 0.40 -1.26 -2.16 117.98 124.74 2qsh s PHE 599 Ca 0.33 0.11 -0.01 0.00 -0.60 0.00 0.00 56.93 56.76 2qsh s PHE 599 Cb -0.16 -2.17 -0.04 0.00 0.51 0.00 0.00 43.02 41.16 2qsh s PHE 599 CO 0.10 0.09 0.13 -2.00 0.70 0.00 0.00 175.22 174.24 2qsh s GLU 600 N 0.74 1.18 0.96 0.44 2.56 -1.25 -5.06 118.70 118.28 2qsh s GLU 600 Ca 0.06 -1.60 -0.16 0.00 0.00 0.00 0.00 54.97 53.26 2qsh s GLU 600 Cb -0.13 0.27 0.25 0.00 2.00 0.00 0.00 34.13 36.52 2qsh s GLU 600 CO 0.02 -0.39 0.64 0.54 -0.56 0.00 0.00 175.26 175.51 2qsh n ARG 601 N -0.26 -3.55 0.00 4.30 3.00 -1.26 -4.21 116.66 114.68 2qsh n ARG 601 Ca 0.01 -1.06 0.00 0.00 -0.01 0.00 0.00 57.85 56.80 2qsh n ARG 601 Cb 0.66 -1.24 0.00 0.00 0.00 0.00 0.00 32.46 31.87 2qsh n ARG 601 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2qsh n GLY 602 N -3.53 2.04 0.00 -0.13 0.00 -1.26 -3.70 105.19 98.61 2qsh n GLY 602 Ca 0.10 -0.36 0.00 0.00 0.00 0.00 0.00 46.02 45.76 2qsh n GLY 602 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2qsh n SER 603 N 4.10 0.00 -4.13 1.61 7.64 -1.26 -5.16 113.62 116.41 2qsh n SER 603 Ca 0.00 0.00 -0.29 0.00 1.01 0.00 0.00 58.87 59.59 2qsh n SER 603 Cb 0.00 0.00 -0.17 0.00 -1.01 0.00 0.00 64.21 63.03 2qsh n SER 603 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 2qsh s THR 604 N 0.00 1.69 0.49 0.44 2.01 -1.24 -5.10 115.64 113.93 2qsh s THR 604 Ca 0.00 -0.80 -0.18 0.00 0.31 0.00 0.00 61.69 61.02 2qsh s THR 604 Cb 0.00 -1.49 -0.09 0.00 0.01 0.00 0.00 72.50 70.93 2qsh s THR 604 CO 0.00 0.48 0.98 -0.69 -0.69 0.00 0.00 174.62 174.70 2qsh s VAL 605 N 0.55 4.48 -0.02 3.82 1.01 -1.26 -3.93 120.40 125.05 2qsh s VAL 605 Ca -0.15 1.29 0.01 0.00 0.00 0.00 0.00 61.98 63.13 2qsh s VAL 605 Cb -0.17 -3.68 0.01 0.00 0.00 0.00 0.00 36.38 32.54 2qsh s VAL 605 CO 0.05 -0.58 -0.02 -0.75 0.00 0.00 0.00 175.10 173.81 2qsh s LYS 606 N -3.81 0.29 0.25 2.72 2.47 -0.92 -5.02 119.74 115.73 2qsh s LYS 606 Ca 0.60 -0.03 -0.30 0.00 -1.56 0.00 0.00 55.97 54.68 2qsh s LYS 606 Cb -0.10 -0.37 -0.09 0.00 -1.46 0.00 0.00 37.83 35.81 2qsh s LYS 606 CO 0.26 -0.03 1.10 -1.25 0.16 0.00 0.00 175.35 175.59 2qsh s PRO 607 N 0.44 4.63 -0.54 4.03 0.04 -1.26 -1.67 135.00 140.67 2qsh s PRO 607 Ca -0.04 1.78 -0.17 0.00 0.04 0.00 0.00 61.00 62.61 2qsh s PRO 607 Cb -0.07 -3.21 0.11 0.00 0.04 0.00 0.00 34.50 31.36 2qsh s PRO 607 CO -0.01 0.18 0.55 0.08 0.04 0.00 0.00 177.00 177.84 2qsh s VAL 608 N -0.92 5.07 -1.02 -0.36 1.01 0.02 -4.83 120.40 119.36 2qsh s VAL 608 Ca 0.46 -1.19 -0.20 0.00 0.00 0.00 0.00 61.98 61.05 2qsh s VAL 608 Cb -0.31 -4.34 0.09 0.00 0.00 0.00 0.00 36.38 31.82 2qsh s VAL 608 CO 0.39 -0.89 1.34 -0.76 0.00 0.00 0.00 175.10 175.19 2qsh s LEU 609 N 2.01 4.28 0.00 3.92 1.02 -1.26 -2.00 118.68 126.66 2qsh s LEU 609 Ca 0.07 -1.90 0.24 0.00 0.02 0.00 0.00 54.13 52.55 2qsh s LEU 609 Cb -0.26 -2.49 1.00 0.00 0.02 0.00 0.00 46.19 44.46 2qsh s LEU 609 CO 0.05 -1.24 1.70 -1.54 0.02 0.00 0.00 176.35 175.34 2qsh n SER 610 N 7.64 1.25 0.00 2.29 3.41 -0.81 -4.93 113.62 122.47 2qsh n SER 610 Ca 0.31 -1.54 0.00 0.00 -0.26 0.00 0.00 58.87 57.38 2qsh n SER 610 Cb 0.49 -0.05 0.00 0.00 -0.26 0.00 0.00 64.21 64.39 2qsh n SER 610 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2qsh n GLY 611 N 1.09 -0.64 2.90 5.00 0.00 -1.24 -2.99 105.19 109.31 2qsh n GLY 611 Ca 0.18 -0.38 -0.12 0.00 0.00 0.00 0.00 46.02 45.69 2qsh n GLY 611 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2qsh s ILE 612 N -4.00 0.10 -0.23 -0.61 -1.09 -0.07 -0.81 121.20 114.49 2qsh s ILE 612 Ca 0.00 -0.14 -0.04 0.00 -2.23 0.00 0.00 60.65 58.24 2qsh s ILE 612 Cb 0.00 -0.11 -0.00 0.00 -1.58 0.00 0.00 42.46 40.77 2qsh s ILE 612 CO 0.00 -0.03 -0.04 -0.69 -1.23 0.00 0.00 174.94 172.95 2qsh s VAL 613 N -0.18 3.28 0.33 2.92 1.01 -0.12 -0.03 120.40 127.61 2qsh s VAL 613 Ca -0.01 -0.61 0.08 0.00 0.00 0.00 0.00 61.98 61.44 2qsh s VAL 613 Cb -0.01 -2.53 -0.06 0.00 0.00 0.00 0.00 36.38 33.77 2qsh s VAL 613 CO -0.00 0.37 -0.06 0.68 0.00 0.00 0.00 175.10 176.09 2qsh s VAL 614 N 1.45 1.95 0.78 2.92 -7.23 -1.02 -1.82 120.40 117.43 2qsh s VAL 614 Ca 0.05 -2.14 -0.13 0.00 -1.81 0.00 0.00 61.98 57.94 2qsh s VAL 614 Cb -0.15 -2.64 0.07 0.00 0.56 0.00 0.00 36.38 34.22 2qsh s VAL 614 CO -0.04 -0.19 1.19 0.00 -0.31 0.00 0.00 175.10 175.75 2qsh s ALA 615 N -2.79 1.95 0.23 1.32 0.00 -1.26 -1.37 121.76 119.83 2qsh s ALA 615 Ca 0.32 0.79 -0.07 0.00 0.00 0.00 0.00 51.96 53.00 2qsh s ALA 615 Cb 0.04 -3.46 0.21 0.00 0.00 0.00 0.00 23.12 19.91 2qsh s ALA 615 CO 0.15 -2.12 1.86 0.87 0.00 0.00 0.00 175.76 176.53 2qsh h LYS 616 N -0.75 1.26 0.00 0.00 1.57 -1.52 -2.75 116.57 114.37 2qsh h LYS 616 Ca -0.46 -0.14 0.00 0.00 -1.87 0.00 0.00 60.65 58.18 2qsh h LYS 616 Cb 1.29 -0.25 0.00 0.00 0.08 0.00 0.00 32.23 33.34 2qsh h LYS 616 CO 0.48 0.91 0.00 -2.67 -0.57 0.00 0.00 179.45 177.60 2qsh n TRP 617 N -4.34 0.00 0.54 -1.35 2.14 -1.26 -2.06 117.44 111.10 2qsh n TRP 617 Ca 0.10 0.00 0.08 0.00 2.07 0.00 0.00 57.50 59.74 2qsh n TRP 617 Cb 0.09 -0.22 0.08 0.00 -0.81 0.00 0.00 31.31 30.44 2qsh n TRP 617 CO 0.00 0.00 0.00 1.28 2.07 0.00 0.00 177.69 181.04 2qsh n LEU 618 N -1.22 2.35 0.10 5.67 4.77 -1.04 -4.70 117.00 122.94 2qsh n LEU 618 Ca 0.09 -1.10 -0.13 0.00 -0.03 0.00 0.00 56.01 54.85 2qsh n LEU 618 Cb 0.12 -0.03 -0.06 0.00 -2.33 0.00 0.00 43.42 41.12 2qsh n LEU 618 CO 0.12 0.45 0.65 -0.09 -1.33 0.00 0.00 177.39 177.19 2qsh h ARG 619 N 2.93 -0.50 -0.12 3.23 2.43 -1.50 -1.54 114.38 119.32 2qsh h ARG 619 Ca 0.00 0.03 -0.10 0.00 -0.81 0.00 0.00 59.98 59.10 2qsh h ARG 619 Cb 0.64 0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 30.30 2qsh h ARG 619 CO 0.00 -0.33 -0.39 1.05 -1.51 0.00 0.00 179.97 178.79 2qsh h GLU 620 N -0.52 0.25 -0.09 0.20 4.11 -1.84 0.12 114.58 116.82 2qsh h GLU 620 Ca 0.04 -0.11 0.01 0.00 0.07 0.00 0.00 59.36 59.36 2qsh h GLU 620 Cb 0.56 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.80 2qsh h GLU 620 CO -0.20 0.61 0.02 0.00 0.07 0.00 0.00 179.01 179.50 2qsh h ALA 621 N 1.38 0.08 -0.36 1.06 0.00 -1.83 0.31 119.26 119.89 2qsh h ALA 621 Ca 0.02 0.01 0.01 0.00 0.00 0.00 0.00 54.91 54.96 2qsh h ALA 621 Cb 0.79 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.57 2qsh h ALA 621 CO 0.06 -0.45 0.22 0.82 0.00 0.00 0.00 179.25 179.90 2qsh h ILE 622 N 0.05 1.05 -0.21 0.00 1.08 -0.70 -1.89 117.51 116.90 2qsh h ILE 622 Ca 0.04 -0.15 -0.06 0.00 -0.39 0.00 0.00 64.86 64.29 2qsh h ILE 622 Cb 0.03 0.56 -0.01 0.00 -3.07 0.00 0.00 36.82 34.33 2qsh h ILE 622 CO -0.05 0.08 -0.13 -0.33 -0.69 0.00 0.00 178.15 177.03 2qsh h GLU 623 N 0.45 0.34 0.21 2.37 5.08 -0.51 0.04 114.58 122.55 2qsh h GLU 623 Ca 0.14 -0.09 -0.01 0.00 -1.00 0.00 0.00 59.36 58.40 2qsh h GLU 623 Cb -0.01 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.20 2qsh h GLU 623 CO -0.06 0.48 -0.10 1.15 -1.00 0.00 0.00 179.01 179.48 2qsh h THR 624 N 0.32 0.88 -0.34 1.13 2.02 -0.63 -2.35 112.91 113.94 2qsh h THR 624 Ca 0.06 -0.71 0.07 0.00 0.77 0.00 0.00 66.41 66.61 2qsh h THR 624 Cb 0.43 1.28 -0.07 0.00 -1.74 0.00 0.00 68.15 68.05 2qsh h THR 624 CO 0.03 0.15 -0.15 0.00 0.37 0.00 0.00 175.52 175.92 2qsh h ALA 625 N 0.03 0.12 -0.50 6.16 0.00 -1.14 -1.23 119.26 122.71 2qsh h ALA 625 Ca -0.03 0.13 0.10 0.00 0.00 0.00 0.00 54.91 55.11 2qsh h ALA 625 Cb 0.46 0.38 -0.09 0.00 0.00 0.00 0.00 17.79 18.54 2qsh h ALA 625 CO 0.05 -0.53 -0.09 0.82 0.00 0.00 0.00 179.25 179.50 2qsh h ILE 626 N -0.09 0.53 -0.26 0.00 2.04 -1.00 0.12 117.51 118.85 2qsh h ILE 626 Ca 0.17 -0.01 0.02 0.00 1.00 0.00 0.00 64.86 66.05 2qsh h ILE 626 Cb 0.36 0.50 -0.01 0.00 -0.74 0.00 0.00 36.82 36.92 2qsh h ILE 626 CO -0.41 0.01 0.18 -0.78 0.00 0.00 0.00 178.15 177.15 2qsh h ASP 627 N 0.03 0.22 -0.82 1.72 3.58 -0.85 -1.95 116.42 118.35 2qsh h ASP 627 Ca 0.24 -0.00 -0.41 0.00 0.42 0.00 0.00 57.03 57.28 2qsh h ASP 627 Cb 0.37 -0.05 -0.25 0.00 1.72 0.00 0.00 39.33 41.12 2qsh h ASP 627 CO -0.48 0.16 0.45 0.61 -2.88 0.00 0.00 179.24 177.09 2qsh n GLY 628 N -1.52 4.54 0.33 -0.78 0.00 0.33 -4.74 105.19 103.36 2qsh n GLY 628 Ca 0.02 -1.12 0.10 0.00 0.00 0.00 0.00 46.02 45.02 2qsh n GLY 628 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 2qsh h ILE 629 N 1.12 0.95 0.00 -0.61 6.09 -0.47 -0.70 117.51 123.89 2qsh h ILE 629 Ca 0.51 -0.13 0.00 0.00 -1.37 0.00 0.00 64.86 63.87 2qsh h ILE 629 Cb 2.54 0.53 0.00 0.00 0.47 0.00 0.00 36.82 40.36 2qsh h ILE 629 CO 0.90 0.07 0.00 1.05 -3.07 0.00 0.00 178.15 177.10 2qsh h GLU 630 N 0.38 0.00 -0.02 2.19 4.11 -1.86 -2.17 114.58 117.22 2qsh h GLU 630 Ca 0.22 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.65 2qsh h GLU 630 Cb 0.36 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.61 2qsh h GLU 630 CO -0.05 0.00 -0.33 1.19 0.07 0.00 0.00 179.01 179.89 2qsh n PHE 631 N -2.52 0.00 1.59 2.06 3.01 -0.27 -5.29 117.46 116.05 2qsh n PHE 631 Ca -0.01 0.00 0.14 0.00 1.01 0.00 0.00 57.45 58.60 2qsh n PHE 631 Cb 0.11 -0.02 0.60 0.00 -0.01 0.00 0.00 39.48 40.16 2qsh n PHE 631 CO 0.00 0.00 0.00 -0.89 1.01 0.00 0.00 176.76 176.88