#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qsf s THR 127 N 0.00 0.23 0.43 5.15 -1.32 -1.26 -5.14 115.64 113.73 2qsf s THR 127 Ca 0.00 -1.14 -0.25 0.00 -1.21 0.00 0.00 61.69 59.08 2qsf s THR 127 Cb 0.00 -0.61 -0.08 0.00 -1.51 0.00 0.00 72.50 70.30 2qsf s THR 127 CO 0.00 -0.58 1.31 -0.55 -2.21 0.00 0.00 174.62 172.58 2qsf s SER 128 N -1.81 6.17 0.00 8.08 0.15 -1.26 -4.92 113.70 120.12 2qsf s SER 128 Ca -0.10 2.66 0.15 0.00 0.70 0.00 0.00 55.95 59.36 2qsf s SER 128 Cb -0.06 -2.64 0.72 0.00 -1.71 0.00 0.00 66.02 62.33 2qsf s SER 128 CO -0.03 -0.95 1.47 -2.11 1.20 0.00 0.00 173.24 172.83 2qsf n ARG 129 N -0.05 0.10 -0.71 5.44 1.85 -1.26 -3.02 116.66 119.02 2qsf n ARG 129 Ca 0.05 0.19 -0.01 0.00 -1.00 0.00 0.00 57.85 57.08 2qsf n ARG 129 Cb 0.44 -1.50 0.21 0.00 -1.05 0.00 0.00 32.46 30.55 2qsf n ARG 129 CO 0.00 0.00 0.00 0.09 -0.01 0.00 0.00 177.63 177.71 2qsf n ASN 130 N -1.40 2.55 -4.73 2.89 3.02 -1.26 -5.00 115.26 111.34 2qsf n ASN 130 Ca 0.05 -3.67 -0.31 0.00 -0.03 0.00 0.00 54.58 50.62 2qsf n ASN 130 Cb 0.15 -0.60 -0.08 0.00 -0.61 0.00 0.00 39.78 38.64 2qsf n ASN 130 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 2qsf s VAL 131 N -3.18 4.31 0.96 2.41 0.11 -1.17 -4.29 120.40 119.56 2qsf s VAL 131 Ca 0.43 -0.73 -0.11 0.00 -2.93 0.00 0.00 61.98 58.64 2qsf s VAL 131 Cb 0.39 -3.01 0.17 0.00 -1.53 0.00 0.00 36.38 32.39 2qsf s VAL 131 CO 0.00 0.23 1.10 0.00 -3.33 0.00 0.00 175.10 173.10 2qsf n SER 133 N -4.26 -3.44 0.05 0.00 3.41 -1.26 -4.77 113.62 103.35 2qsf n SER 133 Ca 0.08 -0.58 -0.11 0.00 -0.26 0.00 0.00 58.87 58.00 2qsf n SER 133 Cb 0.53 -0.89 -0.13 0.00 -0.26 0.00 0.00 64.21 63.46 2qsf n SER 133 CO 0.00 0.00 0.00 0.78 -0.16 0.00 0.00 175.04 175.66 2qsf h ASN 134 N -3.10 0.17 -0.21 4.04 2.35 -1.99 -2.79 115.58 114.05 2qsf h ASN 134 Ca -0.33 -0.22 -0.03 0.00 -0.55 0.00 0.00 56.30 55.16 2qsf h ASN 134 Cb 1.03 -0.06 -0.01 0.00 0.05 0.00 0.00 38.32 39.34 2qsf h ASN 134 CO 0.21 1.18 -0.00 -0.33 -1.65 0.00 0.00 177.43 176.84 2qsf h GLU 135 N 0.03 0.37 -0.93 0.81 5.08 -1.99 -2.41 114.58 115.54 2qsf h GLU 135 Ca -0.16 -0.12 -0.00 0.00 -1.00 0.00 0.00 59.36 58.08 2qsf h GLU 135 Cb 1.92 -0.03 -0.05 0.00 0.50 0.00 0.00 28.75 31.09 2qsf h GLU 135 CO 0.14 0.57 0.57 1.49 -1.00 0.00 0.00 179.01 180.78 2qsf h GLU 136 N 0.14 1.26 -0.89 2.33 4.57 -1.92 0.36 114.58 120.42 2qsf h GLU 136 Ca 0.06 -0.11 0.03 0.00 -1.18 0.00 0.00 59.36 58.16 2qsf h GLU 136 Cb 0.40 -0.27 -0.05 0.00 -0.16 0.00 0.00 28.75 28.68 2qsf h GLU 136 CO 0.01 0.88 0.59 -0.09 -1.18 0.00 0.00 179.01 179.21 2qsf h ARG 137 N 1.28 1.09 -0.06 1.92 2.43 -1.30 -0.81 114.38 118.93 2qsf h ARG 137 Ca 0.33 -0.07 -0.20 0.00 -0.81 0.00 0.00 59.98 59.24 2qsf h ARG 137 Cb -0.07 -0.25 0.01 0.00 -0.42 0.00 0.00 29.97 29.25 2qsf h ARG 137 CO -0.06 0.72 -0.73 0.87 -1.51 0.00 0.00 179.97 179.26 2qsf h LYS 138 N 1.13 0.61 -0.45 0.20 1.57 -0.74 -2.93 116.57 115.95 2qsf h LYS 138 Ca 0.35 -0.57 0.02 0.00 -1.87 0.00 0.00 60.65 58.59 2qsf h LYS 138 Cb 0.01 0.14 -0.02 0.00 0.08 0.00 0.00 32.23 32.43 2qsf h LYS 138 CO -0.10 1.18 0.30 -0.09 -0.57 0.00 0.00 179.45 180.17 2qsf h ARG 139 N 0.23 0.53 -0.09 3.15 2.43 0.05 -2.03 114.38 118.66 2qsf h ARG 139 Ca -0.07 -0.03 -0.16 0.00 -0.81 0.00 0.00 59.98 58.91 2qsf h ARG 139 Cb 1.39 -0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 30.81 2qsf h ARG 139 CO 0.15 0.35 -0.64 0.00 -1.51 0.00 0.00 179.97 178.32 2qsf h ARG 140 N 0.55 0.33 0.08 0.20 3.08 -1.13 0.28 114.38 117.77 2qsf h ARG 140 Ca 0.17 -0.24 -0.00 0.00 0.07 0.00 0.00 59.98 59.98 2qsf h ARG 140 Cb 0.03 0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.12 2qsf h ARG 140 CO -0.04 0.86 -0.04 -0.22 -1.07 0.00 0.00 179.97 179.46 2qsf h LYS 141 N 0.24 -0.10 -0.04 0.04 3.64 -1.24 0.16 116.57 119.28 2qsf h LYS 141 Ca -0.01 0.01 0.01 0.00 -1.27 0.00 0.00 60.65 59.38 2qsf h LYS 141 Cb 1.17 0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 33.01 2qsf h LYS 141 CO 0.11 0.20 -0.01 -0.92 -2.27 0.00 0.00 179.45 176.55 2qsf h TYR 142 N -0.40 -0.03 -0.66 1.91 3.20 -1.35 -0.27 116.97 119.36 2qsf h TYR 142 Ca -0.01 0.00 -0.03 0.00 3.14 0.00 0.00 58.73 61.83 2qsf h TYR 142 Cb 0.34 0.02 -0.03 0.00 1.54 0.00 0.00 36.73 38.60 2qsf h TYR 142 CO 0.02 -0.02 0.29 0.35 -1.64 0.00 0.00 178.16 177.16 2qsf h PHE 143 N -0.01 0.96 -0.89 -3.82 3.57 -0.94 0.20 116.94 116.01 2qsf h PHE 143 Ca 0.02 -0.05 -0.01 0.00 3.53 0.00 0.00 57.97 61.46 2qsf h PHE 143 Cb 0.04 -0.30 -0.04 0.00 2.79 0.00 0.00 35.95 38.44 2qsf h PHE 143 CO -0.11 0.72 0.50 1.25 -2.23 0.00 0.00 178.31 178.44 2qsf h HIS 144 N 0.95 1.20 -0.12 0.41 2.76 -0.49 -0.07 115.15 119.79 2qsf h HIS 144 Ca 0.23 -0.02 -0.09 0.00 -2.20 0.00 0.00 60.37 58.28 2qsf h HIS 144 Cb 0.14 -0.39 0.00 0.00 1.55 0.00 0.00 27.41 28.72 2qsf h HIS 144 CO 0.01 0.81 -0.30 0.52 -1.30 0.00 0.00 177.93 177.68 2qsf h MET 145 N 1.23 0.41 -0.32 5.26 2.86 0.08 -1.58 114.93 122.87 2qsf h MET 145 Ca 0.31 -0.28 0.02 0.00 -2.06 0.00 0.00 59.70 57.70 2qsf h MET 145 Cb -0.00 0.04 -0.03 0.00 0.06 0.00 0.00 31.60 31.67 2qsf h MET 145 CO -0.05 0.90 0.15 1.25 1.06 0.00 0.00 176.91 180.21 2qsf h LEU 146 N -0.02 0.22 -0.62 1.22 6.46 -0.44 -1.70 115.31 120.43 2qsf h LEU 146 Ca -0.00 0.02 -0.04 0.00 -0.12 0.00 0.00 57.88 57.73 2qsf h LEU 146 Cb 0.91 -0.02 -0.03 0.00 -0.73 0.00 0.00 40.66 40.79 2qsf h LEU 146 CO 0.06 0.17 0.22 0.22 -0.62 0.00 0.00 178.44 178.49 2qsf h TYR 147 N 0.32 0.98 -0.00 1.25 3.20 -1.04 -2.94 116.97 118.73 2qsf h TYR 147 Ca 0.13 -0.09 0.01 0.00 3.14 0.00 0.00 58.73 61.92 2qsf h TYR 147 Cb 0.06 -0.29 -0.01 0.00 1.54 0.00 0.00 36.73 38.03 2qsf h TYR 147 CO -0.10 0.79 -0.03 1.25 -1.64 0.00 0.00 178.16 178.43 2qsf h LEU 148 N 0.88 -0.08 0.06 2.82 6.46 -0.89 -1.94 115.31 122.62 2qsf h LEU 148 Ca 0.20 0.01 0.02 0.00 -0.12 0.00 0.00 57.88 58.00 2qsf h LEU 148 Cb 0.26 0.03 -0.04 0.00 -0.73 0.00 0.00 40.66 40.18 2qsf h LEU 148 CO -0.01 -0.04 -0.25 0.58 -0.62 0.00 0.00 178.44 178.10 2qsf h VAL 149 N -0.05 0.43 -0.78 1.05 2.07 -1.28 -1.28 116.25 116.41 2qsf h VAL 149 Ca 0.01 0.00 0.14 0.00 0.82 0.00 0.00 66.70 67.67 2qsf h VAL 149 Cb 0.06 0.43 -0.09 0.00 -1.52 0.00 0.00 31.29 30.17 2qsf h VAL 149 CO -0.03 0.00 0.35 0.00 0.02 0.00 0.00 177.57 177.91 2qsf h LEU 151 N 0.52 0.54 -0.28 0.00 3.38 -0.82 0.31 115.31 118.95 2qsf h LEU 151 Ca 0.43 -0.15 -0.20 0.00 0.09 0.00 0.00 57.88 58.05 2qsf h LEU 151 Cb 0.62 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.21 2qsf h LEU 151 CO -0.38 0.71 -0.88 0.24 0.09 0.00 0.00 178.44 178.22 2qsf h MET 152 N 0.50 0.19 -0.30 1.13 2.86 0.01 -1.37 114.93 117.96 2qsf h MET 152 Ca 0.09 -0.21 -0.13 0.00 -2.06 0.00 0.00 59.70 57.39 2qsf h MET 152 Cb 0.55 0.06 -0.00 0.00 0.06 0.00 0.00 31.60 32.26 2qsf h MET 152 CO 0.03 0.95 -0.32 0.28 1.06 0.00 0.00 176.91 178.91 2qsf h VAL 153 N 0.11 1.30 -0.50 -2.22 2.07 -0.17 -2.06 116.25 114.78 2qsf h VAL 153 Ca -0.04 -1.50 0.05 0.00 0.82 0.00 0.00 66.70 66.02 2qsf h VAL 153 Cb 1.51 1.58 -0.04 0.00 -1.52 0.00 0.00 31.29 32.81 2qsf h VAL 153 CO 0.13 0.48 0.24 -0.74 0.02 0.00 0.00 177.57 177.71 2qsf h HIS 154 N 0.49 0.44 0.00 1.57 6.17 -0.22 -0.81 115.15 122.80 2qsf h HIS 154 Ca 0.04 0.02 -0.04 0.00 0.71 0.00 0.00 60.37 61.10 2qsf h HIS 154 Cb 0.90 -0.13 -0.01 0.00 2.52 0.00 0.00 27.41 30.70 2qsf h HIS 154 CO 0.07 0.21 -0.20 0.78 0.71 0.00 0.00 177.93 179.51 2qsf h GLY 155 N 0.47 0.00 0.61 5.26 0.00 -1.13 -0.56 103.07 107.73 2qsf h GLY 155 Ca 0.22 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.55 2qsf h GLY 155 CO -0.17 0.00 -0.02 -2.75 0.00 0.00 0.00 176.54 173.60 2qsf h PHE 156 N 0.00 -0.06 -0.71 5.60 3.57 -0.50 -1.70 116.94 123.14 2qsf h PHE 156 Ca -0.00 -0.00 -0.05 0.00 3.53 0.00 0.00 57.97 61.44 2qsf h PHE 156 Cb 0.35 0.02 -0.03 0.00 2.79 0.00 0.00 35.95 39.08 2qsf h PHE 156 CO 0.00 0.32 0.24 0.82 -2.23 0.00 0.00 178.31 177.46 2qsf h ILE 157 N -0.45 1.25 -0.01 1.41 2.04 -0.94 -1.91 117.51 118.90 2qsf h ILE 157 Ca -0.01 -0.86 -0.04 0.00 1.00 0.00 0.00 64.86 64.96 2qsf h ILE 157 Cb 0.41 0.48 -0.01 0.00 -0.74 0.00 0.00 36.82 36.96 2qsf h ILE 157 CO 0.01 0.34 -0.17 -0.09 0.00 0.00 0.00 178.15 178.24 2qsf h ARG 158 N 1.03 0.01 -0.26 2.37 9.65 -1.11 -1.10 114.38 124.97 2qsf h ARG 158 Ca 0.23 -0.00 -0.11 0.00 -1.10 0.00 0.00 59.98 59.00 2qsf h ARG 158 Cb 0.28 -0.00 -0.01 0.00 -1.39 0.00 0.00 29.97 28.84 2qsf h ARG 158 CO -0.01 0.18 -0.29 -0.97 2.80 0.00 0.00 179.97 181.68 2qsf h ASN 159 N 0.01 0.55 -0.15 -3.80 -0.00 -0.51 -1.63 115.58 110.05 2qsf h ASN 159 Ca 0.00 -0.21 -0.04 0.00 -0.00 0.00 0.00 56.30 56.05 2qsf h ASN 159 Cb 0.31 -0.15 -0.00 0.00 -0.00 0.00 0.00 38.32 38.47 2qsf h ASN 159 CO 0.02 0.82 -0.07 -0.33 -0.00 0.00 0.00 177.43 177.87 2qsf h GLU 160 N 0.47 0.31 -0.90 6.67 5.08 -0.85 -2.94 114.58 122.41 2qsf h GLU 160 Ca 0.06 -0.14 0.11 0.00 -1.00 0.00 0.00 59.36 58.40 2qsf h GLU 160 Cb 0.75 -0.01 -0.08 0.00 0.50 0.00 0.00 28.75 29.91 2qsf h GLU 160 CO 0.06 0.63 0.53 -1.49 -1.00 0.00 0.00 179.01 177.75 2qsf h TRP 161 N -0.02 0.97 -0.06 4.33 4.06 -1.12 0.07 115.95 124.17 2qsf h TRP 161 Ca 0.03 0.03 0.02 0.00 2.06 0.00 0.00 58.89 61.03 2qsf h TRP 161 Cb 0.54 -0.30 -0.00 0.00 -1.00 0.00 0.00 29.16 28.40 2qsf h TRP 161 CO 0.07 0.37 0.06 0.82 -3.56 0.00 0.00 178.44 176.20 2qsf h ILE 162 N 0.85 0.57 -0.24 1.49 2.04 -1.12 -1.14 117.51 119.96 2qsf h ILE 162 Ca 0.45 0.00 0.00 0.00 1.00 0.00 0.00 64.86 66.31 2qsf h ILE 162 Cb 0.46 0.95 0.00 0.00 -0.74 0.00 0.00 36.82 37.49 2qsf h ILE 162 CO -0.27 0.00 0.00 0.59 0.00 0.00 0.00 178.15 178.47 2qsf n ASN 163 N -3.92 1.57 -4.64 1.72 3.02 0.01 -4.59 115.26 108.43 2qsf n ASN 163 Ca -0.02 -2.06 -0.49 0.00 -0.03 0.00 0.00 54.58 51.99 2qsf n ASN 163 Cb 0.16 -0.24 -0.05 0.00 -0.61 0.00 0.00 39.78 39.04 2qsf n ASN 163 CO 0.00 0.00 0.00 -0.24 -2.62 0.00 0.00 177.26 174.40 2qsf n SER 164 N 0.23 2.45 -0.10 6.41 2.88 -0.43 -4.89 113.62 120.17 2qsf n SER 164 Ca 0.09 1.10 -0.11 0.00 -1.33 0.00 0.00 58.87 58.62 2qsf n SER 164 Cb 0.28 -1.32 -0.03 0.00 -0.75 0.00 0.00 64.21 62.39 2qsf n SER 164 CO 0.00 0.00 0.00 0.11 -1.23 0.00 0.00 175.04 173.92 2qsf h LYS 165 N 5.39 0.51 -0.95 -1.46 1.79 -1.92 -1.21 116.57 118.73 2qsf h LYS 165 Ca -0.46 -0.15 0.05 0.00 -2.18 0.00 0.00 60.65 57.91 2qsf h LYS 165 Cb 1.29 -0.06 -0.06 0.00 -1.58 0.00 0.00 32.23 31.83 2qsf h LYS 165 CO 0.84 0.63 0.62 -0.09 -1.08 0.00 0.00 179.45 180.37 2qsf h ARG 166 N 0.33 1.11 0.06 3.15 1.12 -1.99 -2.40 114.38 115.76 2qsf h ARG 166 Ca 0.09 -0.07 -0.00 0.00 -1.11 0.00 0.00 59.98 58.89 2qsf h ARG 166 Cb 0.37 -0.25 0.00 0.00 -0.01 0.00 0.00 29.97 30.08 2qsf h ARG 166 CO 0.01 0.74 -0.03 1.25 -3.11 0.00 0.00 179.97 178.82 2qsf h LEU 167 N 1.15 -0.07 -0.12 3.80 6.46 -1.85 -3.16 115.31 121.52 2qsf h LEU 167 Ca 0.39 -0.34 0.04 0.00 -0.12 0.00 0.00 57.88 57.86 2qsf h LEU 167 Cb 0.10 0.02 -0.05 0.00 -0.73 0.00 0.00 40.66 39.99 2qsf h LEU 167 CO -0.14 0.31 -0.21 0.77 -0.62 0.00 0.00 178.44 178.55 2qsf h SER 168 N -0.46 -0.65 -0.18 1.25 4.64 -0.93 -0.35 113.55 116.88 2qsf h SER 168 Ca -0.01 0.11 0.05 0.00 -0.47 0.00 0.00 61.79 61.47 2qsf h SER 168 Cb 0.40 0.29 -0.01 0.00 -0.31 0.00 0.00 62.40 62.78 2qsf h SER 168 CO 0.01 -0.26 0.23 0.08 -0.87 0.00 0.00 176.83 176.02 2qsf h ARG 169 N -0.27 0.00 0.15 4.77 0.11 -1.52 0.81 114.38 118.43 2qsf h ARG 169 Ca 0.10 0.00 -0.34 0.00 0.10 0.00 0.00 59.98 59.83 2qsf h ARG 169 Cb 0.41 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 31.49 2qsf h ARG 169 CO -0.28 0.00 -1.77 -0.22 0.10 0.00 0.00 179.97 177.80 2qsf h LYS 170 N 0.00 0.32 0.00 0.08 3.64 -1.09 -3.36 116.57 116.16 2qsf h LYS 170 Ca 0.08 -0.54 -0.02 0.00 -1.27 0.00 0.00 60.65 58.90 2qsf h LYS 170 Cb 0.55 0.20 -0.00 0.00 -0.41 0.00 0.00 32.23 32.57 2qsf h LYS 170 CO -0.00 1.21 -0.12 -0.07 -2.27 0.00 0.00 179.45 178.20 2qsf h LEU 171 N 0.09 0.00 -2.08 5.20 3.38 -0.33 -3.18 115.31 118.38 2qsf h LEU 171 Ca -0.34 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.63 2qsf h LEU 171 Cb 2.07 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.82 2qsf h LEU 171 CO 0.15 0.12 -0.01 0.28 0.09 0.00 0.00 178.44 179.07 2qsf h SER 172 N 0.00 0.00 0.54 -0.43 0.02 -1.01 -1.85 113.55 110.82 2qsf h SER 172 Ca -0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2qsf h SER 172 Cb 0.99 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.53 2qsf h SER 172 CO 0.02 0.01 0.00 0.59 -1.14 0.00 0.00 176.83 176.30 2qsf n ASN 173 N -4.39 0.00 0.06 3.07 3.02 -1.20 -3.18 115.26 112.64 2qsf n ASN 173 Ca -0.03 0.37 0.12 0.00 -0.03 0.00 0.00 54.58 55.01 2qsf n ASN 173 Cb 0.10 -0.44 0.16 0.00 -0.61 0.00 0.00 39.78 38.98 2qsf n ASN 173 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 2qsf n LEU 174 N -1.44 0.69 -4.47 3.41 4.77 -0.69 -4.83 117.00 114.43 2qsf n LEU 174 Ca 0.05 0.21 -0.41 0.00 -0.03 0.00 0.00 56.01 55.83 2qsf n LEU 174 Cb 0.19 -0.18 -0.10 0.00 -2.33 0.00 0.00 43.42 41.00 2qsf n LEU 174 CO 0.16 -0.05 -0.11 -0.69 -1.33 0.00 0.00 177.39 175.37 2qsf s VAL 175 N -3.17 5.13 0.96 4.08 1.01 -1.19 -5.03 120.40 122.20 2qsf s VAL 175 Ca 0.06 -0.49 -0.11 0.00 0.00 0.00 0.00 61.98 61.43 2qsf s VAL 175 Cb 0.13 -3.75 0.13 0.00 0.00 0.00 0.00 36.38 32.89 2qsf s VAL 175 CO 0.73 -0.15 0.85 -2.65 0.00 0.00 0.00 175.10 173.88 2qsf n PRO 176 N 5.10 -0.66 0.13 2.72 -0.02 -1.26 -4.75 135.00 136.26 2qsf n PRO 176 Ca -0.12 -0.14 -0.00 0.00 -2.02 0.00 0.00 63.50 61.22 2qsf n PRO 176 Cb 0.48 -2.17 0.27 0.00 -0.02 0.00 0.00 33.50 32.07 2qsf n PRO 176 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 2qsf h GLU 177 N -1.89 0.14 -0.37 -0.52 4.57 -1.98 -1.73 114.58 112.80 2qsf h GLU 177 Ca -0.45 -0.06 -0.06 0.00 -1.18 0.00 0.00 59.36 57.61 2qsf h GLU 177 Cb 1.28 -0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.86 2qsf h GLU 177 CO 0.40 0.52 0.01 0.87 -1.18 0.00 0.00 179.01 179.63 2qsf h LYS 178 N 0.12 0.64 -0.36 1.92 1.57 -2.01 -2.66 116.57 115.79 2qsf h LYS 178 Ca 0.01 -0.20 -0.11 0.00 -1.87 0.00 0.00 60.65 58.49 2qsf h LYS 178 Cb 0.76 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.99 2qsf h LYS 178 CO 0.06 0.74 -0.22 0.28 -0.57 0.00 0.00 179.45 179.74 2qsf h VAL 179 N 0.47 1.27 -0.69 0.50 2.07 -1.88 -2.60 116.25 115.38 2qsf h VAL 179 Ca 0.11 -1.31 0.03 0.00 0.82 0.00 0.00 66.70 66.35 2qsf h VAL 179 Cb 0.44 1.23 -0.04 0.00 -1.52 0.00 0.00 31.29 31.40 2qsf h VAL 179 CO 0.02 0.43 0.46 0.15 0.02 0.00 0.00 177.57 178.65 2qsf h PHE 180 N 0.62 0.81 -0.11 1.57 3.57 -1.14 -2.27 116.94 120.00 2qsf h PHE 180 Ca 0.09 0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.59 2qsf h PHE 180 Cb 0.71 -0.27 -0.00 0.00 2.79 0.00 0.00 35.95 39.17 2qsf h PHE 180 CO 0.03 0.48 0.00 0.93 -2.23 0.00 0.00 178.31 177.53 2qsf h GLU 181 N 0.85 0.19 -0.83 1.11 5.08 -1.12 -2.81 114.58 117.05 2qsf h GLU 181 Ca 0.27 -0.06 0.14 0.00 -1.00 0.00 0.00 59.36 58.71 2qsf h GLU 181 Cb 0.04 -0.02 -0.06 0.00 0.50 0.00 0.00 28.75 29.21 2qsf h GLU 181 CO -0.07 0.43 0.54 -0.07 -1.00 0.00 0.00 179.01 178.84 2qsf h LEU 182 N -0.07 0.55 0.00 1.33 3.38 -1.17 0.21 115.31 119.54 2qsf h LEU 182 Ca 0.03 0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.03 2qsf h LEU 182 Cb 0.34 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.01 2qsf h LEU 182 CO 0.00 0.29 0.00 0.18 0.09 0.00 0.00 178.44 179.00 2qsf n LEU 183 N -4.52 0.00 -3.20 1.67 4.77 -0.89 -3.10 117.00 111.73 2qsf n LEU 183 Ca 0.16 0.49 -0.23 0.00 -0.03 0.00 0.00 56.01 56.40 2qsf n LEU 183 Cb 0.48 -0.49 -0.06 0.00 -2.33 0.00 0.00 43.42 41.02 2qsf n LEU 183 CO 0.31 -0.20 -0.24 1.41 -1.33 0.00 0.00 177.39 177.33 2qsf n HIS 184 N -1.49 0.20 -0.79 -1.77 8.25 0.74 -4.95 115.22 115.41 2qsf n HIS 184 Ca 0.04 -3.69 -0.30 0.00 -0.26 0.00 0.00 57.72 53.51 2qsf n HIS 184 Cb 0.20 -0.39 0.17 0.00 1.12 0.00 0.00 29.99 31.09 2qsf n HIS 184 CO 0.00 0.00 0.00 -2.14 0.64 0.00 0.00 176.34 174.84 2qsf s PRO 185 N -1.70 0.79 0.11 -0.41 0.02 -1.16 -4.89 135.00 127.77 2qsf s PRO 185 Ca 0.37 1.28 -0.07 0.00 0.02 0.00 0.00 61.00 62.60 2qsf s PRO 185 Cb 0.22 -1.72 -0.06 0.00 0.02 0.00 0.00 34.50 32.97 2qsf s PRO 185 CO -0.10 -2.70 0.39 -0.65 -0.33 0.00 0.00 177.00 173.62 2qsf s GLN 186 N -4.67 3.69 -0.24 5.54 1.11 -1.26 -5.00 119.66 118.83 2qsf s GLN 186 Ca 0.66 0.06 -0.29 0.00 0.01 0.00 0.00 55.36 55.80 2qsf s GLN 186 Cb -0.22 -2.91 -0.06 0.00 -1.01 0.00 0.00 33.01 28.81 2qsf s GLN 186 CO 0.59 0.50 2.22 1.17 0.01 0.00 0.00 175.29 179.79 2qsf n LYS 187 N 0.48 1.82 -2.73 2.91 3.00 -1.26 -4.87 118.16 117.50 2qsf n LYS 187 Ca -0.05 0.49 -0.42 0.00 -0.00 0.00 0.00 58.31 58.33 2qsf n LYS 187 Cb 0.52 -3.13 -0.04 0.00 0.00 0.00 0.00 35.03 32.39 2qsf n LYS 187 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.40 177.74 2qsf s ASP 188 N 8.24 6.21 0.19 3.14 2.15 -1.26 -4.91 116.67 130.43 2qsf s ASP 188 Ca 1.02 -0.64 -0.15 0.00 0.43 0.00 0.00 52.55 53.22 2qsf s ASP 188 Cb -0.41 -2.48 0.17 0.00 -0.30 0.00 0.00 42.92 39.90 2qsf s ASP 188 CO 0.37 -1.55 1.66 -0.33 -0.17 0.00 0.00 175.17 175.15 2qsf h GLU 189 N 9.69 0.03 0.43 4.34 4.39 -2.00 -3.02 114.58 128.44 2qsf h GLU 189 Ca -0.28 -0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.41 2qsf h GLU 189 Cb 1.06 -0.01 -0.03 0.00 -0.10 0.00 0.00 28.75 29.68 2qsf h GLU 189 CO 1.20 0.02 -0.51 1.49 -1.16 0.00 0.00 179.01 180.05 2qsf h GLU 190 N 0.03 -0.93 -2.32 2.33 4.57 -2.02 -3.42 114.58 112.83 2qsf h GLU 190 Ca 0.25 0.06 -0.36 0.00 -1.18 0.00 0.00 59.36 58.13 2qsf h GLU 190 Cb 0.38 0.21 -0.35 0.00 -0.16 0.00 0.00 28.75 28.84 2qsf h GLU 190 CO -0.49 -0.62 -0.66 -1.17 -1.18 0.00 0.00 179.01 174.89 2qsf s LEU 191 N -10.14 -0.09 0.52 1.64 2.96 -1.15 -5.00 118.68 107.42 2qsf s LEU 191 Ca -0.18 -0.75 0.37 0.00 -0.22 0.00 0.00 54.13 53.35 2qsf s LEU 191 Cb 0.05 0.34 1.53 0.00 0.50 0.00 0.00 46.19 48.61 2qsf s LEU 191 CO 0.61 -0.39 1.73 -0.65 -1.32 0.00 0.00 176.35 176.33 2qsf h PRO 192 N 8.30 0.05 -0.37 0.98 0.11 -1.80 0.22 132.00 139.48 2qsf h PRO 192 Ca -0.15 -0.00 0.11 0.00 0.11 0.00 0.00 66.00 66.06 2qsf h PRO 192 Cb 1.08 -0.01 -0.01 0.00 0.11 0.00 0.00 31.00 32.16 2qsf h PRO 192 CO 0.34 0.04 0.29 1.25 -0.21 0.00 0.00 178.00 179.71 2qsf h LEU 193 N 0.06 0.00 -0.01 2.35 5.85 -1.93 -1.24 115.31 120.39 2qsf h LEU 193 Ca 0.68 0.00 0.00 0.00 0.84 0.00 0.00 57.88 59.40 2qsf h LEU 193 Cb 2.56 0.00 0.00 0.00 0.37 0.00 0.00 40.66 43.59 2qsf h LEU 193 CO -0.09 0.00 -0.09 0.54 -0.34 0.00 0.00 178.44 178.46 2qsf n ARG 194 N -4.26 0.05 -0.09 1.25 1.74 0.77 -2.61 116.66 113.50 2qsf n ARG 194 Ca 0.06 -0.01 -0.17 0.00 -0.77 0.00 0.00 57.85 56.96 2qsf n ARG 194 Cb 0.47 -1.50 -0.13 0.00 -1.02 0.00 0.00 32.46 30.28 2qsf n ARG 194 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 2qsf n SER 195 N -1.47 1.73 -0.09 0.55 3.41 -0.51 -3.59 113.62 113.65 2qsf n SER 195 Ca 0.07 -0.01 0.04 0.00 -0.26 0.00 0.00 58.87 58.71 2qsf n SER 195 Cb 0.33 -0.34 0.36 0.00 -0.26 0.00 0.00 64.21 64.31 2qsf n SER 195 CO 0.00 0.00 0.00 0.74 -0.16 0.00 0.00 175.04 175.62 2qsf h THR 196 N 0.02 1.11 -0.43 6.66 2.02 -1.51 -0.66 112.91 120.12 2qsf h THR 196 Ca -0.52 -0.25 -0.03 0.00 0.77 0.00 0.00 66.41 66.38 2qsf h THR 196 Cb 1.98 0.33 -0.02 0.00 -1.74 0.00 0.00 68.15 68.70 2qsf h THR 196 CO -0.02 0.13 0.13 -0.09 0.37 0.00 0.00 175.52 176.04 2qsf h ARG 197 N 0.72 0.62 -0.04 6.66 1.12 -1.62 -0.79 114.38 121.04 2qsf h ARG 197 Ca 0.22 -0.10 -0.18 0.00 -1.11 0.00 0.00 59.98 58.81 2qsf h ARG 197 Cb -0.01 -0.11 -0.01 0.00 -0.01 0.00 0.00 29.97 29.84 2qsf h ARG 197 CO -0.05 0.55 -0.75 0.87 -3.11 0.00 0.00 179.97 177.47 2qsf h LYS 198 N 0.61 0.28 0.04 0.20 1.57 -1.21 -0.67 116.57 117.39 2qsf h LYS 198 Ca 0.14 -0.24 -0.00 0.00 -1.87 0.00 0.00 60.65 58.68 2qsf h LYS 198 Cb 0.19 0.06 0.00 0.00 0.08 0.00 0.00 32.23 32.56 2qsf h LYS 198 CO -0.01 0.91 -0.02 1.25 -0.57 0.00 0.00 179.45 181.01 2qsf h LEU 199 N 0.18 -0.05 -1.53 2.94 6.46 -0.63 0.24 115.31 122.93 2qsf h LEU 199 Ca -0.03 -0.10 -0.03 0.00 -0.12 0.00 0.00 57.88 57.59 2qsf h LEU 199 Cb 1.33 0.01 -0.01 0.00 -0.73 0.00 0.00 40.66 41.26 2qsf h LEU 199 CO 0.12 0.08 -0.04 -0.07 -0.62 0.00 0.00 178.44 177.91 2qsf h LEU 200 N -0.17 0.23 -0.60 2.25 3.38 -1.12 0.31 115.31 119.59 2qsf h LEU 200 Ca -0.01 -0.03 -0.15 0.00 0.09 0.00 0.00 57.88 57.78 2qsf h LEU 200 Cb 0.15 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 40.83 2qsf h LEU 200 CO 0.01 0.32 -0.54 -0.78 0.09 0.00 0.00 178.44 177.53 2qsf h ASP 201 N 0.25 0.50 -0.09 -0.43 1.82 -0.53 -0.89 116.42 117.05 2qsf h ASP 201 Ca 0.06 -0.26 -0.03 0.00 -0.39 0.00 0.00 57.03 56.40 2qsf h ASP 201 Cb 0.24 -0.14 -0.00 0.00 0.68 0.00 0.00 39.33 40.10 2qsf h ASP 201 CO 0.01 0.94 -0.07 1.23 -1.61 0.00 0.00 179.24 179.74 2qsf h GLY 202 N 1.18 0.23 0.87 -0.78 0.00 0.83 -1.85 103.07 103.55 2qsf h GLY 202 Ca 0.01 -0.23 0.03 0.00 0.00 0.00 0.00 47.33 47.14 2qsf h GLY 202 CO 0.10 0.20 0.33 1.41 0.00 0.00 0.00 176.54 178.58 2qsf h LEU 203 N -0.18 0.54 -1.04 3.11 3.38 -0.94 0.80 115.31 120.97 2qsf h LEU 203 Ca 0.02 0.00 0.05 0.00 0.09 0.00 0.00 57.88 58.04 2qsf h LEU 203 Cb 0.56 -0.11 -0.06 0.00 0.09 0.00 0.00 40.66 41.14 2qsf h LEU 203 CO 0.02 0.38 0.64 0.50 0.09 0.00 0.00 178.44 180.07 2qsf h LYS 204 N 0.66 1.18 -0.13 1.13 3.64 -1.12 0.13 116.57 122.06 2qsf h LYS 204 Ca 0.22 -0.07 -0.00 0.00 -1.27 0.00 0.00 60.65 59.53 2qsf h LYS 204 Cb 0.02 -0.27 -0.01 0.00 -0.41 0.00 0.00 32.23 31.57 2qsf h LYS 204 CO -0.10 0.78 0.07 0.87 -2.27 0.00 0.00 179.45 178.81 2qsf h LYS 205 N 1.22 0.18 -0.87 1.90 1.79 -0.22 -2.28 116.57 118.28 2qsf h LYS 205 Ca 0.40 -0.02 -0.00 0.00 -2.18 0.00 0.00 60.65 58.85 2qsf h LYS 205 Cb 0.05 -0.04 -0.04 0.00 -1.58 0.00 0.00 32.23 30.63 2qsf h LYS 205 CO -0.13 0.20 0.53 0.00 -1.08 0.00 0.00 179.45 178.96 2qsf h MET 207 N 1.20 0.87 -0.01 0.00 1.85 -0.47 -1.71 114.93 116.66 2qsf h MET 207 Ca 0.31 -0.06 -0.06 0.00 -0.61 0.00 0.00 59.70 59.29 2qsf h MET 207 Cb -0.06 -0.19 0.00 0.00 0.43 0.00 0.00 31.60 31.78 2qsf h MET 207 CO -0.06 0.59 -0.22 0.93 -0.40 0.00 0.00 176.91 177.75 2qsf h GLU 208 N 0.89 0.16 0.00 0.39 5.08 -0.82 -3.09 114.58 117.19 2qsf h GLU 208 Ca 0.24 -0.16 -0.04 0.00 -1.00 0.00 0.00 59.36 58.40 2qsf h GLU 208 Cb -0.08 0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.21 2qsf h GLU 208 CO -0.05 0.88 -0.18 1.37 -1.00 0.00 0.00 179.01 180.04 2qsf h LEU 209 N -0.49 0.00 -0.54 1.33 8.10 -1.31 -2.57 115.31 119.83 2qsf h LEU 209 Ca -0.02 0.00 -0.16 0.00 0.11 0.00 0.00 57.88 57.80 2qsf h LEU 209 Cb 0.95 0.00 -0.01 0.00 -0.44 0.00 0.00 40.66 41.16 2qsf h LEU 209 CO 0.04 0.18 -0.66 -0.25 -4.11 0.00 0.00 178.44 173.64 2qsf h TRP 210 N 0.00 0.40 0.00 0.17 2.91 -1.35 -1.88 115.95 116.19 2qsf h TRP 210 Ca -0.00 -0.16 -0.02 0.00 1.13 0.00 0.00 58.89 59.84 2qsf h TRP 210 Cb 0.48 -0.07 -0.00 0.00 -0.51 0.00 0.00 29.16 29.06 2qsf h TRP 210 CO 0.00 0.87 -0.08 1.96 -1.03 0.00 0.00 178.44 180.16 2qsf h GLN 211 N 0.22 0.00 0.11 2.65 1.08 -1.37 -0.47 115.11 117.33 2qsf h GLN 211 Ca -0.02 0.00 -0.30 0.00 -1.45 0.00 0.00 58.65 56.88 2qsf h GLN 211 Cb 1.20 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 28.62 2qsf h GLN 211 CO 0.11 0.08 -1.49 0.87 -0.95 0.00 0.00 178.83 177.45 2qsf h LYS 212 N 0.00 0.24 -0.20 1.46 1.57 -1.42 -3.33 116.57 114.89 2qsf h LYS 212 Ca -0.00 -0.41 -0.16 0.00 -1.87 0.00 0.00 60.65 58.21 2qsf h LYS 212 Cb 0.44 0.15 -0.01 0.00 0.08 0.00 0.00 32.23 32.89 2qsf h LYS 212 CO 0.01 1.11 -0.53 1.25 -0.57 0.00 0.00 179.45 180.72 2qsf h HIS 213 N 0.07 0.73 -1.52 -1.35 2.76 -0.78 -3.38 115.15 111.67 2qsf h HIS 213 Ca -0.23 -0.25 -0.63 0.00 -2.20 0.00 0.00 60.37 57.05 2qsf h HIS 213 Cb 2.01 -0.14 -0.12 0.00 1.55 0.00 0.00 27.41 30.70 2qsf h HIS 213 CO 0.06 0.99 1.32 -0.46 -1.30 0.00 0.00 177.93 178.54 2qsf s TRP 214 N -4.04 2.74 -0.00 5.26 -0.11 -0.24 -4.48 118.94 118.07 2qsf s TRP 214 Ca -0.08 -1.07 -0.18 0.00 1.22 0.00 0.00 56.10 55.99 2qsf s TRP 214 Cb 0.11 -4.56 -0.10 0.00 -1.50 0.00 0.00 33.47 27.42 2qsf s TRP 214 CO 0.84 -1.78 0.87 0.87 -4.62 0.00 0.00 176.95 173.13 2qsf h LYS 215 N 9.35 -0.62 -5.14 5.86 1.79 -1.65 -3.44 116.57 122.72 2qsf h LYS 215 Ca 0.20 0.04 -0.61 0.00 -2.18 0.00 0.00 60.65 58.10 2qsf h LYS 215 Cb 1.01 0.14 -0.14 0.00 -1.58 0.00 0.00 32.23 31.66 2qsf h LYS 215 CO 1.33 -0.41 -0.50 0.42 -1.08 0.00 0.00 179.45 179.21 2qsf s ILE 216 N -3.77 5.37 -0.32 1.86 -1.09 -1.07 -5.06 121.20 117.12 2qsf s ILE 216 Ca -0.09 0.19 0.01 0.00 -2.23 0.00 0.00 60.65 58.53 2qsf s ILE 216 Cb 0.01 -3.49 0.08 0.00 -1.58 0.00 0.00 42.46 37.47 2qsf s ILE 216 CO 0.28 0.37 0.02 -0.89 -1.23 0.00 0.00 174.94 173.49 2qsf s THR 217 N 0.87 2.56 0.43 2.92 2.01 -1.26 -2.64 115.64 120.53 2qsf s THR 217 Ca 0.08 -1.91 -0.10 0.00 0.31 0.00 0.00 61.69 60.07 2qsf s THR 217 Cb -0.13 -2.67 -0.06 0.00 0.01 0.00 0.00 72.50 69.65 2qsf s THR 217 CO 0.03 -0.36 0.80 -0.54 -0.69 0.00 0.00 174.62 173.86 2qsf s LYS 218 N 1.07 3.75 0.66 4.92 1.02 -1.06 -4.97 119.74 125.13 2qsf s LYS 218 Ca 0.02 0.48 -0.05 0.00 0.02 0.00 0.00 55.97 56.44 2qsf s LYS 218 Cb -0.20 -2.36 0.05 0.00 -0.52 0.00 0.00 37.83 34.80 2qsf s LYS 218 CO -0.05 -0.10 0.96 0.15 -0.92 0.00 0.00 175.35 175.39 2qsf s LYS 219 N -4.04 2.35 0.17 1.68 1.02 -1.26 -4.10 119.74 115.56 2qsf s LYS 219 Ca 0.51 -0.31 -0.30 0.00 0.02 0.00 0.00 55.97 55.89 2qsf s LYS 219 Cb -0.10 -2.24 -0.07 0.00 -0.52 0.00 0.00 37.83 34.90 2qsf s LYS 219 CO 0.34 -1.08 1.08 0.71 -0.92 0.00 0.00 175.35 175.48 2qsf s TYR 220 N -3.13 3.62 0.24 3.18 1.51 -1.26 -4.83 117.35 116.68 2qsf s TYR 220 Ca 0.59 1.63 -0.08 0.00 -1.01 0.00 0.00 57.07 58.20 2qsf s TYR 220 Cb -0.11 -3.25 0.40 0.00 -0.11 0.00 0.00 41.96 38.90 2qsf s TYR 220 CO 0.44 -0.51 1.65 -0.44 -1.11 0.00 0.00 175.55 175.58 2qsf h ASP 221 N 5.12 -0.30 0.00 2.29 3.45 -1.99 -3.43 116.42 121.56 2qsf h ASP 221 Ca -0.44 0.18 0.00 0.00 0.43 0.00 0.00 57.03 57.20 2qsf h ASP 221 Cb 1.21 0.31 0.00 0.00 -0.56 0.00 0.00 39.33 40.30 2qsf h ASP 221 CO 0.72 -0.15 0.00 0.59 -1.57 0.00 0.00 179.24 178.83 2qsf n ASN 222 N -5.31 0.00 -0.45 6.45 3.02 -1.26 -5.01 115.26 112.69 2qsf n ASN 222 Ca 0.12 0.00 0.05 0.00 -0.03 0.00 0.00 54.58 54.72 2qsf n ASN 222 Cb 0.44 0.00 0.12 0.00 -0.61 0.00 0.00 39.78 39.73 2qsf n ASN 222 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 2qsf n GLU 223 N 0.00 2.83 0.00 3.52 4.71 -1.26 -5.08 120.64 125.36 2qsf n GLU 223 Ca 0.00 -2.01 0.00 0.00 -0.01 0.00 0.00 57.16 55.14 2qsf n GLU 223 Cb 0.00 -1.27 0.00 0.00 -1.01 0.00 0.00 31.44 29.16 2qsf n GLU 223 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 2qsf n GLY 224 N 0.00 2.97 1.71 0.62 0.00 -1.26 -1.89 105.19 107.35 2qsf n GLY 224 Ca 0.10 -0.27 -0.06 0.00 0.00 0.00 0.00 46.02 45.79 2qsf n GLY 224 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2qsf n LEU 225 N 0.00 5.50 -4.81 0.99 4.77 -1.26 -4.98 117.00 117.21 2qsf n LEU 225 Ca 0.00 -3.37 -0.30 0.00 -0.03 0.00 0.00 56.01 52.31 2qsf n LEU 225 Cb 0.00 -0.71 0.08 0.00 -2.33 0.00 0.00 43.42 40.46 2qsf n LEU 225 CO 0.00 0.92 0.71 -0.31 -1.33 0.00 0.00 177.39 177.38 2qsf s TYR 226 N -3.08 2.91 0.28 -1.77 1.51 -0.79 -4.39 117.35 112.03 2qsf s TYR 226 Ca 0.52 1.18 -0.29 0.00 -1.01 0.00 0.00 57.07 57.46 2qsf s TYR 226 Cb 0.43 -3.08 -0.10 0.00 -0.11 0.00 0.00 41.96 39.09 2qsf s TYR 226 CO 0.10 -1.65 1.40 1.41 -1.11 0.00 0.00 175.55 175.69 2qsf s MET 227 N -5.15 4.29 0.30 -0.62 -2.45 0.76 -4.95 119.30 111.47 2qsf s MET 227 Ca 0.60 2.29 0.07 0.00 -1.25 0.00 0.00 55.69 57.40 2qsf s MET 227 Cb -0.14 -3.09 -0.03 0.00 1.25 0.00 0.00 34.83 32.82 2qsf s MET 227 CO 0.54 -0.35 0.31 1.03 1.05 0.00 0.00 175.02 177.60 2qsf s ARG 228 N -0.95 2.95 0.43 4.11 0.52 -1.26 -4.67 118.95 120.08 2qsf s ARG 228 Ca 0.55 -1.10 0.02 0.00 -0.52 0.00 0.00 55.73 54.68 2qsf s ARG 228 Cb -0.41 -2.62 -0.00 0.00 0.52 0.00 0.00 34.95 32.43 2qsf s ARG 228 CO 0.48 0.22 0.63 0.95 0.02 0.00 0.00 175.30 177.60 2qsf s THR 229 N -2.19 3.86 0.35 0.02 -4.23 -1.26 -4.55 115.64 107.64 2qsf s THR 229 Ca 0.38 -0.64 0.18 0.00 -1.18 0.00 0.00 61.69 60.44 2qsf s THR 229 Cb -0.07 -3.40 0.17 0.00 1.34 0.00 0.00 72.50 70.53 2qsf s THR 229 CO 0.27 -0.25 1.90 -0.50 -0.54 0.00 0.00 174.62 175.50 2qsf h TRP 230 N 0.48 0.00 -0.19 3.99 4.06 -1.96 -1.43 115.95 120.91 2qsf h TRP 230 Ca -0.45 0.00 -0.09 0.00 2.06 0.00 0.00 58.89 60.40 2qsf h TRP 230 Cb 1.26 0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 29.42 2qsf h TRP 230 CO 0.44 0.28 -0.25 -0.22 -3.56 0.00 0.00 178.44 175.12 2qsf h LYS 231 N 0.00 0.50 -0.52 0.49 1.63 -1.95 -1.78 116.57 114.94 2qsf h LYS 231 Ca -0.00 -0.29 -0.01 0.00 -0.85 0.00 0.00 60.65 59.50 2qsf h LYS 231 Cb 0.57 0.02 -0.02 0.00 -0.60 0.00 0.00 32.23 32.20 2qsf h LYS 231 CO 0.04 0.88 0.29 0.93 -3.45 0.00 0.00 179.45 178.13 2qsf h GLU 232 N 0.15 0.72 -0.35 1.90 5.08 -1.76 -0.68 114.58 119.64 2qsf h GLU 232 Ca 0.02 -0.08 -0.07 0.00 -1.00 0.00 0.00 59.36 58.23 2qsf h GLU 232 Cb 0.82 -0.14 -0.02 0.00 0.50 0.00 0.00 28.75 29.91 2qsf h GLU 232 CO 0.06 0.55 -0.06 0.82 -1.00 0.00 0.00 179.01 179.37 2qsf h ILE 233 N 0.69 1.23 -0.12 3.13 2.04 -1.25 -0.92 117.51 122.30 2qsf h ILE 233 Ca 0.18 -0.97 -0.19 0.00 1.00 0.00 0.00 64.86 64.89 2qsf h ILE 233 Cb 0.04 1.03 -0.00 0.00 -0.74 0.00 0.00 36.82 37.15 2qsf h ILE 233 CO -0.03 0.33 -0.71 -0.08 0.00 0.00 0.00 178.15 177.65 2qsf h GLU 234 N 0.55 0.53 0.00 2.37 4.81 -1.00 -3.18 114.58 118.66 2qsf h GLU 234 Ca 0.11 -0.42 0.00 0.00 -0.13 0.00 0.00 59.36 58.92 2qsf h GLU 234 Cb 0.45 0.08 0.00 0.00 0.63 0.00 0.00 28.75 29.91 2qsf h GLU 234 CO 0.02 1.04 -0.09 -1.33 -0.73 0.00 0.00 179.01 177.93 2qsf n MET 235 N -3.88 0.09 0.08 1.92 2.81 -0.29 -3.87 117.12 113.96 2qsf n MET 235 Ca -0.05 0.06 0.04 0.00 -1.81 0.00 0.00 57.70 55.95 2qsf n MET 235 Cb 0.70 -1.59 0.24 0.00 -0.71 0.00 0.00 33.22 31.86 2qsf n MET 235 CO 0.00 0.00 0.00 -1.13 1.51 0.00 0.00 175.97 176.35 2qsf n SER 236 N -1.73 0.23 0.01 7.83 3.41 -0.37 -0.64 113.62 122.34 2qsf n SER 236 Ca 0.06 0.56 -0.19 0.00 -0.26 0.00 0.00 58.87 59.04 2qsf n SER 236 Cb 0.37 -0.57 -0.14 0.00 -0.26 0.00 0.00 64.21 63.61 2qsf n SER 236 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2qsf h ALA 237 N 1.74 0.47 0.00 7.33 0.00 -1.81 -3.35 119.26 123.65 2qsf h ALA 237 Ca 0.00 -1.38 -0.19 0.00 0.00 0.00 0.00 54.91 53.34 2qsf h ALA 237 Cb 0.16 0.64 -0.03 0.00 0.00 0.00 0.00 17.79 18.56 2qsf h ALA 237 CO 0.00 1.34 -0.90 -0.91 0.00 0.00 0.00 179.25 178.78 2qsf h ASN 238 N 0.06 0.00 -2.21 0.00 4.21 -1.30 -3.31 115.58 113.04 2qsf h ASN 238 Ca -0.39 0.00 -0.73 0.00 1.21 0.00 0.00 56.30 56.39 2qsf h ASN 238 Cb 2.04 0.00 -0.32 0.00 -1.12 0.00 0.00 38.32 38.92 2qsf h ASN 238 CO 0.10 0.88 0.49 0.59 -1.29 0.00 0.00 177.43 178.20 2qsf n ASN 239 N -3.31 6.46 -4.56 5.81 4.13 0.18 -5.05 115.26 118.92 2qsf n ASN 239 Ca 0.00 -3.70 -0.47 0.00 1.68 0.00 0.00 54.58 52.09 2qsf n ASN 239 Cb 0.89 -0.96 -0.03 0.00 -1.54 0.00 0.00 39.78 38.15 2qsf n ASN 239 CO 0.00 0.00 0.00 0.29 0.28 0.00 0.00 177.26 177.83 2qsf n LYS 240 N -0.17 1.11 -4.41 3.52 5.02 -1.25 -4.80 118.16 117.17 2qsf n LYS 240 Ca 0.43 0.39 -0.24 0.00 -2.02 0.00 0.00 58.31 56.87 2qsf n LYS 240 Cb 0.31 -1.77 -0.09 0.00 -0.02 0.00 0.00 35.03 33.46 2qsf n LYS 240 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 2qsf s ARG 241 N -1.00 1.88 -0.03 1.97 0.52 -1.26 -5.11 118.95 115.93 2qsf s ARG 241 Ca 0.65 -1.67 0.03 0.00 -0.52 0.00 0.00 55.73 54.23 2qsf s ARG 241 Cb -0.79 -1.89 -0.03 0.00 0.52 0.00 0.00 34.95 32.75 2qsf s ARG 241 CO 0.56 0.33 -0.10 0.21 0.02 0.00 0.00 175.30 176.32 2qsf s LYS 242 N -3.57 2.53 -0.02 3.54 2.20 -1.26 -5.12 119.74 118.04 2qsf s LYS 242 Ca 0.31 -0.70 0.07 0.00 -0.36 0.00 0.00 55.97 55.29 2qsf s LYS 242 Cb -0.05 -2.45 -0.02 0.00 -1.51 0.00 0.00 37.83 33.80 2qsf s LYS 242 CO 0.17 0.62 -0.22 -0.06 -0.36 0.00 0.00 175.35 175.49 2qsf s PHE 243 N -0.87 2.03 -0.61 4.03 0.08 -1.26 -5.09 117.98 116.29 2qsf s PHE 243 Ca 0.14 -0.41 -0.26 0.00 0.12 0.00 0.00 56.93 56.52 2qsf s PHE 243 Cb -0.11 -1.31 0.04 0.00 -0.57 0.00 0.00 43.02 41.07 2qsf s PHE 243 CO 0.04 -0.05 1.09 0.21 -0.10 0.00 0.00 175.22 176.40 2qsf s LYS 244 N -0.47 3.33 0.10 0.44 2.47 -1.26 -4.98 119.74 119.37 2qsf s LYS 244 Ca 0.07 -0.18 -0.36 0.00 -1.56 0.00 0.00 55.97 53.95 2qsf s LYS 244 Cb -0.09 -4.09 -0.17 0.00 -1.46 0.00 0.00 37.83 32.02 2qsf s LYS 244 CO -0.00 -1.72 1.17 2.41 0.16 0.00 0.00 175.35 177.37 2qsf n THR 245 N 6.34 0.41 -3.87 3.43 -1.04 -1.26 -4.95 114.28 113.33 2qsf n THR 245 Ca 0.03 -0.10 -0.27 0.00 -2.04 0.00 0.00 64.05 61.67 2qsf n THR 245 Cb 0.48 -0.60 -0.17 0.00 -1.82 0.00 0.00 70.33 68.22 2qsf n THR 245 CO 0.00 0.00 0.00 -0.22 -0.64 0.00 0.00 175.07 174.21 2qsf s LEU 246 N 0.58 1.25 0.42 -4.42 0.20 -1.26 -5.10 118.68 110.34 2qsf s LEU 246 Ca 0.81 -0.42 0.08 0.00 0.69 0.00 0.00 54.13 55.28 2qsf s LEU 246 Cb -0.99 -0.80 -0.03 0.00 -0.43 0.00 0.00 46.19 43.94 2qsf s LEU 246 CO 0.51 -0.16 0.35 -0.54 -0.29 0.00 0.00 176.35 176.22 2qsf s LYS 247 N 1.72 2.49 0.26 1.98 1.02 -1.26 -4.99 119.74 120.96 2qsf s LYS 247 Ca 0.03 -1.58 -0.02 0.00 0.02 0.00 0.00 55.97 54.42 2qsf s LYS 247 Cb -0.14 -2.32 0.56 0.00 -0.52 0.00 0.00 37.83 35.41 2qsf s LYS 247 CO -0.08 -0.18 1.67 -0.09 -0.92 0.00 0.00 175.35 175.75 2qsf h ARG 248 N 1.08 0.24 0.00 1.68 2.43 -2.00 0.78 114.38 118.60 2qsf h ARG 248 Ca -0.42 -0.01 -0.04 0.00 -0.81 0.00 0.00 59.98 58.70 2qsf h ARG 248 Cb 1.26 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 30.75 2qsf h ARG 248 CO 0.59 0.16 -0.20 0.66 -1.51 0.00 0.00 179.97 179.67 2qsf h SER 249 N 0.25 0.00 0.75 -3.80 4.64 -1.99 -1.95 113.55 111.44 2qsf h SER 249 Ca 0.47 0.00 -0.18 0.00 -0.47 0.00 0.00 61.79 61.60 2qsf h SER 249 Cb 0.86 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.93 2qsf h SER 249 CO -0.57 0.20 -0.86 0.44 -0.87 0.00 0.00 176.83 175.17 2qsf h ASP 250 N 0.00 0.09 -0.25 4.97 3.32 -1.25 -2.28 116.42 121.02 2qsf h ASP 250 Ca -0.00 -0.08 -0.08 0.00 0.02 0.00 0.00 57.03 56.89 2qsf h ASP 250 Cb 0.39 -0.03 -0.01 0.00 0.22 0.00 0.00 39.33 39.90 2qsf h ASP 250 CO 0.03 0.90 -0.15 0.15 -1.72 0.00 0.00 179.24 178.45 2qsf h PHE 251 N 0.04 0.64 -0.69 4.55 3.57 -0.92 -0.81 116.94 123.31 2qsf h PHE 251 Ca -0.02 -0.17 -0.02 0.00 3.53 0.00 0.00 57.97 61.29 2qsf h PHE 251 Cb 1.50 -0.14 -0.03 0.00 2.79 0.00 0.00 35.95 40.06 2qsf h PHE 251 CO 0.01 0.83 0.35 -0.07 -2.23 0.00 0.00 178.31 177.19 2qsf h LEU 252 N 0.27 0.89 -0.06 0.59 3.38 -1.35 -1.25 115.31 117.78 2qsf h LEU 252 Ca 0.05 -0.12 -0.00 0.00 0.09 0.00 0.00 57.88 57.90 2qsf h LEU 252 Cb 0.67 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 41.19 2qsf h LEU 252 CO 0.04 0.76 0.03 0.03 0.09 0.00 0.00 178.44 179.39 2qsf h ARG 253 N 0.96 0.09 -0.79 1.13 3.08 -1.31 -1.89 114.38 115.64 2qsf h ARG 253 Ca 0.24 -0.01 0.06 0.00 0.07 0.00 0.00 59.98 60.34 2qsf h ARG 253 Cb 0.09 -0.02 -0.06 0.00 0.08 0.00 0.00 29.97 30.07 2qsf h ARG 253 CO -0.03 0.19 0.48 0.00 -1.07 0.00 0.00 179.97 179.54 2qsf h ALA 254 N 0.89 1.08 -0.35 0.04 0.00 -0.92 -1.19 119.26 118.82 2qsf h ALA 254 Ca 0.02 -0.00 -0.16 0.00 0.00 0.00 0.00 54.91 54.77 2qsf h ALA 254 Cb 0.14 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 17.72 2qsf h ALA 254 CO -0.00 0.20 -0.40 0.28 0.00 0.00 0.00 179.25 179.33 2qsf h VAL 255 N 0.88 1.28 0.00 0.00 2.07 -1.13 0.10 116.25 119.45 2qsf h VAL 255 Ca 0.35 -1.57 -0.11 0.00 0.82 0.00 0.00 66.70 66.18 2qsf h VAL 255 Cb 0.17 1.47 -0.02 0.00 -1.52 0.00 0.00 31.29 31.39 2qsf h VAL 255 CO -0.17 0.52 -0.53 0.77 0.02 0.00 0.00 177.57 178.18 2qsf h SER 256 N 0.69 0.00 1.11 0.57 4.64 -1.06 -2.93 113.55 116.57 2qsf h SER 256 Ca 0.05 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.37 2qsf h SER 256 Cb 0.99 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.08 2qsf h SER 256 CO 0.10 0.53 -0.84 0.11 -0.87 0.00 0.00 176.83 175.85 2qsf h LYS 257 N 0.00 0.00 -1.27 4.77 1.57 -1.20 -3.49 116.57 116.96 2qsf h LYS 257 Ca -0.01 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.76 2qsf h LYS 257 Cb 0.94 0.00 0.01 0.00 0.08 0.00 0.00 32.23 33.26 2qsf h LYS 257 CO 0.07 0.00 -0.03 0.41 -0.57 0.00 0.00 179.45 179.33 2qsf n GLY 258 N 1.19 0.87 3.03 3.86 0.00 -0.12 -4.66 105.19 109.36 2qsf n GLY 258 Ca 0.01 -0.63 -0.23 0.00 0.00 0.00 0.00 46.02 45.17 2qsf n GLY 258 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2qsf s HIS 259 N -3.01 1.32 0.00 1.61 3.76 -0.38 -2.32 115.29 116.28 2qsf s HIS 259 Ca 0.03 -0.42 0.00 0.00 -0.15 0.00 0.00 55.06 54.51 2qsf s HIS 259 Cb -0.01 -0.96 0.00 0.00 1.11 0.00 0.00 32.58 32.72 2qsf s HIS 259 CO 0.03 -0.20 0.00 0.41 -0.85 0.00 0.00 174.74 174.13 2qsf n GLY 260 N 3.56 2.19 3.60 -2.22 0.00 -1.08 -4.52 105.19 106.72 2qsf n GLY 260 Ca -0.21 -1.39 -0.29 0.00 0.00 0.00 0.00 46.02 44.13 2qsf n GLY 260 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 2qsf s ASP 261 N 0.00 1.71 0.56 1.61 1.47 -1.26 -2.55 116.67 118.20 2qsf s ASP 261 Ca 0.00 1.11 0.24 0.00 1.18 0.00 0.00 52.55 55.08 2qsf s ASP 261 Cb 0.00 -1.72 1.53 0.00 -0.34 0.00 0.00 42.92 42.39 2qsf s ASP 261 CO 0.00 -3.69 2.15 -0.65 0.68 0.00 0.00 175.17 173.66 2qsf h PRO 262 N -2.28 0.00 -0.18 2.11 0.11 -1.94 -2.03 132.00 127.79 2qsf h PRO 262 Ca -0.54 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 65.52 2qsf h PRO 262 Cb 1.33 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.43 2qsf h PRO 262 CO 0.51 0.00 -0.07 -0.44 -0.21 0.00 0.00 178.00 177.79 2qsf h ASP 263 N 0.00 0.38 0.09 -2.05 3.32 -1.95 -2.79 116.42 113.42 2qsf h ASP 263 Ca 0.05 -0.40 -0.09 0.00 0.02 0.00 0.00 57.03 56.61 2qsf h ASP 263 Cb 0.24 -0.10 -0.01 0.00 0.22 0.00 0.00 39.33 39.67 2qsf h ASP 263 CO -0.00 0.69 -0.30 0.40 -1.72 0.00 0.00 179.24 178.31 2qsf h ILE 264 N 0.06 1.27 -0.56 0.35 2.04 -1.82 -2.48 117.51 116.38 2qsf h ILE 264 Ca 0.04 -1.29 -0.02 0.00 1.00 0.00 0.00 64.86 64.59 2qsf h ILE 264 Cb 0.54 1.48 -0.03 0.00 -0.74 0.00 0.00 36.82 38.07 2qsf h ILE 264 CO 0.02 0.39 0.26 -1.28 0.00 0.00 0.00 178.15 177.55 2qsf h SER 265 N 0.28 0.73 -0.12 1.72 0.87 -1.29 -1.44 113.55 114.30 2qsf h SER 265 Ca 0.04 -0.14 -0.04 0.00 -1.23 0.00 0.00 61.79 60.42 2qsf h SER 265 Cb 0.68 -0.19 -0.00 0.00 -0.44 0.00 0.00 62.40 62.45 2qsf h SER 265 CO 0.05 0.67 -0.09 0.58 -0.53 0.00 0.00 176.83 177.51 2qsf h VAL 266 N 0.75 1.34 -0.91 2.23 2.07 -1.38 -1.87 116.25 118.49 2qsf h VAL 266 Ca 0.19 -1.19 0.18 0.00 0.82 0.00 0.00 66.70 66.70 2qsf h VAL 266 Cb 0.14 1.86 -0.07 0.00 -1.52 0.00 0.00 31.29 31.69 2qsf h VAL 266 CO -0.02 0.34 0.59 1.56 0.02 0.00 0.00 177.57 180.06 2qsf h GLN 267 N -0.09 0.52 -0.19 1.57 4.20 -1.34 0.31 115.11 120.09 2qsf h GLN 267 Ca 0.02 -0.03 -0.19 0.00 0.06 0.00 0.00 58.65 58.51 2qsf h GLN 267 Cb 0.59 -0.12 0.00 0.00 0.30 0.00 0.00 27.48 28.25 2qsf h GLN 267 CO 0.02 0.35 -0.63 0.78 -0.67 0.00 0.00 178.83 178.68 2qsf h GLY 268 N 0.54 0.76 0.73 3.46 0.00 -1.05 -2.54 103.07 104.97 2qsf h GLY 268 Ca 0.47 -0.96 0.05 0.00 0.00 0.00 0.00 47.33 46.89 2qsf h GLY 268 CO -0.21 0.86 0.31 -2.75 0.00 0.00 0.00 176.54 174.75 2qsf h PHE 269 N 0.51 0.58 -0.93 5.60 3.57 0.40 0.06 116.94 126.73 2qsf h PHE 269 Ca -0.01 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.50 2qsf h PHE 269 Cb 1.22 -0.18 -0.04 0.00 2.79 0.00 0.00 35.95 39.74 2qsf h PHE 269 CO 0.06 0.29 0.55 0.28 -2.23 0.00 0.00 178.31 177.26 2qsf h VAL 270 N 0.60 1.26 -0.61 1.41 2.07 -1.05 -2.02 116.25 117.91 2qsf h VAL 270 Ca 0.25 -0.57 0.01 0.00 0.82 0.00 0.00 66.70 67.21 2qsf h VAL 270 Cb 0.13 -0.04 -0.03 0.00 -1.52 0.00 0.00 31.29 29.83 2qsf h VAL 270 CO -0.16 0.27 0.40 0.00 0.02 0.00 0.00 177.57 178.11 2qsf h ALA 271 N 1.30 0.77 -0.34 1.67 0.00 -0.71 -0.49 119.26 121.47 2qsf h ALA 271 Ca 0.33 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 55.20 2qsf h ALA 271 Cb -0.04 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.49 2qsf h ALA 271 CO -0.06 0.19 0.20 1.98 0.00 0.00 0.00 179.25 181.57 2qsf h MET 272 N 0.81 0.46 -0.81 0.00 -1.53 -0.52 -0.02 114.93 113.33 2qsf h MET 272 Ca 0.23 -0.04 -0.04 0.00 -3.44 0.00 0.00 59.70 56.41 2qsf h MET 272 Cb -0.08 -0.10 -0.04 0.00 -0.55 0.00 0.00 31.60 30.84 2qsf h MET 272 CO -0.05 0.35 0.36 -0.07 0.14 0.00 0.00 176.91 177.64 2qsf h LEU 273 N 0.44 1.08 -1.55 3.39 3.38 -1.07 -1.26 115.31 119.70 2qsf h LEU 273 Ca 0.12 -0.14 -0.05 0.00 0.09 0.00 0.00 57.88 57.90 2qsf h LEU 273 Cb 0.01 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.48 2qsf h LEU 273 CO -0.02 0.92 -0.23 0.03 0.09 0.00 0.00 178.44 179.24 2qsf h ARG 274 N 1.16 0.00 0.00 1.13 3.08 -0.68 -1.35 114.38 117.73 2qsf h ARG 274 Ca 0.28 0.00 -0.04 0.00 0.07 0.00 0.00 59.98 60.29 2qsf h ARG 274 Cb 0.15 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.20 2qsf h ARG 274 CO -0.03 0.23 -0.18 0.00 -1.07 0.00 0.00 179.97 178.92 2qsf h ALA 275 N 1.77 1.07 -0.62 0.04 0.00 0.19 -1.20 119.26 120.52 2qsf h ALA 275 Ca -0.00 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.75 2qsf h ALA 275 Cb 0.50 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.26 2qsf h ALA 275 CO 0.03 0.22 0.00 0.00 0.00 0.00 0.00 179.25 179.50 2qsf n ASN 277 N 1.24 -5.14 -4.59 0.00 5.15 -0.45 -5.01 115.26 106.46 2qsf n ASN 277 Ca 0.21 -0.46 -0.34 0.00 -0.60 0.00 0.00 54.58 53.39 2qsf n ASN 277 Cb 0.60 -4.29 -0.11 0.00 -0.53 0.00 0.00 39.78 35.46 2qsf n ASN 277 CO 0.00 0.00 0.00 0.68 1.40 0.00 0.00 177.26 179.34 2qsf s VAL 278 N -3.27 3.99 -0.89 3.44 -7.23 -0.78 -5.01 120.40 110.65 2qsf s VAL 278 Ca 0.42 -0.35 -0.25 0.00 -1.81 0.00 0.00 61.98 59.99 2qsf s VAL 278 Cb -0.18 -2.69 -0.05 0.00 0.56 0.00 0.00 36.38 34.01 2qsf s VAL 278 CO 0.61 0.56 1.98 0.21 -0.31 0.00 0.00 175.10 178.14 2qsf s ASN 279 N -0.38 5.06 -0.18 4.85 2.47 -1.26 -4.22 114.94 121.28 2qsf s ASN 279 Ca 0.06 -0.61 -0.00 0.00 0.42 0.00 0.00 52.86 52.73 2qsf s ASN 279 Cb -0.12 -2.56 0.01 0.00 -1.45 0.00 0.00 41.25 37.13 2qsf s ASN 279 CO 0.02 -2.82 -0.16 0.00 -3.72 0.00 0.00 177.10 170.43 2qsf s ALA 280 N 10.39 2.46 0.45 1.71 0.00 -1.26 -1.86 121.76 133.66 2qsf s ALA 280 Ca 0.72 -1.17 -0.09 0.00 0.00 0.00 0.00 51.96 51.42 2qsf s ALA 280 Cb -0.07 -1.29 -0.05 0.00 0.00 0.00 0.00 23.12 21.71 2qsf s ALA 280 CO 0.00 -0.29 0.81 1.03 0.00 0.00 0.00 175.76 177.31 2qsf s ARG 281 N 1.21 3.69 -0.24 0.00 0.52 0.20 -4.60 118.95 119.73 2qsf s ARG 281 Ca 0.02 0.43 -0.08 0.00 -0.52 0.00 0.00 55.73 55.58 2qsf s ARG 281 Cb -0.14 -2.35 -0.04 0.00 0.52 0.00 0.00 34.95 32.95 2qsf s ARG 281 CO -0.08 -0.15 0.10 -1.17 0.02 0.00 0.00 175.30 174.02 2qsf s LEU 282 N -4.26 3.65 -0.16 2.53 2.96 -0.01 -2.39 118.68 121.01 2qsf s LEU 282 Ca 0.51 -0.10 -0.05 0.00 -0.22 0.00 0.00 54.13 54.26 2qsf s LEU 282 Cb -0.10 -1.98 -0.04 0.00 0.50 0.00 0.00 46.19 44.57 2qsf s LEU 282 CO 0.38 0.00 0.02 -0.63 -1.32 0.00 0.00 176.35 174.80 2qsf s ILE 283 N 1.41 4.45 -0.08 6.68 -1.09 0.34 -0.78 121.20 132.11 2qsf s ILE 283 Ca 0.06 -0.16 0.00 0.00 -2.23 0.00 0.00 60.65 58.32 2qsf s ILE 283 Cb -0.15 -2.97 0.02 0.00 -1.58 0.00 0.00 42.46 37.79 2qsf s ILE 283 CO 0.05 0.50 -0.07 -0.32 -1.23 0.00 0.00 174.94 173.87 2qsf s MET 284 N 0.15 1.27 -0.51 2.79 -2.45 0.06 -0.70 119.30 119.92 2qsf s MET 284 Ca 0.02 -0.20 -0.18 0.00 -1.25 0.00 0.00 55.69 54.09 2qsf s MET 284 Cb -0.13 -1.30 0.07 0.00 1.25 0.00 0.00 34.83 34.73 2qsf s MET 284 CO 0.01 -0.17 0.55 0.45 1.05 0.00 0.00 175.02 176.91 2qsf s SER 285 N 1.37 6.19 0.17 1.11 0.15 0.14 -1.17 113.70 121.65 2qsf s SER 285 Ca -0.02 -1.18 -0.30 0.00 0.70 0.00 0.00 55.95 55.14 2qsf s SER 285 Cb -0.14 -2.25 -0.08 0.00 -1.71 0.00 0.00 66.02 61.84 2qsf s SER 285 CO -0.03 -0.84 1.28 0.00 1.20 0.00 0.00 173.24 174.85 2qsf n GLN 287 N 2.96 2.35 -1.60 0.00 1.13 -1.26 -4.34 117.38 116.61 2qsf n GLN 287 Ca 0.07 -4.51 -0.29 0.00 -1.94 0.00 0.00 57.00 50.33 2qsf n GLN 287 Cb 0.44 -2.14 0.12 0.00 0.11 0.00 0.00 30.24 28.77 2qsf n GLN 287 CO 0.00 0.00 0.00 -1.25 -1.44 0.00 0.00 177.06 174.37 2qsf s PRO 288 N -2.37 1.49 0.64 -1.09 0.04 -1.26 -4.12 135.00 128.32 2qsf s PRO 288 Ca 0.40 0.34 -0.17 0.00 0.04 0.00 0.00 61.00 61.61 2qsf s PRO 288 Cb 0.16 -1.88 -0.01 0.00 0.04 0.00 0.00 34.50 32.81 2qsf s PRO 288 CO -0.03 -1.97 1.16 -1.25 0.04 0.00 0.00 177.00 174.96 2qsf s PRO 289 N -5.30 2.79 -0.53 0.56 0.04 -1.26 -4.79 135.00 126.51 2qsf s PRO 289 Ca 0.63 1.62 -0.28 0.00 0.04 0.00 0.00 61.00 63.01 2qsf s PRO 289 Cb -0.14 -1.93 0.01 0.00 0.04 0.00 0.00 34.50 32.48 2qsf s PRO 289 CO 0.53 -1.30 1.48 0.34 0.04 0.00 0.00 177.00 178.09 2qsf s ASP 290 N -2.07 6.05 0.23 6.66 2.15 -1.26 -4.76 116.67 123.67 2qsf s ASP 290 Ca 0.72 0.42 0.25 0.00 0.43 0.00 0.00 52.55 54.36 2qsf s ASP 290 Cb -0.25 -2.54 0.91 0.00 -0.30 0.00 0.00 42.92 40.74 2qsf s ASP 290 CO 0.38 -1.74 1.74 2.22 -0.17 0.00 0.00 175.17 177.59 2qsf n PHE 291 N 9.84 0.83 1.57 -5.34 1.16 -1.26 -2.27 117.46 121.99 2qsf n PHE 291 Ca 0.14 0.29 0.14 0.00 -1.87 0.00 0.00 57.45 56.16 2qsf n PHE 291 Cb 0.49 -0.97 0.62 0.00 -1.61 0.00 0.00 39.48 38.02 2qsf n PHE 291 CO 0.00 0.00 0.00 0.25 -1.87 0.00 0.00 176.76 175.14 2qsf n THR 292 N -2.22 0.00 -2.82 1.97 -2.24 -1.26 -4.72 114.28 102.99 2qsf n THR 292 Ca 0.04 -0.14 -0.43 0.00 -2.27 0.00 0.00 64.05 61.24 2qsf n THR 292 Cb 0.31 0.14 -0.04 0.00 -2.10 0.00 0.00 70.33 68.64 2qsf n THR 292 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 2qsf s ASN 293 N -2.15 6.52 0.00 3.42 3.84 -0.96 -4.89 114.94 120.72 2qsf s ASN 293 Ca 0.37 0.17 0.24 0.00 0.21 0.00 0.00 52.86 53.84 2qsf s ASN 293 Cb 0.21 -2.45 0.46 0.00 -0.55 0.00 0.00 41.25 38.91 2qsf s ASN 293 CO 0.39 -1.04 1.41 0.23 -2.79 0.00 0.00 177.10 175.31 2qsf n MET 294 N 7.14 2.26 -2.15 0.43 2.81 -1.26 -4.95 117.12 121.40 2qsf n MET 294 Ca 0.06 -1.87 -0.42 0.00 -1.81 0.00 0.00 57.70 53.67 2qsf n MET 294 Cb 0.48 -1.48 -0.03 0.00 -0.71 0.00 0.00 33.22 31.49 2qsf n MET 294 CO 0.00 0.00 0.00 0.15 1.51 0.00 0.00 175.97 177.63 2qsf s LYS 295 N -1.75 4.31 0.00 0.03 1.02 -1.26 -1.16 119.74 120.92 2qsf s LYS 295 Ca 0.34 2.10 0.09 0.00 0.02 0.00 0.00 55.97 58.52 2qsf s LYS 295 Cb 0.21 -3.28 0.45 0.00 -0.52 0.00 0.00 37.83 34.69 2qsf s LYS 295 CO 0.31 -0.47 1.11 1.51 -0.92 0.00 0.00 175.35 176.89 2qsf n ILE 296 N 4.03 0.66 -3.25 2.17 0.00 -1.26 -4.32 119.36 117.39 2qsf n ILE 296 Ca 0.12 0.17 -0.03 0.00 0.00 0.00 0.00 62.75 63.00 2qsf n ILE 296 Cb 0.42 -1.03 -0.04 0.00 0.00 0.00 0.00 39.64 38.99 2qsf n ILE 296 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 176.55 175.93 2qsf s ASP 297 N -2.46 -0.48 -0.53 9.51 -1.08 -1.26 -5.01 116.67 115.36 2qsf s ASP 297 Ca 0.09 0.22 -0.13 0.00 -0.52 0.00 0.00 52.55 52.21 2qsf s ASP 297 Cb 0.06 1.55 0.13 0.00 -1.46 0.00 0.00 42.92 43.20 2qsf s ASP 297 CO 0.12 -0.30 0.45 -0.89 0.52 0.00 0.00 175.17 175.07 2qsf s THR 298 N 2.68 4.81 0.25 1.71 2.01 -1.26 -5.05 115.64 120.80 2qsf s THR 298 Ca 0.13 -1.68 0.00 0.00 0.31 0.00 0.00 61.69 60.46 2qsf s THR 298 Cb -0.13 -4.11 -0.00 0.00 0.01 0.00 0.00 72.50 68.26 2qsf s THR 298 CO -0.23 -0.84 0.01 -1.20 -0.69 0.00 0.00 174.62 171.67 2qsf n SER 299 N 5.03 2.45 -0.18 3.53 7.64 -1.26 -4.08 113.62 126.75 2qsf n SER 299 Ca -0.10 -2.15 0.00 0.00 1.01 0.00 0.00 58.87 57.63 2qsf n SER 299 Cb 0.41 0.24 0.00 0.00 -1.01 0.00 0.00 64.21 63.85 2qsf n SER 299 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 2qsf n LEU 300 N 0.00 0.00 0.00 -3.43 4.32 -1.26 -5.12 117.00 111.51 2qsf n LEU 300 Ca -0.10 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 55.89 2qsf n LEU 300 Cb 0.33 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 42.13 2qsf n LEU 300 CO 0.18 0.00 0.00 -3.20 -1.22 0.00 0.00 177.39 173.15 2qsf n ASN 304 N -0.43 0.00 -3.84 -1.43 5.15 -1.26 -5.32 115.26 108.13 2qsf n ASN 304 Ca 0.00 0.00 -0.13 0.00 -0.60 0.00 0.00 54.58 53.85 2qsf n ASN 304 Cb 0.00 0.00 -0.14 0.00 -0.53 0.00 0.00 39.78 39.11 2qsf n ASN 304 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2qsf s ALA 305 N 0.00 -0.03 0.23 5.20 0.00 -1.26 -5.06 121.76 120.83 2qsf s ALA 305 Ca 0.00 0.14 -0.06 0.00 0.00 0.00 0.00 51.96 52.04 2qsf s ALA 305 Cb 0.00 -0.10 0.21 0.00 0.00 0.00 0.00 23.12 23.23 2qsf s ALA 305 CO 0.00 -0.04 1.75 -0.92 0.00 0.00 0.00 175.76 176.55 2qsf h TYR 306 N 6.41 1.09 0.00 0.00 3.20 -2.01 -2.70 116.97 122.97 2qsf h TYR 306 Ca -0.30 -0.12 -0.03 0.00 3.14 0.00 0.00 58.73 61.43 2qsf h TYR 306 Cb 1.19 -0.31 -0.00 0.00 1.54 0.00 0.00 36.73 39.14 2qsf h TYR 306 CO 0.43 0.89 -0.13 0.87 -1.64 0.00 0.00 178.16 178.58 2qsf h LYS 307 N 0.99 0.00 0.14 1.82 1.57 -1.98 -2.80 116.57 116.31 2qsf h LYS 307 Ca 0.21 0.00 -0.26 0.00 -1.87 0.00 0.00 60.65 58.73 2qsf h LYS 307 Cb 0.35 0.00 0.03 0.00 0.08 0.00 0.00 32.23 32.69 2qsf h LYS 307 CO 0.00 0.13 -1.10 -0.44 -0.57 0.00 0.00 179.45 177.47 2qsf h ASP 308 N 0.00 0.73 -0.28 0.86 3.32 -1.85 -3.22 116.42 115.98 2qsf h ASP 308 Ca -0.00 -0.87 0.04 0.00 0.02 0.00 0.00 57.03 56.22 2qsf h ASP 308 Cb 0.24 -0.23 -0.03 0.00 0.22 0.00 0.00 39.33 39.52 2qsf h ASP 308 CO 0.02 1.53 0.07 -0.03 -1.72 0.00 0.00 179.24 179.11 2qsf h MET 309 N 0.04 0.18 -0.11 3.56 4.05 -1.32 -2.70 114.93 118.63 2qsf h MET 309 Ca -0.18 -0.01 0.00 0.00 -0.28 0.00 0.00 59.70 59.23 2qsf h MET 309 Cb 1.82 -0.04 0.00 0.00 -0.80 0.00 0.00 31.60 32.58 2qsf h MET 309 CO 0.21 0.12 0.00 0.28 0.23 0.00 0.00 176.91 177.75 2qsf n VAL 310 N -5.07 0.15 0.21 -5.77 0.31 -1.08 -3.94 118.33 103.15 2qsf n VAL 310 Ca -0.01 -0.15 0.05 0.00 -0.01 0.00 0.00 64.34 64.22 2qsf n VAL 310 Cb 0.12 0.06 0.46 0.00 -0.91 0.00 0.00 33.84 33.57 2qsf n VAL 310 CO 0.00 0.00 0.00 0.50 -1.32 0.00 0.00 176.83 176.01 2qsf h LYS 311 N 0.68 0.00 -5.14 5.55 3.64 -1.49 -3.42 116.57 116.39 2qsf h LYS 311 Ca 0.00 0.00 -0.51 0.00 -1.27 0.00 0.00 60.65 58.87 2qsf h LYS 311 Cb 0.15 0.00 -0.30 0.00 -0.41 0.00 0.00 32.23 31.67 2qsf h LYS 311 CO 0.00 0.27 -0.82 0.71 -2.27 0.00 0.00 179.45 177.34 2qsf s TYR 312 N -4.32 1.39 0.68 1.91 1.51 -1.25 -4.80 117.35 112.47 2qsf s TYR 312 Ca -0.03 -0.34 -0.12 0.00 -1.01 0.00 0.00 57.07 55.56 2qsf s TYR 312 Cb 0.15 -0.93 0.01 0.00 -0.11 0.00 0.00 41.96 41.07 2qsf s TYR 312 CO 0.69 -0.10 1.07 -1.25 -1.11 0.00 0.00 175.55 174.85 2qsf s PRO 313 N -0.05 2.87 -0.17 -1.71 0.04 -1.26 -5.00 135.00 129.73 2qsf s PRO 313 Ca -0.00 1.09 0.08 0.00 0.04 0.00 0.00 61.00 62.20 2qsf s PRO 313 Cb -0.09 -1.98 -0.23 0.00 0.04 0.00 0.00 34.50 32.25 2qsf s PRO 313 CO 0.01 -1.16 0.18 -0.89 0.04 0.00 0.00 177.00 175.18 2qsf n ILE 314 N -2.90 1.54 -4.54 0.56 2.08 -1.26 -4.88 119.36 109.96 2qsf n ILE 314 Ca 0.08 -0.73 -0.30 0.00 0.56 0.00 0.00 62.75 62.37 2qsf n ILE 314 Cb 0.53 -1.10 -0.13 0.00 -0.75 0.00 0.00 39.64 38.19 2qsf n ILE 314 CO 0.00 0.00 0.00 -0.36 0.56 0.00 0.00 176.55 176.75 2qsf s PHE 315 N -2.54 2.48 0.00 1.39 0.40 -1.26 0.23 117.98 118.69 2qsf s PHE 315 Ca -0.18 -0.30 0.00 0.00 -0.60 0.00 0.00 56.93 55.85 2qsf s PHE 315 Cb 0.07 -1.39 0.00 0.00 0.51 0.00 0.00 43.02 42.22 2qsf s PHE 315 CO 0.75 0.29 0.00 -2.67 0.70 0.00 0.00 175.22 174.29 2qsf n TRP 316 N 1.26 -0.96 -4.37 0.36 2.14 0.13 -4.99 117.44 111.01 2qsf n TRP 316 Ca -0.16 0.00 -0.23 0.00 2.07 0.00 0.00 57.50 59.18 2qsf n TRP 316 Cb 0.52 0.00 -0.11 0.00 -0.81 0.00 0.00 31.31 30.91 2qsf n TRP 316 CO 0.00 0.00 0.00 0.00 2.07 0.00 0.00 177.69 179.76 2qsf s GLU 318 N -2.84 -0.04 -0.11 0.00 2.12 -1.00 -0.63 118.70 116.20 2qsf s GLU 318 Ca 0.18 0.38 -0.03 0.00 0.36 0.00 0.00 54.97 55.87 2qsf s GLU 318 Cb -0.06 -0.57 -0.03 0.00 0.26 0.00 0.00 34.13 33.73 2qsf s GLU 318 CO 0.08 -0.35 -0.00 0.08 -0.54 0.00 0.00 175.26 174.52 2qsf s VAL 319 N 2.19 4.25 0.01 3.70 1.01 -0.02 0.58 120.40 132.12 2qsf s VAL 319 Ca 0.04 -0.26 -0.25 0.00 0.00 0.00 0.00 61.98 61.51 2qsf s VAL 319 Cb -0.12 -2.81 -0.05 0.00 0.00 0.00 0.00 36.38 33.40 2qsf s VAL 319 CO -0.04 0.57 0.79 0.86 0.00 0.00 0.00 175.10 177.28 2qsf s TRP 320 N -0.55 3.69 -0.38 5.22 -0.11 -0.77 0.58 118.94 126.60 2qsf s TRP 320 Ca 0.09 1.46 -0.07 0.00 1.22 0.00 0.00 56.10 58.80 2qsf s TRP 320 Cb -0.12 -2.87 0.06 0.00 -1.50 0.00 0.00 33.47 29.05 2qsf s TRP 320 CO 0.02 0.18 0.19 0.34 -4.62 0.00 0.00 176.95 173.06 2qsf s ASP 321 N 0.32 5.47 0.28 5.86 3.68 -0.73 -4.85 116.67 126.71 2qsf s ASP 321 Ca 0.41 -1.40 0.01 0.00 2.13 0.00 0.00 52.55 53.70 2qsf s ASP 321 Cb -0.20 -1.93 0.42 0.00 -1.45 0.00 0.00 42.92 39.77 2qsf s ASP 321 CO 0.23 -0.45 1.76 0.07 0.13 0.00 0.00 175.17 176.91 2qsf h LYS 322 N 8.30 0.60 -0.46 4.34 2.10 -1.96 0.40 116.57 129.89 2qsf h LYS 322 Ca -0.22 -0.18 -0.10 0.00 -2.00 0.00 0.00 60.65 58.15 2qsf h LYS 322 Cb 1.08 -0.06 -0.01 0.00 -0.90 0.00 0.00 32.23 32.34 2qsf h LYS 322 CO 0.69 0.71 -0.10 0.74 -2.00 0.00 0.00 179.45 179.49 2qsf h PHE 323 N 0.55 0.98 -0.02 0.07 -1.00 -1.93 -3.24 116.94 112.36 2qsf h PHE 323 Ca 0.10 -0.21 0.00 0.00 2.81 0.00 0.00 57.97 60.67 2qsf h PHE 323 Cb 0.53 -0.24 0.00 0.00 3.61 0.00 0.00 35.95 39.85 2qsf h PHE 323 CO 0.02 0.96 -0.27 -1.13 -1.61 0.00 0.00 178.31 176.28 2qsf n SER 324 N -4.27 1.98 -3.44 2.17 3.41 -1.21 -4.96 113.62 107.31 2qsf n SER 324 Ca -0.00 -1.49 -0.25 0.00 -0.26 0.00 0.00 58.87 56.87 2qsf n SER 324 Cb 0.37 0.34 0.04 0.00 -0.26 0.00 0.00 64.21 64.71 2qsf n SER 324 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2qsf n LYS 325 N 0.23 -5.93 -4.24 4.33 4.76 0.14 -4.99 118.16 112.46 2qsf n LYS 325 Ca 0.08 0.77 -0.17 0.00 -2.87 0.00 0.00 58.31 56.13 2qsf n LYS 325 Cb 0.40 -5.69 -0.13 0.00 -1.84 0.00 0.00 35.03 27.77 2qsf n LYS 325 CO 0.00 0.00 0.00 0.15 -1.37 0.00 0.00 177.40 176.18 2qsf s LYS 326 N -6.14 0.68 -0.04 1.97 -0.14 -1.06 -4.82 119.74 110.19 2qsf s LYS 326 Ca 0.49 -0.55 -0.30 0.00 -1.36 0.00 0.00 55.97 54.25 2qsf s LYS 326 Cb -0.23 -0.61 -0.02 0.00 -1.68 0.00 0.00 37.83 35.28 2qsf s LYS 326 CO 0.60 0.15 1.02 -1.58 -0.76 0.00 0.00 175.35 174.79 2qsf s TRP 327 N -0.71 3.55 -0.09 3.18 0.52 -1.26 -1.77 118.94 122.35 2qsf s TRP 327 Ca -0.01 1.59 -0.14 0.00 0.02 0.00 0.00 56.10 57.56 2qsf s TRP 327 Cb -0.06 -3.19 -0.05 0.00 -1.15 0.00 0.00 33.47 29.01 2qsf s TRP 327 CO 0.00 -0.29 0.34 0.42 0.02 0.00 0.00 176.95 177.44 2qsf s ILE 328 N 1.53 5.21 -0.10 2.03 1.01 0.19 -4.67 121.20 126.40 2qsf s ILE 328 Ca 0.51 0.66 -0.20 0.00 0.00 0.00 0.00 60.65 61.63 2qsf s ILE 328 Cb -0.21 -3.65 -0.04 0.00 0.01 0.00 0.00 42.46 38.57 2qsf s ILE 328 CO 0.23 0.49 0.56 -0.89 0.00 0.00 0.00 174.94 175.33 2qsf s THR 329 N -0.33 5.14 -0.06 2.92 2.01 -0.19 -0.84 115.64 124.29 2qsf s THR 329 Ca 0.20 1.13 0.01 0.00 0.31 0.00 0.00 61.69 63.34 2qsf s THR 329 Cb -0.15 -3.90 0.02 0.00 0.01 0.00 0.00 72.50 68.49 2qsf s THR 329 CO 0.08 0.30 -0.08 -0.69 -0.69 0.00 0.00 174.62 173.54 2qsf s VAL 330 N 0.67 0.86 -0.41 3.82 1.01 0.20 -0.41 120.40 126.15 2qsf s VAL 330 Ca 0.30 -0.30 0.01 0.00 0.00 0.00 0.00 61.98 61.99 2qsf s VAL 330 Cb -0.16 -0.83 0.13 0.00 0.00 0.00 0.00 36.38 35.52 2qsf s VAL 330 CO 0.13 0.30 0.21 -0.62 0.00 0.00 0.00 175.10 175.13 2qsf s ASP 331 N 0.88 3.60 0.12 3.32 3.68 -0.30 -1.09 116.67 126.87 2qsf s ASP 331 Ca -0.11 -2.42 0.27 0.00 2.13 0.00 0.00 52.55 52.41 2qsf s ASP 331 Cb -0.15 -0.92 0.99 0.00 -1.45 0.00 0.00 42.92 41.39 2qsf s ASP 331 CO 0.01 -0.29 1.82 -0.81 0.13 0.00 0.00 175.17 176.03 2qsf n PRO 332 N 3.80 0.14 -0.06 4.34 -0.04 -1.26 -0.56 135.00 141.35 2qsf n PRO 332 Ca 0.08 0.14 -0.08 0.00 -0.04 0.00 0.00 63.50 63.60 2qsf n PRO 332 Cb 0.36 -1.67 -0.03 0.00 -0.04 0.00 0.00 33.50 32.12 2qsf n PRO 332 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 2qsf n VAL 333 N -1.91 1.44 0.00 0.52 0.31 -1.26 -4.59 118.33 112.84 2qsf n VAL 333 Ca 0.06 0.18 0.00 0.00 -0.01 0.00 0.00 64.34 64.57 2qsf n VAL 333 Cb 0.37 -2.18 0.00 0.00 -0.91 0.00 0.00 33.84 31.12 2qsf n VAL 333 CO 0.00 0.00 0.00 -3.20 -1.32 0.00 0.00 176.83 172.31 2qsf n ASN 334 N -4.26 0.00 0.02 4.52 2.85 -1.26 -4.36 115.26 112.77 2qsf n ASN 334 Ca -0.12 0.10 0.11 0.00 -0.11 0.00 0.00 54.58 54.55 2qsf n ASN 334 Cb 0.43 -0.08 0.47 0.00 1.24 0.00 0.00 39.78 41.83 2qsf n ASN 334 CO 0.00 0.00 0.00 0.18 -2.11 0.00 0.00 177.26 175.33 2qsf n LEU 335 N -0.75 0.10 -4.03 1.20 4.77 -1.26 -4.92 117.00 112.11 2qsf n LEU 335 Ca 0.00 0.52 -0.37 0.00 -0.03 0.00 0.00 56.01 56.13 2qsf n LEU 335 Cb 0.00 -0.49 -0.01 0.00 -2.33 0.00 0.00 43.42 40.59 2qsf n LEU 335 CO 0.00 -0.16 -0.23 0.29 -1.33 0.00 0.00 177.39 175.97 2qsf n LYS 336 N -1.60 -1.06 -3.78 3.23 5.02 -0.31 -4.95 118.16 114.70 2qsf n LYS 336 Ca 0.05 0.20 -0.10 0.00 -2.02 0.00 0.00 58.31 56.45 2qsf n LYS 336 Cb 0.27 -3.38 -0.05 0.00 -0.02 0.00 0.00 35.03 31.84 2qsf n LYS 336 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 2qsf s THR 337 N -3.77 0.06 -0.09 -0.18 -4.23 0.27 -4.94 115.64 102.77 2qsf s THR 337 Ca 0.31 -0.93 0.04 0.00 -1.18 0.00 0.00 61.69 59.93 2qsf s THR 337 Cb -0.15 -1.50 0.00 0.00 1.34 0.00 0.00 72.50 72.19 2qsf s THR 337 CO 0.94 -0.28 -0.22 -0.63 -0.54 0.00 0.00 174.62 173.89 2qsf s ILE 338 N -3.88 1.90 -0.01 2.99 1.01 -1.26 -1.15 121.20 120.79 2qsf s ILE 338 Ca 0.09 -0.92 -0.02 0.00 0.00 0.00 0.00 60.65 59.79 2qsf s ILE 338 Cb 0.02 -1.65 0.00 0.00 0.01 0.00 0.00 42.46 40.84 2qsf s ILE 338 CO -0.06 0.52 0.06 -1.83 0.00 0.00 0.00 174.94 173.64 2qsf s GLU 339 N 0.40 0.16 -1.12 2.79 -1.05 0.45 -5.01 118.70 115.32 2qsf s GLU 339 Ca -0.18 -0.07 -0.11 0.00 -0.15 0.00 0.00 54.97 54.46 2qsf s GLU 339 Cb -0.18 0.07 0.25 0.00 -0.44 0.00 0.00 34.13 33.83 2qsf s GLU 339 CO 0.08 -0.03 1.17 -0.65 0.95 0.00 0.00 175.26 176.78 2qsf s GLN 340 N -0.36 4.14 0.01 -4.83 -0.21 -1.26 -1.02 119.66 116.13 2qsf s GLN 340 Ca -0.04 -3.02 -0.37 0.00 0.02 0.00 0.00 55.36 51.95 2qsf s GLN 340 Cb -0.03 -4.67 -0.16 0.00 1.00 0.00 0.00 33.01 29.16 2qsf s GLN 340 CO 0.00 -1.37 1.52 0.28 -2.12 0.00 0.00 175.29 173.60 2qsf n VAL 341 N 3.22 0.12 0.02 1.09 0.31 -1.26 -4.87 118.33 116.96 2qsf n VAL 341 Ca 0.26 -0.02 0.00 0.00 -0.01 0.00 0.00 64.34 64.57 2qsf n VAL 341 Cb 0.40 -1.13 0.00 0.00 -0.91 0.00 0.00 33.84 32.21 2qsf n VAL 341 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 2qsf n ARG 342 N 3.64 0.00 0.00 5.55 5.12 -1.26 -4.96 116.66 124.75 2qsf n ARG 342 Ca 0.20 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 56.12 2qsf n ARG 342 Cb 0.20 -0.48 0.00 0.00 -1.16 0.00 0.00 32.46 31.02 2qsf n ARG 342 CO 0.00 0.00 0.00 1.47 -1.93 0.00 0.00 177.63 177.17 2qsf n LEU 343 N -3.21 0.00 -4.10 0.55 -0.00 -1.26 -5.01 117.00 103.98 2qsf n LEU 343 Ca 0.00 0.00 -0.28 0.00 -0.00 0.00 0.00 56.01 55.73 2qsf n LEU 343 Cb 0.28 0.00 -0.17 0.00 -0.00 0.00 0.00 43.42 43.53 2qsf n LEU 343 CO 0.00 0.00 -0.51 -2.28 -0.00 0.00 0.00 177.39 174.60 2qsf s HIS 344 N -1.09 2.01 -0.12 1.47 5.04 -1.26 -4.77 115.29 116.57 2qsf s HIS 344 Ca 0.00 -0.86 -0.01 0.00 -1.54 0.00 0.00 55.06 52.65 2qsf s HIS 344 Cb 0.00 -1.41 -0.02 0.00 0.04 0.00 0.00 32.58 31.18 2qsf s HIS 344 CO 0.00 -0.40 -0.09 0.45 -2.34 0.00 0.00 174.74 172.36 2qsf s SER 345 N 0.68 4.42 0.16 9.88 0.15 -1.26 -4.76 113.70 122.97 2qsf s SER 345 Ca -0.13 -0.18 0.23 0.00 0.70 0.00 0.00 55.95 56.57 2qsf s SER 345 Cb -0.16 -1.52 0.90 0.00 -1.71 0.00 0.00 66.02 63.53 2qsf s SER 345 CO 0.03 0.22 1.70 0.29 1.20 0.00 0.00 173.24 176.69 2qsf n LYS 346 N 3.16 0.15 0.05 5.44 5.02 -1.26 -3.39 118.16 127.32 2qsf n LYS 346 Ca -0.18 0.29 0.12 0.00 -2.02 0.00 0.00 58.31 56.52 2qsf n LYS 346 Cb 0.53 -1.74 0.30 0.00 -0.02 0.00 0.00 35.03 34.10 2qsf n LYS 346 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 2qsf n LEU 347 N -2.01 0.57 -4.70 -0.35 4.32 -1.26 -4.82 117.00 108.75 2qsf n LEU 347 Ca 0.04 0.28 -0.42 0.00 -0.02 0.00 0.00 56.01 55.89 2qsf n LEU 347 Cb 0.28 -0.27 -0.03 0.00 -1.62 0.00 0.00 43.42 41.78 2qsf n LEU 347 CO 0.22 -0.03 0.82 0.00 -1.22 0.00 0.00 177.39 177.18 2qsf s ALA 348 N -3.09 3.35 0.38 -1.18 0.00 -1.22 -4.72 121.76 115.28 2qsf s ALA 348 Ca 0.09 0.62 -0.27 0.00 0.00 0.00 0.00 51.96 52.40 2qsf s ALA 348 Cb 0.15 -3.43 -0.11 0.00 0.00 0.00 0.00 23.12 19.73 2qsf s ALA 348 CO 0.66 -0.49 1.32 -0.35 0.00 0.00 0.00 175.76 176.91 2qsf n PRO 349 N 4.43 2.16 -4.20 0.00 -0.04 -1.26 -5.02 135.00 131.07 2qsf n PRO 349 Ca 0.09 0.76 -0.18 0.00 -0.04 0.00 0.00 63.50 64.12 2qsf n PRO 349 Cb 0.48 -2.42 -0.15 0.00 -0.04 0.00 0.00 33.50 31.37 2qsf n PRO 349 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 2qsf s LYS 350 N -2.05 0.68 0.00 0.54 3.01 -1.26 -4.90 119.74 115.75 2qsf s LYS 350 Ca 0.57 -0.17 0.00 0.00 -1.01 0.00 0.00 55.97 55.36 2qsf s LYS 350 Cb -0.53 -0.67 0.00 0.00 -1.01 0.00 0.00 37.83 35.62 2qsf s LYS 350 CO 0.61 0.03 0.00 0.41 0.51 0.00 0.00 175.35 176.91 2qsf n GLY 351 N 3.48 1.98 0.31 -3.33 0.00 -1.26 -4.44 105.19 101.93 2qsf n GLY 351 Ca -0.20 -1.49 0.13 0.00 0.00 0.00 0.00 46.02 44.47 2qsf n GLY 351 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2qsf h VAL 352 N 0.00 0.27 -0.36 1.61 2.07 -1.98 -1.23 116.25 116.63 2qsf h VAL 352 Ca 0.00 -0.06 -0.04 0.00 0.82 0.00 0.00 66.70 67.42 2qsf h VAL 352 Cb 0.00 0.09 -0.01 0.00 -1.52 0.00 0.00 31.29 29.85 2qsf h VAL 352 CO 0.00 0.03 0.06 0.00 0.02 0.00 0.00 177.57 177.68 2qsf h ALA 353 N 1.81 0.47 0.00 1.67 0.00 -1.98 -2.94 119.26 118.29 2qsf h ALA 353 Ca 0.55 -0.21 -0.05 0.00 0.00 0.00 0.00 54.91 55.20 2qsf h ALA 353 Cb 1.12 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.77 2qsf h ALA 353 CO -0.69 0.18 -0.25 0.00 0.00 0.00 0.00 179.25 178.49 2qsf h GLU 356 N 2.93 0.79 -0.10 0.00 4.81 -1.37 -3.07 114.58 118.57 2qsf h GLU 356 Ca 0.00 -0.07 0.00 0.00 -0.13 0.00 0.00 59.36 59.16 2qsf h GLU 356 Cb 0.63 -0.17 0.00 0.00 0.63 0.00 0.00 28.75 29.84 2qsf h GLU 356 CO 0.00 0.56 0.00 0.54 -0.73 0.00 0.00 179.01 179.38 2qsf n ARG 357 N -4.64 2.42 -3.47 1.92 1.74 -1.26 -4.85 116.66 108.52 2qsf n ARG 357 Ca 0.04 -1.54 -0.29 0.00 -0.77 0.00 0.00 57.85 55.29 2qsf n ARG 357 Cb 0.05 -1.09 -0.12 0.00 -1.02 0.00 0.00 32.46 30.28 2qsf n ARG 357 CO 0.00 0.00 0.00 1.21 -1.52 0.00 0.00 177.63 177.32 2qsf s ASN 358 N -0.89 2.92 -0.57 0.55 3.84 -1.16 -0.17 114.94 119.45 2qsf s ASN 358 Ca 0.08 -2.25 -0.08 0.00 0.21 0.00 0.00 52.86 50.82 2qsf s ASN 358 Cb 0.04 -0.43 0.15 0.00 -0.55 0.00 0.00 41.25 40.46 2qsf s ASN 358 CO 0.05 -0.30 0.44 -0.32 -2.79 0.00 0.00 177.10 174.18 2qsf s MET 359 N 0.99 2.67 -0.25 0.43 -2.45 -1.25 -4.23 119.30 115.21 2qsf s MET 359 Ca 0.19 -2.11 -0.28 0.00 -1.25 0.00 0.00 55.69 52.23 2qsf s MET 359 Cb -0.22 -3.94 -0.06 0.00 1.25 0.00 0.00 34.83 31.87 2qsf s MET 359 CO -0.00 -1.20 2.25 -0.11 1.05 0.00 0.00 175.02 177.01 2qsf n LEU 360 N 4.32 3.10 0.00 4.11 0.00 -1.26 -4.73 117.00 122.55 2qsf n LEU 360 Ca 0.01 0.13 0.00 0.00 0.00 0.00 0.00 56.01 56.15 2qsf n LEU 360 Cb 0.41 -1.54 0.00 0.00 0.00 0.00 0.00 43.42 42.29 2qsf n LEU 360 CO 0.38 -0.79 -0.21 0.54 0.00 0.00 0.00 177.39 177.31 2qsf n ARG 361 N 8.77 0.17 -3.63 1.96 1.74 -1.26 -4.89 116.66 119.52 2qsf n ARG 361 Ca 0.31 0.00 -0.29 0.00 -0.77 0.00 0.00 57.85 57.10 2qsf n ARG 361 Cb 0.45 -0.71 -0.14 0.00 -1.02 0.00 0.00 32.46 31.03 2qsf n ARG 361 CO 0.00 0.00 0.00 0.71 -1.52 0.00 0.00 177.63 176.82 2qsf s TYR 362 N -1.42 1.25 -0.48 -1.55 2.02 -1.26 -4.92 117.35 110.98 2qsf s TYR 362 Ca 0.00 -1.64 -0.15 0.00 -0.37 0.00 0.00 57.07 54.91 2qsf s TYR 362 Cb 0.00 -1.41 0.08 0.00 -0.40 0.00 0.00 41.96 40.23 2qsf s TYR 362 CO 0.00 -0.84 0.41 0.08 -1.57 0.00 0.00 175.55 173.63 2qsf s VAL 363 N 1.40 5.22 -0.08 0.71 1.01 -1.26 -1.52 120.40 125.88 2qsf s VAL 363 Ca 0.13 -1.12 -0.09 0.00 0.00 0.00 0.00 61.98 60.89 2qsf s VAL 363 Cb -0.19 -4.15 -0.04 0.00 0.00 0.00 0.00 36.38 31.99 2qsf s VAL 363 CO -0.18 -0.62 0.21 -0.63 0.00 0.00 0.00 175.10 173.88 2qsf s ILE 364 N 1.63 5.38 -0.13 2.22 -1.09 -0.32 0.14 121.20 129.04 2qsf s ILE 364 Ca 0.04 0.37 0.03 0.00 -2.23 0.00 0.00 60.65 58.86 2qsf s ILE 364 Cb -0.25 -3.49 0.01 0.00 -1.58 0.00 0.00 42.46 37.15 2qsf s ILE 364 CO 0.06 0.60 -0.22 0.00 -1.23 0.00 0.00 174.94 174.15 2qsf s ALA 365 N -1.05 2.18 -0.07 9.38 0.00 -0.53 -0.76 121.76 130.91 2qsf s ALA 365 Ca 0.18 -1.03 0.01 0.00 0.00 0.00 0.00 51.96 51.12 2qsf s ALA 365 Cb -0.13 -0.94 -0.03 0.00 0.00 0.00 0.00 23.12 22.02 2qsf s ALA 365 CO 0.07 0.04 -0.09 0.71 0.00 0.00 0.00 175.76 176.49 2qsf s TYR 366 N 0.71 2.86 0.48 0.00 1.51 0.04 -2.36 117.35 120.58 2qsf s TYR 366 Ca -0.10 -0.09 0.04 0.00 -1.01 0.00 0.00 57.07 55.91 2qsf s TYR 366 Cb -0.16 -1.71 -0.03 0.00 -0.11 0.00 0.00 41.96 39.95 2qsf s TYR 366 CO 0.01 0.23 0.07 0.16 -1.11 0.00 0.00 175.55 174.91 2qsf s ASP 367 N -0.65 4.16 0.32 2.29 1.47 -1.04 -0.83 116.67 122.40 2qsf s ASP 367 Ca 0.10 -1.46 0.09 0.00 1.18 0.00 0.00 52.55 52.45 2qsf s ASP 367 Cb -0.11 0.14 0.84 0.00 -0.34 0.00 0.00 42.92 43.45 2qsf s ASP 367 CO 0.01 -0.74 1.77 0.03 0.68 0.00 0.00 175.17 176.93 2qsf h ARG 368 N 1.40 0.63 -0.66 2.11 3.08 -1.92 -0.93 114.38 118.09 2qsf h ARG 368 Ca -0.43 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 59.58 2qsf h ARG 368 Cb 1.29 -0.14 0.00 0.00 0.08 0.00 0.00 29.97 31.19 2qsf h ARG 368 CO 0.74 0.42 0.00 1.63 -1.07 0.00 0.00 179.97 181.68 2qsf n LYS 369 N -4.77 2.69 -3.07 0.04 4.76 -1.26 -4.90 118.16 111.65 2qsf n LYS 369 Ca 0.24 -1.57 -0.17 0.00 -2.87 0.00 0.00 58.31 53.95 2qsf n LYS 369 Cb 0.66 -1.71 0.04 0.00 -1.84 0.00 0.00 35.03 32.18 2qsf n LYS 369 CO 0.00 0.00 0.00 0.66 -1.37 0.00 0.00 177.40 176.69 2qsf n TYR 370 N 0.42 -1.79 -3.15 2.13 4.02 -0.35 -4.52 117.16 113.92 2qsf n TYR 370 Ca 0.14 0.57 -0.28 0.00 -0.01 0.00 0.00 57.90 58.32 2qsf n TYR 370 Cb 0.62 -3.76 -0.03 0.00 -0.02 0.00 0.00 39.34 36.14 2qsf n TYR 370 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 176.86 176.05 2qsf s GLY 371 N -3.02 1.80 -0.19 2.72 0.00 -1.26 -0.59 107.32 106.78 2qsf s GLY 371 Ca 0.33 -0.49 -0.04 0.00 0.00 0.00 0.00 44.72 44.51 2qsf s GLY 371 CO 0.41 -0.36 0.15 0.00 0.00 0.00 0.00 173.10 173.29 2qsf s ARG 373 N 2.21 1.41 -0.40 0.00 0.52 -1.00 -4.64 118.95 117.06 2qsf s ARG 373 Ca 0.04 -1.08 -0.27 0.00 -0.52 0.00 0.00 55.73 53.91 2qsf s ARG 373 Cb -0.16 -1.62 0.02 0.00 0.52 0.00 0.00 34.95 33.71 2qsf s ARG 373 CO -0.12 0.40 0.99 0.34 0.02 0.00 0.00 175.30 176.93 2qsf s ASP 374 N -1.47 6.68 -0.19 0.23 3.68 -1.26 -1.45 116.67 122.88 2qsf s ASP 374 Ca 0.09 0.55 0.16 0.00 2.13 0.00 0.00 52.55 55.48 2qsf s ASP 374 Cb -0.09 -2.49 0.53 0.00 -1.45 0.00 0.00 42.92 39.42 2qsf s ASP 374 CO 0.03 -0.97 1.43 0.55 0.13 0.00 0.00 175.17 176.35 2qsf n VAL 375 N 6.20 2.33 -0.34 1.11 3.14 0.12 -4.70 118.33 126.18 2qsf n VAL 375 Ca 0.09 -1.95 0.11 0.00 -2.96 0.00 0.00 64.34 59.62 2qsf n VAL 375 Cb 0.48 -0.27 0.28 0.00 -1.06 0.00 0.00 33.84 33.28 2qsf n VAL 375 CO 0.00 0.00 0.00 0.74 -6.46 0.00 0.00 176.83 171.11 2qsf h THR 376 N 1.74 0.74 -1.00 1.55 2.02 -1.87 -2.15 112.91 113.94 2qsf h THR 376 Ca 0.03 -0.26 0.35 0.00 0.77 0.00 0.00 66.41 67.30 2qsf h THR 376 Cb 1.48 -0.08 -0.16 0.00 -1.74 0.00 0.00 68.15 67.65 2qsf h THR 376 CO 0.25 0.14 0.54 -0.09 0.37 0.00 0.00 175.52 176.73 2qsf h ARG 377 N 0.75 0.20 -0.02 6.66 1.12 -1.86 0.42 114.38 121.65 2qsf h ARG 377 Ca 0.54 -0.01 -0.13 0.00 -1.11 0.00 0.00 59.98 59.26 2qsf h ARG 377 Cb 0.78 -0.04 -0.02 0.00 -0.01 0.00 0.00 29.97 30.68 2qsf h ARG 377 CO -0.36 0.13 -0.61 -0.09 -3.11 0.00 0.00 179.97 175.92 2qsf h ARG 378 N 0.20 0.08 0.00 0.20 2.43 -1.77 -3.34 114.38 112.18 2qsf h ARG 378 Ca 0.77 -0.06 -0.30 0.00 -0.81 0.00 0.00 59.98 59.58 2qsf h ARG 378 Cb 1.85 0.01 -0.06 0.00 -0.42 0.00 0.00 29.97 31.35 2qsf h ARG 378 CO -0.67 0.67 -2.26 0.66 -1.51 0.00 0.00 179.97 176.85 2qsf n TYR 379 N -3.83 0.08 -2.97 2.20 4.02 0.73 -4.75 117.16 112.63 2qsf n TYR 379 Ca -0.02 0.03 -0.42 0.00 -0.01 0.00 0.00 57.90 57.48 2qsf n TYR 379 Cb 0.61 -0.94 -0.05 0.00 -0.02 0.00 0.00 39.34 38.94 2qsf n TYR 379 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2qsf s ALA 380 N -2.67 3.48 0.18 -0.72 0.00 0.11 -4.73 121.76 117.43 2qsf s ALA 380 Ca -0.09 -0.56 -0.02 0.00 0.00 0.00 0.00 51.96 51.29 2qsf s ALA 380 Cb 0.07 -3.30 0.07 0.00 0.00 0.00 0.00 23.12 19.97 2qsf s ALA 380 CO 0.84 -1.32 1.45 0.37 0.00 0.00 0.00 175.76 177.11 2qsf h GLN 381 N 8.29 0.45 -1.69 0.00 4.15 -1.86 -3.23 115.11 121.23 2qsf h GLN 381 Ca -0.25 -0.34 -0.65 0.00 0.77 0.00 0.00 58.65 58.18 2qsf h GLN 381 Cb 1.10 0.06 -0.37 0.00 0.21 0.00 0.00 27.48 28.48 2qsf h GLN 381 CO 0.89 0.97 -0.14 0.91 -1.93 0.00 0.00 178.83 179.52 2qsf n TRP 382 N -3.88 3.29 -0.08 3.99 7.02 -1.26 -4.85 117.44 121.67 2qsf n TRP 382 Ca -0.04 -2.88 -0.11 0.00 -1.02 0.00 0.00 57.50 53.45 2qsf n TRP 382 Cb 0.68 -0.45 -0.05 0.00 -2.42 0.00 0.00 31.31 29.06 2qsf n TRP 382 CO 0.00 0.00 0.00 0.52 -2.02 0.00 0.00 177.69 176.19 2qsf h MET 383 N 2.73 -0.37 0.00 -0.99 2.86 -1.92 0.19 114.93 117.44 2qsf h MET 383 Ca 0.38 0.03 0.00 0.00 -2.06 0.00 0.00 59.70 58.05 2qsf h MET 383 Cb 0.62 0.09 0.00 0.00 0.06 0.00 0.00 31.60 32.37 2qsf h MET 383 CO 1.04 -0.25 0.00 -0.91 1.06 0.00 0.00 176.91 177.85 2qsf h ASN 384 N -0.39 0.00 0.00 1.22 2.35 -1.91 0.58 115.58 117.43 2qsf h ASN 384 Ca 0.11 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.85 2qsf h ASN 384 Cb 0.60 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.97 2qsf h ASN 384 CO -0.51 0.00 -1.27 -1.54 -1.65 0.00 0.00 177.43 172.46 2qsf n SER 385 N -2.89 3.73 0.01 5.81 3.41 -1.07 -4.55 113.62 118.07 2qsf n SER 385 Ca 0.02 0.00 -0.03 0.00 -0.26 0.00 0.00 58.87 58.60 2qsf n SER 385 Cb 0.36 1.17 -0.01 0.00 -0.26 0.00 0.00 64.21 65.47 2qsf n SER 385 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2qsf n LYS 386 N -1.76 0.16 -0.13 4.33 4.76 0.65 -4.76 118.16 121.40 2qsf n LYS 386 Ca -0.02 0.06 -0.08 0.00 -2.87 0.00 0.00 58.31 55.40 2qsf n LYS 386 Cb 0.22 -0.77 -0.00 0.00 -1.84 0.00 0.00 35.03 32.63 2qsf n LYS 386 CO 0.00 0.00 0.00 0.28 -1.37 0.00 0.00 177.40 176.31 2qsf h VAL 387 N -0.29 1.13 -0.87 -0.18 2.07 -1.44 -3.21 116.25 113.46 2qsf h VAL 387 Ca -0.01 -0.30 0.23 0.00 0.82 0.00 0.00 66.70 67.43 2qsf h VAL 387 Cb 0.35 0.62 -0.15 0.00 -1.52 0.00 0.00 31.29 30.59 2qsf h VAL 387 CO -0.01 0.13 0.17 -0.09 0.02 0.00 0.00 177.57 177.80 2qsf h ARG 388 N 0.52 0.16 0.00 1.57 2.43 -1.12 0.90 114.38 118.84 2qsf h ARG 388 Ca 0.14 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.30 2qsf h ARG 388 Cb 0.01 -0.04 0.00 0.00 -0.42 0.00 0.00 29.97 29.52 2qsf h ARG 388 CO -0.03 0.10 0.00 0.36 -1.51 0.00 0.00 179.97 178.90 2qsf n LYS 389 N -5.28 0.11 0.04 0.20 -0.00 -1.21 -2.28 118.16 109.73 2qsf n LYS 389 Ca 0.21 0.32 0.11 0.00 -0.00 0.00 0.00 58.31 58.95 2qsf n LYS 389 Cb 0.67 -1.70 0.08 0.00 -0.00 0.00 0.00 35.03 34.07 2qsf n LYS 389 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.40 177.94 2qsf n ARG 390 N -1.91 0.28 -3.25 -1.58 5.12 0.29 -4.92 116.66 110.69 2qsf n ARG 390 Ca 0.03 0.02 -0.33 0.00 -1.93 0.00 0.00 57.85 55.65 2qsf n ARG 390 Cb 0.22 -1.62 -0.06 0.00 -1.16 0.00 0.00 32.46 29.85 2qsf n ARG 390 CO 0.00 0.00 0.00 1.03 -1.93 0.00 0.00 177.63 176.73 2qsf s ARG 391 N -3.18 3.94 0.31 5.56 0.52 -0.97 -4.86 118.95 120.28 2qsf s ARG 391 Ca 0.05 0.52 0.25 0.00 -0.52 0.00 0.00 55.73 56.03 2qsf s ARG 391 Cb 0.14 -2.57 1.10 0.00 0.52 0.00 0.00 34.95 34.14 2qsf s ARG 391 CO 0.77 0.25 1.75 0.97 0.02 0.00 0.00 175.30 179.07 2qsf h ILE 392 N 2.08 0.00 -0.14 1.52 6.09 -1.91 -2.47 117.51 122.68 2qsf h ILE 392 Ca -0.48 -0.21 0.00 0.00 -1.37 0.00 0.00 64.86 62.80 2qsf h ILE 392 Cb 1.17 0.94 0.00 0.00 0.47 0.00 0.00 36.82 39.40 2qsf h ILE 392 CO 0.67 0.00 0.00 1.07 -3.07 0.00 0.00 178.15 176.82 2qsf n THR 393 N -2.36 0.22 0.26 2.19 5.66 -1.26 -3.98 114.28 115.00 2qsf n THR 393 Ca 0.01 -0.20 0.14 0.00 -3.05 0.00 0.00 64.05 60.95 2qsf n THR 393 Cb 0.20 0.06 0.33 0.00 -1.55 0.00 0.00 70.33 69.37 2qsf n THR 393 CO 0.00 0.00 0.00 0.07 -3.05 0.00 0.00 175.07 172.09 2qsf h LYS 394 N 0.85 0.00 0.00 1.09 2.10 -1.59 -3.38 116.57 115.65 2qsf h LYS 394 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 2qsf h LYS 394 Cb 0.24 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.57 2qsf h LYS 394 CO 0.01 0.00 0.00 -0.40 -2.00 0.00 0.00 179.45 177.06 2qsf n ASP 395 N -3.04 0.44 -0.06 7.07 5.68 -1.26 -5.02 116.55 120.36 2qsf n ASP 395 Ca 0.03 -0.41 -0.21 0.00 -0.50 0.00 0.00 54.79 53.70 2qsf n ASP 395 Cb 0.46 0.00 -0.13 0.00 -1.14 0.00 0.00 41.12 40.31 2qsf n ASP 395 CO 0.00 0.00 0.00 -0.78 -1.33 0.00 0.00 177.20 175.09 2qsf h ASP 396 N 0.00 0.15 -0.29 -1.12 3.58 -1.91 -3.20 116.42 113.63 2qsf h ASP 396 Ca 0.00 -0.70 -0.02 0.00 0.42 0.00 0.00 57.03 56.73 2qsf h ASP 396 Cb 0.00 -0.05 -0.02 0.00 1.72 0.00 0.00 39.33 40.98 2qsf h ASP 396 CO 0.00 1.53 0.13 0.15 -2.88 0.00 0.00 179.24 178.17 2qsf h PHE 397 N -0.68 0.46 -0.03 0.28 3.57 -1.96 -1.19 116.94 117.39 2qsf h PHE 397 Ca -0.32 -0.01 -0.15 0.00 3.53 0.00 0.00 57.97 61.02 2qsf h PHE 397 Cb 1.49 -0.15 -0.01 0.00 2.79 0.00 0.00 35.95 40.07 2qsf h PHE 397 CO 0.12 0.37 -0.68 0.78 -2.23 0.00 0.00 178.31 176.66 2qsf h GLY 398 N 0.62 0.15 1.36 2.40 0.00 -1.73 0.19 103.07 106.06 2qsf h GLY 398 Ca 0.12 -0.21 -0.14 0.00 0.00 0.00 0.00 47.33 47.10 2qsf h GLY 398 CO -0.01 0.18 -0.35 -2.09 0.00 0.00 0.00 176.54 174.27 2qsf h GLU 399 N 0.09 0.71 0.05 4.80 4.57 -1.36 -0.78 114.58 122.66 2qsf h GLU 399 Ca -0.01 -0.35 -0.00 0.00 -1.18 0.00 0.00 59.36 57.82 2qsf h GLU 399 Cb 1.21 -0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.80 2qsf h GLU 399 CO 0.10 0.96 -0.02 -0.22 -1.18 0.00 0.00 179.01 178.64 2qsf h LYS 400 N 0.59 -0.07 -0.22 1.92 3.64 -1.10 -2.85 116.57 118.48 2qsf h LYS 400 Ca 0.06 0.00 0.06 0.00 -1.27 0.00 0.00 60.65 59.50 2qsf h LYS 400 Cb 0.88 0.01 -0.07 0.00 -0.41 0.00 0.00 32.23 32.65 2qsf h LYS 400 CO 0.08 0.55 -0.29 2.35 -2.27 0.00 0.00 179.45 179.88 2qsf h TRP 401 N -0.80 -0.78 -0.01 1.91 7.01 -0.64 -0.90 115.95 121.75 2qsf h TRP 401 Ca -0.01 0.04 -0.01 0.00 2.11 0.00 0.00 58.89 61.03 2qsf h TRP 401 Cb 0.65 0.37 -0.00 0.00 -2.10 0.00 0.00 29.16 28.08 2qsf h TRP 401 CO 0.15 -0.36 -0.03 0.35 -2.79 0.00 0.00 178.44 175.76 2qsf h PHE 402 N -0.31 0.01 0.00 2.65 3.57 -1.24 -1.41 116.94 120.21 2qsf h PHE 402 Ca 0.13 0.00 -0.11 0.00 3.53 0.00 0.00 57.97 61.52 2qsf h PHE 402 Cb 0.51 -0.00 -0.02 0.00 2.79 0.00 0.00 35.95 39.23 2qsf h PHE 402 CO -0.42 0.04 -0.51 -0.09 -2.23 0.00 0.00 178.31 175.10 2qsf h ARG 403 N 0.01 0.00 -0.23 1.11 9.65 -0.94 -2.48 114.38 121.50 2qsf h ARG 403 Ca 0.00 0.00 -0.18 0.00 -1.10 0.00 0.00 59.98 58.70 2qsf h ARG 403 Cb 0.06 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.64 2qsf h ARG 403 CO 0.00 0.51 -0.56 0.87 2.80 0.00 0.00 179.97 183.60 2qsf h LYS 404 N 0.00 0.79 -0.30 0.20 1.57 -0.55 -2.51 116.57 115.78 2qsf h LYS 404 Ca -0.01 -0.54 -0.02 0.00 -1.87 0.00 0.00 60.65 58.22 2qsf h LYS 404 Cb 1.07 0.08 -0.01 0.00 0.08 0.00 0.00 32.23 33.45 2qsf h LYS 404 CO 0.07 1.16 0.12 0.28 -0.57 0.00 0.00 179.45 180.51 2qsf h VAL 405 N 0.53 1.17 -0.32 0.50 2.07 -1.36 0.11 116.25 118.96 2qsf h VAL 405 Ca -0.00 -0.52 -0.08 0.00 0.82 0.00 0.00 66.70 66.91 2qsf h VAL 405 Cb 1.17 0.97 -0.02 0.00 -1.52 0.00 0.00 31.29 31.89 2qsf h VAL 405 CO 0.12 0.18 -0.15 0.40 0.02 0.00 0.00 177.57 178.14 2qsf h ILE 406 N 0.33 1.25 -0.09 4.57 2.04 -1.51 -2.77 117.51 121.33 2qsf h ILE 406 Ca 0.10 -1.13 -0.01 0.00 1.00 0.00 0.00 64.86 64.82 2qsf h ILE 406 Cb 0.17 1.17 -0.00 0.00 -0.74 0.00 0.00 36.82 37.42 2qsf h ILE 406 CO -0.01 0.37 0.03 0.74 0.00 0.00 0.00 178.15 179.28 2qsf h THR 407 N 0.52 1.17 0.00 -0.27 2.02 -1.12 0.11 112.91 115.34 2qsf h THR 407 Ca 0.09 -0.51 0.00 0.00 0.77 0.00 0.00 66.41 66.76 2qsf h THR 407 Cb 0.57 1.34 0.00 0.00 -1.74 0.00 0.00 68.15 68.32 2qsf h THR 407 CO 0.04 0.15 0.00 0.00 0.37 0.00 0.00 175.52 176.08 2qsf n ALA 408 N -2.22 1.03 0.34 6.16 0.00 -0.00 -1.36 120.51 124.46 2qsf n ALA 408 Ca -0.06 0.12 0.03 0.00 0.00 0.00 0.00 53.44 53.53 2qsf n ALA 408 Cb 0.13 -1.18 -0.04 0.00 0.00 0.00 0.00 19.45 18.36 2qsf n ALA 408 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2qsf n LEU 409 N -1.94 0.38 -4.46 0.00 4.32 -0.79 -4.89 117.00 109.63 2qsf n LEU 409 Ca -0.01 -0.51 -0.44 0.00 -0.02 0.00 0.00 56.01 55.03 2qsf n LEU 409 Cb 0.02 0.00 -0.05 0.00 -1.62 0.00 0.00 43.42 41.77 2qsf n LEU 409 CO 0.06 0.09 0.49 -2.28 -1.22 0.00 0.00 177.39 174.53 2qsf s HIS 410 N -1.65 2.94 -0.74 -1.77 2.46 0.30 -4.21 115.29 112.63 2qsf s HIS 410 Ca 0.03 -0.46 -0.00 0.00 0.47 0.00 0.00 55.06 55.10 2qsf s HIS 410 Cb 0.05 -3.80 0.37 0.00 -0.13 0.00 0.00 32.58 29.07 2qsf s HIS 410 CO 0.29 -1.21 1.79 0.72 -2.47 0.00 0.00 174.74 173.86 2qsf n HIS 411 N 6.66 3.10 -3.81 3.88 8.25 0.24 -4.91 115.22 128.62 2qsf n HIS 411 Ca -0.05 -2.54 -0.05 0.00 -0.26 0.00 0.00 57.72 54.82 2qsf n HIS 411 Cb 0.46 -0.91 -0.00 0.00 1.12 0.00 0.00 29.99 30.65 2qsf n HIS 411 CO 0.00 0.00 0.00 -0.98 0.64 0.00 0.00 176.34 176.00 2qsf s ARG 412 N -3.93 1.56 0.11 -0.41 1.70 -1.26 -4.76 118.95 111.96 2qsf s ARG 412 Ca 0.51 -0.92 0.02 0.00 -0.47 0.00 0.00 55.73 54.88 2qsf s ARG 412 Cb 0.43 0.50 -0.04 0.00 -0.57 0.00 0.00 34.95 35.27 2qsf s ARG 412 CO -0.35 -0.72 0.23 0.15 -1.08 0.00 0.00 175.30 173.53 2qsf s LYS 413 N -3.16 3.37 1.00 3.89 -0.14 -1.26 -5.03 119.74 118.40 2qsf s LYS 413 Ca 0.14 -0.56 -0.18 0.00 -1.36 0.00 0.00 55.97 54.01 2qsf s LYS 413 Cb -0.04 -2.96 -0.11 0.00 -1.68 0.00 0.00 37.83 33.04 2qsf s LYS 413 CO 0.06 0.56 -0.64 -2.13 -0.76 0.00 0.00 175.35 172.43 2qsf n ARG 414 N -0.14 -0.12 -4.07 1.68 0.63 -1.26 -5.02 116.66 108.35 2qsf n ARG 414 Ca -0.06 -0.03 -0.10 0.00 -0.92 0.00 0.00 57.85 56.74 2qsf n ARG 414 Cb 0.53 -1.19 -0.07 0.00 0.45 0.00 0.00 32.46 32.17 2qsf n ARG 414 CO 0.00 0.00 0.00 0.99 -2.51 0.00 0.00 177.63 176.11 2qsf s THR 415 N -2.08 0.01 0.23 5.15 2.01 -1.26 -5.01 115.64 114.69 2qsf s THR 415 Ca 0.43 -1.65 -0.07 0.00 0.31 0.00 0.00 61.69 60.72 2qsf s THR 415 Cb -0.15 -2.26 0.18 0.00 0.01 0.00 0.00 72.50 70.28 2qsf s THR 415 CO 0.77 -0.06 1.81 0.50 -0.69 0.00 0.00 174.62 176.96 2qsf h LYS 416 N 2.46 1.18 -0.78 4.92 3.11 -2.00 -2.01 116.57 123.46 2qsf h LYS 416 Ca -0.31 -0.19 0.10 0.00 -2.81 0.00 0.00 60.65 57.45 2qsf h LYS 416 Cb 1.25 -0.21 -0.08 0.00 -1.00 0.00 0.00 32.23 32.19 2qsf h LYS 416 CO 0.45 0.93 0.41 0.82 -2.81 0.00 0.00 179.45 179.25 2qsf h ILE 417 N 1.17 0.84 0.00 2.00 1.08 -2.00 0.17 117.51 120.77 2qsf h ILE 417 Ca 0.28 -0.23 0.00 0.00 -0.39 0.00 0.00 64.86 64.52 2qsf h ILE 417 Cb 0.16 0.11 0.00 0.00 -3.07 0.00 0.00 36.82 34.02 2qsf h ILE 417 CO -0.03 0.12 0.00 0.44 -0.69 0.00 0.00 178.15 177.99 2qsf h ASP 418 N 0.67 0.00 0.15 1.72 3.32 -1.76 -2.09 116.42 118.43 2qsf h ASP 418 Ca 0.39 0.00 -0.35 0.00 0.02 0.00 0.00 57.03 57.09 2qsf h ASP 418 Cb 0.42 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.97 2qsf h ASP 418 CO -0.28 0.00 -1.79 0.44 -1.72 0.00 0.00 179.24 175.89 2qsf h ASP 419 N 0.00 0.50 -0.71 6.45 3.32 -0.50 -2.60 116.42 122.87 2qsf h ASP 419 Ca 0.00 -0.93 0.00 0.00 0.02 0.00 0.00 57.03 56.13 2qsf h ASP 419 Cb 0.27 -0.16 -0.04 0.00 0.22 0.00 0.00 39.33 39.63 2qsf h ASP 419 CO 0.00 1.79 0.45 1.88 -1.72 0.00 0.00 179.24 181.65 2qsf h TYR 420 N 0.01 0.91 -0.10 4.55 -1.99 -0.91 -0.68 116.97 118.77 2qsf h TYR 420 Ca -0.37 0.01 -0.09 0.00 2.00 0.00 0.00 58.73 60.28 2qsf h TYR 420 Cb 2.01 -0.31 0.00 0.00 2.00 0.00 0.00 36.73 40.44 2qsf h TYR 420 CO 0.10 0.59 -0.28 1.49 -0.00 0.00 0.00 178.16 180.06 2qsf h GLU 421 N 0.97 0.37 -0.28 4.88 4.81 -1.50 -2.39 114.58 121.45 2qsf h GLU 421 Ca 0.26 -0.26 0.02 0.00 -0.13 0.00 0.00 59.36 59.25 2qsf h GLU 421 Cb -0.08 0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.32 2qsf h GLU 421 CO -0.05 0.88 0.19 -0.44 -0.73 0.00 0.00 179.01 178.85 2qsf h ASP 422 N -0.07 0.25 -0.01 1.04 3.45 -1.07 0.85 116.42 120.87 2qsf h ASP 422 Ca -0.01 -0.00 -0.00 0.00 0.43 0.00 0.00 57.03 57.45 2qsf h ASP 422 Cb 0.89 -0.06 -0.00 0.00 -0.56 0.00 0.00 39.33 39.60 2qsf h ASP 422 CO 0.06 0.18 0.00 1.56 -1.57 0.00 0.00 179.24 179.47 2qsf h GLN 423 N 0.29 0.01 -0.81 3.56 4.20 -1.04 -1.05 115.11 120.28 2qsf h GLN 423 Ca 0.11 -0.00 0.08 0.00 0.06 0.00 0.00 58.65 58.90 2qsf h GLN 423 Cb 0.09 -0.00 -0.07 0.00 0.30 0.00 0.00 27.48 27.81 2qsf h GLN 423 CO -0.02 0.31 0.48 -0.92 -0.67 0.00 0.00 178.83 178.00 2qsf h TYR 424 N -0.29 0.87 -0.30 2.96 5.03 -0.72 0.32 116.97 124.84 2qsf h TYR 424 Ca 0.00 0.03 -0.06 0.00 2.58 0.00 0.00 58.73 61.28 2qsf h TYR 424 Cb 0.30 -0.27 -0.02 0.00 1.55 0.00 0.00 36.73 38.30 2qsf h TYR 424 CO 0.03 0.39 -0.09 0.74 -1.32 0.00 0.00 178.16 177.91 2qsf h PHE 425 N 0.83 0.52 0.06 -3.82 0.05 -0.71 -2.07 116.94 111.79 2qsf h PHE 425 Ca 0.38 -0.07 -0.00 0.00 3.82 0.00 0.00 57.97 62.09 2qsf h PHE 425 Cb 0.28 -0.14 0.00 0.00 2.00 0.00 0.00 35.95 38.08 2qsf h PHE 425 CO -0.05 0.58 -0.03 0.35 -0.18 0.00 0.00 178.31 178.98 2qsf h PHE 426 N 0.46 -0.07 0.00 -0.55 3.57 0.38 -1.74 116.94 118.99 2qsf h PHE 426 Ca 0.09 -0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.58 2qsf h PHE 426 Cb 0.45 0.02 -0.00 0.00 2.79 0.00 0.00 35.95 39.21 2qsf h PHE 426 CO 0.01 0.05 -0.04 1.96 -2.23 0.00 0.00 178.31 178.06 2qsf h GLN 427 N -0.18 0.00 0.03 1.11 4.20 -0.92 -1.40 115.11 117.95 2qsf h GLN 427 Ca -0.01 0.00 -0.22 0.00 0.06 0.00 0.00 58.65 58.48 2qsf h GLN 427 Cb 0.15 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 27.91 2qsf h GLN 427 CO 0.01 0.04 -1.04 0.00 -0.67 0.00 0.00 178.83 177.18 2qsf h ARG 428 N 0.00 0.07 0.00 1.46 2.47 -0.89 -2.09 114.38 115.40 2qsf h ARG 428 Ca -0.00 -0.11 -0.01 0.00 -1.26 0.00 0.00 59.98 58.60 2qsf h ARG 428 Cb 0.20 0.04 -0.00 0.00 -1.65 0.00 0.00 29.97 28.56 2qsf h ARG 428 CO 0.01 1.04 -0.05 -0.44 0.56 0.00 0.00 179.97 181.08 2qsf h ASP 429 N 0.02 0.00 0.27 7.04 3.32 -0.39 -1.75 116.42 124.94 2qsf h ASP 429 Ca -0.04 0.00 -0.34 0.00 0.02 0.00 0.00 57.03 56.67 2qsf h ASP 429 Cb 1.79 0.00 0.01 0.00 0.22 0.00 0.00 39.33 41.35 2qsf h ASP 429 CO 0.15 0.05 -1.67 -0.33 -1.72 0.00 0.00 179.24 175.72 2qsf h GLU 430 N 0.00 0.37 0.00 3.56 5.08 -1.40 -3.37 114.58 118.82 2qsf h GLU 430 Ca -0.00 -0.63 -0.11 0.00 -1.00 0.00 0.00 59.36 57.62 2qsf h GLU 430 Cb 0.82 0.23 -0.02 0.00 0.50 0.00 0.00 28.75 30.29 2qsf h GLU 430 CO 0.01 1.27 -0.55 0.77 -1.00 0.00 0.00 179.01 179.51 2qsf h SER 431 N 0.10 0.00 -0.68 1.42 0.02 -1.28 -3.31 113.55 109.81 2qsf h SER 431 Ca -0.31 0.00 0.15 0.00 -0.84 0.00 0.00 61.79 60.79 2qsf h SER 431 Cb 2.08 0.00 -0.11 0.00 0.14 0.00 0.00 62.40 64.51 2qsf h SER 431 CO 0.18 0.55 0.07 -0.08 -1.14 0.00 0.00 176.83 176.40 2qsf h GLU 432 N 0.00 0.16 0.00 3.45 4.81 -1.48 -3.47 114.58 118.05 2qsf h GLU 432 Ca -0.01 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.21 2qsf h GLU 432 Cb 1.12 -0.04 0.00 0.00 0.63 0.00 0.00 28.75 30.46 2qsf h GLU 432 CO 0.07 0.11 0.00 0.41 -0.73 0.00 0.00 179.01 178.87 2qsf n GLY 433 N -1.37 -1.37 3.72 1.92 0.00 -1.25 -4.89 105.19 101.95 2qsf n GLY 433 Ca 0.12 -1.57 -0.42 0.00 0.00 0.00 0.00 46.02 44.14 2qsf n GLY 433 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2qsf s ILE 434 N -1.52 3.59 1.20 -0.61 1.01 -1.26 -5.02 121.20 118.58 2qsf s ILE 434 Ca 0.00 1.16 -0.17 0.00 0.00 0.00 0.00 60.65 61.64 2qsf s ILE 434 Cb 0.00 -3.74 0.29 0.00 0.01 0.00 0.00 42.46 39.01 2qsf s ILE 434 CO 0.00 0.10 1.05 -2.16 0.00 0.00 0.00 174.94 173.93 2qsf s PRO 435 N 0.89 -1.22 -0.21 2.79 0.04 -1.26 -4.98 135.00 131.04 2qsf s PRO 435 Ca 0.61 0.30 0.15 0.00 0.04 0.00 0.00 61.00 62.09 2qsf s PRO 435 Cb -0.34 -1.56 0.58 0.00 0.04 0.00 0.00 34.50 33.22 2qsf s PRO 435 CO 0.31 -3.79 1.50 -0.40 0.04 0.00 0.00 177.00 174.66 2qsf n ASP 436 N -4.88 3.99 -3.91 6.66 5.75 -1.26 -4.99 116.55 117.92 2qsf n ASP 436 Ca 0.09 -3.13 -0.10 0.00 -0.01 0.00 0.00 54.79 51.64 2qsf n ASP 436 Cb 0.58 -0.59 -0.09 0.00 -1.03 0.00 0.00 41.12 39.99 2qsf n ASP 436 CO 0.00 0.00 0.00 -0.94 -0.11 0.00 0.00 177.20 176.15 2qsf s SER 437 N -1.81 0.14 0.08 -1.12 1.04 -1.26 -4.97 113.70 105.80 2qsf s SER 437 Ca 0.45 -0.51 -0.27 0.00 0.48 0.00 0.00 55.95 56.11 2qsf s SER 437 Cb 0.37 0.25 -0.17 0.00 0.10 0.00 0.00 66.02 66.57 2qsf s SER 437 CO 0.09 -0.54 1.67 0.58 0.98 0.00 0.00 173.24 176.02 2qsf h VAL 438 N 3.54 0.76 -0.47 5.02 2.07 -1.97 -2.87 116.25 122.32 2qsf h VAL 438 Ca -0.32 -0.05 0.12 0.00 0.82 0.00 0.00 66.70 67.27 2qsf h VAL 438 Cb 1.19 0.79 -0.02 0.00 -1.52 0.00 0.00 31.29 31.72 2qsf h VAL 438 CO 0.50 0.01 0.33 0.06 0.02 0.00 0.00 177.57 178.50 2qsf h GLN 439 N -0.37 0.06 0.00 1.57 -0.00 -1.97 -0.84 115.11 113.56 2qsf h GLN 439 Ca -0.04 -0.00 -0.00 0.00 -0.00 0.00 0.00 58.65 58.61 2qsf h GLN 439 Cb 0.28 -0.01 -0.00 0.00 -0.00 0.00 0.00 27.48 27.75 2qsf h GLN 439 CO 0.06 0.04 -0.00 -0.44 -0.00 0.00 0.00 178.83 178.49 2qsf h ASP 440 N 0.07 0.00 -0.28 0.06 3.32 -1.83 -2.94 116.42 114.81 2qsf h ASP 440 Ca 0.22 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.27 2qsf h ASP 440 Cb 0.81 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.36 2qsf h ASP 440 CO -0.02 0.00 0.00 0.18 -1.72 0.00 0.00 179.24 177.68 2qsf n LEU 441 N -3.10 2.63 -4.64 1.55 4.77 -0.34 -4.56 117.00 113.31 2qsf n LEU 441 Ca 0.03 -1.12 -0.41 0.00 -0.03 0.00 0.00 56.01 54.48 2qsf n LEU 441 Cb 0.48 -0.18 -0.05 0.00 -2.33 0.00 0.00 43.42 41.33 2qsf n LEU 441 CO 0.32 0.56 0.51 -0.54 -1.33 0.00 0.00 177.39 176.91 2qsf s LYS 442 N -1.64 4.16 -1.49 3.23 3.01 -1.10 -3.94 119.74 121.97 2qsf s LYS 442 Ca 0.35 0.74 -0.11 0.00 -1.01 0.00 0.00 55.97 55.94 2qsf s LYS 442 Cb 0.20 -3.64 0.07 0.00 -1.01 0.00 0.00 37.83 33.45 2qsf s LYS 442 CO 0.29 -0.44 0.94 0.09 0.51 0.00 0.00 175.35 176.74 2qsf n ASN 443 N 5.76 -4.19 -4.82 2.83 4.13 -1.26 -4.96 115.26 112.74 2qsf n ASN 443 Ca 0.02 -0.78 -0.33 0.00 1.68 0.00 0.00 54.58 55.17 2qsf n ASN 443 Cb 0.48 -3.95 -0.07 0.00 -1.54 0.00 0.00 39.78 34.70 2qsf n ASN 443 CO 0.00 0.00 0.00 -2.28 0.28 0.00 0.00 177.26 175.26 2qsf s HIS 444 N -3.37 3.36 0.21 3.10 2.46 -1.25 -4.99 115.29 114.81 2qsf s HIS 444 Ca 0.54 1.51 0.24 0.00 0.47 0.00 0.00 55.06 57.82 2qsf s HIS 444 Cb -0.27 -2.76 1.00 0.00 -0.13 0.00 0.00 32.58 30.42 2qsf s HIS 444 CO 0.82 -0.02 1.87 -1.00 -2.47 0.00 0.00 174.74 173.94 2qsf h PRO 445 N 2.13 0.00 0.00 2.88 0.13 -1.93 -3.37 132.00 131.84 2qsf h PRO 445 Ca -0.48 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 2qsf h PRO 445 Cb 1.18 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.31 2qsf h PRO 445 CO 0.63 0.23 -0.15 0.66 -0.23 0.00 0.00 178.00 179.13 2qsf n TYR 446 N -3.48 0.00 -4.20 1.56 4.02 -1.26 -4.88 117.16 108.91 2qsf n TYR 446 Ca -0.00 0.00 -0.16 0.00 -0.01 0.00 0.00 57.90 57.72 2qsf n TYR 446 Cb 0.40 0.00 -0.11 0.00 -0.02 0.00 0.00 39.34 39.61 2qsf n TYR 446 CO 0.00 0.00 0.00 0.71 -1.01 0.00 0.00 176.86 176.56 2qsf s TYR 447 N -1.02 1.21 0.04 -0.72 1.51 -1.26 -1.30 117.35 115.82 2qsf s TYR 447 Ca 0.00 -0.59 0.00 0.00 -1.01 0.00 0.00 57.07 55.48 2qsf s TYR 447 Cb 0.00 -0.65 -0.03 0.00 -0.11 0.00 0.00 41.96 41.17 2qsf s TYR 447 CO 0.00 0.07 -0.04 0.08 -1.11 0.00 0.00 175.55 174.55 2qsf s VAL 448 N -2.16 0.27 0.06 0.71 1.01 0.35 -4.18 120.40 116.46 2qsf s VAL 448 Ca 0.06 -1.28 -0.13 0.00 0.00 0.00 0.00 61.98 60.63 2qsf s VAL 448 Cb -0.05 -0.80 -0.06 0.00 0.00 0.00 0.00 36.38 35.47 2qsf s VAL 448 CO 0.02 -0.65 0.43 -0.76 0.00 0.00 0.00 175.10 174.13 2qsf s LEU 449 N -2.03 4.40 0.37 3.92 1.43 -1.26 -0.18 118.68 125.33 2qsf s LEU 449 Ca -0.06 0.91 0.18 0.00 -1.03 0.00 0.00 54.13 54.13 2qsf s LEU 449 Cb -0.04 -2.87 1.15 0.00 0.03 0.00 0.00 46.19 44.46 2qsf s LEU 449 CO -0.04 0.22 1.68 -0.08 0.23 0.00 0.00 176.35 178.36 2qsf h GLU 450 N 4.10 0.29 0.00 1.70 4.81 -1.71 0.23 114.58 124.01 2qsf h GLU 450 Ca -0.50 -0.02 -0.06 0.00 -0.13 0.00 0.00 59.36 58.65 2qsf h GLU 450 Cb 1.20 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 30.51 2qsf h GLU 450 CO 0.64 0.19 -0.29 1.96 -0.73 0.00 0.00 179.01 180.79 2qsf h GLN 451 N 0.30 0.00 -0.01 1.92 4.20 -1.93 -2.80 115.11 116.79 2qsf h GLN 451 Ca 0.72 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.43 2qsf h GLN 451 Cb 1.80 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.58 2qsf h GLN 451 CO -0.51 0.29 -0.07 -0.25 -0.67 0.00 0.00 178.83 177.61 2qsf n ASP 452 N -3.93 0.93 -4.65 1.46 8.00 0.81 -4.81 116.55 114.36 2qsf n ASP 452 Ca -0.02 -1.09 -0.43 0.00 0.71 0.00 0.00 54.79 53.96 2qsf n ASP 452 Cb 0.36 0.01 -0.02 0.00 -0.02 0.00 0.00 41.12 41.44 2qsf n ASP 452 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 2qsf s ILE 453 N -2.20 3.81 0.90 0.53 1.01 -1.06 -4.93 121.20 119.27 2qsf s ILE 453 Ca 0.35 0.97 -0.11 0.00 0.00 0.00 0.00 60.65 61.86 2qsf s ILE 453 Cb 0.21 -3.68 0.14 0.00 0.01 0.00 0.00 42.46 39.13 2qsf s ILE 453 CO 0.41 -0.15 1.14 0.29 0.00 0.00 0.00 174.94 176.62 2qsf n LYS 454 N 7.14 -0.37 0.24 2.79 4.76 -1.26 -4.89 118.16 126.57 2qsf n LYS 454 Ca 0.17 -0.04 0.16 0.00 -2.87 0.00 0.00 58.31 55.73 2qsf n LYS 454 Cb 0.44 -2.38 0.71 0.00 -1.84 0.00 0.00 35.03 31.96 2qsf n LYS 454 CO 0.00 0.00 0.00 0.37 -1.37 0.00 0.00 177.40 176.40 2qsf h GLN 455 N -1.75 0.00 -0.65 1.97 4.15 -1.97 -1.84 115.11 115.02 2qsf h GLN 455 Ca -0.43 0.00 0.00 0.00 0.77 0.00 0.00 58.65 58.99 2qsf h GLN 455 Cb 1.27 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.96 2qsf h GLN 455 CO 0.42 0.00 0.00 0.25 -1.93 0.00 0.00 178.83 177.57 2qsf n THR 456 N -2.83 2.18 -4.29 2.39 -2.24 -1.26 -4.92 114.28 103.31 2qsf n THR 456 Ca 0.00 -1.15 -0.16 0.00 -2.27 0.00 0.00 64.05 60.48 2qsf n THR 456 Cb 0.24 -0.24 -0.10 0.00 -2.10 0.00 0.00 70.33 68.13 2qsf n THR 456 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 2qsf s GLN 457 N -2.35 1.24 0.07 -0.78 -0.21 -0.69 -0.40 119.66 116.53 2qsf s GLN 457 Ca 0.46 -1.61 -0.22 0.00 0.02 0.00 0.00 55.36 54.01 2qsf s GLN 457 Cb 0.34 -0.50 0.05 0.00 1.00 0.00 0.00 33.01 33.90 2qsf s GLN 457 CO 0.15 -0.10 0.52 0.96 -2.12 0.00 0.00 175.29 174.70 2qsf s ILE 458 N -3.49 0.03 0.11 1.08 -4.36 -0.76 -4.85 121.20 108.96 2qsf s ILE 458 Ca 0.26 -0.24 -0.31 0.00 -0.26 0.00 0.00 60.65 60.10 2qsf s ILE 458 Cb 0.06 -1.00 -0.07 0.00 1.25 0.00 0.00 42.46 42.69 2qsf s ILE 458 CO 0.07 -0.13 1.23 -0.69 0.24 0.00 0.00 174.94 175.65 2qsf s VAL 459 N -2.79 3.76 0.57 8.37 1.01 -1.26 -0.58 120.40 129.49 2qsf s VAL 459 Ca -0.03 1.32 -0.20 0.00 0.00 0.00 0.00 61.98 63.07 2qsf s VAL 459 Cb -0.00 -3.85 -0.04 0.00 0.00 0.00 0.00 36.38 32.49 2qsf s VAL 459 CO -0.04 0.13 1.25 -0.54 0.00 0.00 0.00 175.10 175.90 2qsf s LYS 460 N 0.69 3.05 0.34 2.72 1.02 -0.18 -4.87 119.74 122.50 2qsf s LYS 460 Ca 0.58 1.95 -0.29 0.00 0.02 0.00 0.00 55.97 58.23 2qsf s LYS 460 Cb -0.32 -2.05 -0.11 0.00 -0.52 0.00 0.00 37.83 34.83 2qsf s LYS 460 CO 0.32 -1.17 1.39 -1.25 -0.92 0.00 0.00 175.35 173.71 2qsf s PRO 461 N -3.16 4.26 0.00 -1.68 0.04 -1.26 -2.63 135.00 130.57 2qsf s PRO 461 Ca 0.75 2.35 0.00 0.00 0.04 0.00 0.00 61.00 64.14 2qsf s PRO 461 Cb -0.34 -3.04 0.00 0.00 0.04 0.00 0.00 34.50 31.16 2qsf s PRO 461 CO 0.38 -0.34 0.00 0.41 0.04 0.00 0.00 177.00 177.49 2qsf n GLY 462 N 0.89 0.59 3.15 0.56 0.00 -1.26 -5.05 105.19 104.08 2qsf n GLY 462 Ca 0.01 -0.14 -0.23 0.00 0.00 0.00 0.00 46.02 45.66 2qsf n GLY 462 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qsf n LYS 464 N 2.55 2.00 -1.76 0.00 2.85 -1.26 -4.78 118.16 117.75 2qsf n LYS 464 Ca -0.15 0.00 -0.34 0.00 -1.05 0.00 0.00 58.31 56.77 2qsf n LYS 464 Cb 0.54 0.00 0.05 0.00 -0.65 0.00 0.00 35.03 34.98 2qsf n LYS 464 CO 0.00 0.00 0.00 -1.21 -0.05 0.00 0.00 177.40 176.14 2qsf s GLU 465 N 1.51 2.67 -0.02 -1.58 8.01 -1.26 -4.76 118.70 123.27 2qsf s GLU 465 Ca 0.00 1.66 0.21 0.00 0.01 0.00 0.00 54.97 56.84 2qsf s GLU 465 Cb 0.00 -1.91 -0.25 0.00 -4.31 0.00 0.00 34.13 27.66 2qsf s GLU 465 CO 0.00 -1.40 0.52 0.00 0.01 0.00 0.00 175.26 174.39 2qsf n GLY 467 N 1.36 -1.50 3.39 0.00 0.00 -1.06 -5.02 105.19 102.36 2qsf n GLY 467 Ca -0.10 -1.03 -0.20 0.00 0.00 0.00 0.00 46.02 44.70 2qsf n GLY 467 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2qsf s TYR 468 N -2.57 1.79 -0.11 1.61 1.51 -1.26 -0.75 117.35 117.57 2qsf s TYR 468 Ca 0.00 -0.89 -0.03 0.00 -1.01 0.00 0.00 57.07 55.13 2qsf s TYR 468 Cb 0.00 -1.09 0.05 0.00 -0.11 0.00 0.00 41.96 40.82 2qsf s TYR 468 CO 0.00 0.04 0.14 -1.17 -1.11 0.00 0.00 175.55 173.45 2qsf s LEU 469 N -3.40 0.03 -0.27 -1.29 1.98 -0.48 -4.91 118.68 110.34 2qsf s LEU 469 Ca 0.32 0.05 -0.15 0.00 -2.89 0.00 0.00 54.13 51.46 2qsf s LEU 469 Cb 0.06 0.12 -0.03 0.00 0.66 0.00 0.00 46.19 47.00 2qsf s LEU 469 CO 0.12 -0.27 0.39 -0.75 -1.89 0.00 0.00 176.35 173.94 2qsf s LYS 470 N 2.25 3.99 -0.46 1.98 2.20 -1.26 -0.29 119.74 128.15 2qsf s LYS 470 Ca 0.04 0.04 -0.28 0.00 -0.36 0.00 0.00 55.97 55.40 2qsf s LYS 470 Cb -0.13 -3.67 0.01 0.00 -1.51 0.00 0.00 37.83 32.53 2qsf s LYS 470 CO -0.07 -0.30 1.41 0.08 -0.36 0.00 0.00 175.35 176.11 2qsf s VAL 471 N 2.09 3.87 0.97 4.02 1.01 0.33 -4.97 120.40 127.73 2qsf s VAL 471 Ca 0.15 0.85 -0.12 0.00 0.00 0.00 0.00 61.98 62.86 2qsf s VAL 471 Cb -0.16 -4.27 0.10 0.00 0.00 0.00 0.00 36.38 32.05 2qsf s VAL 471 CO 0.10 -0.87 0.69 1.41 0.00 0.00 0.00 175.10 176.42 2qsf n HIS 472 N 9.06 -0.61 0.00 5.22 -0.00 -1.26 -3.36 115.22 124.27 2qsf n HIS 472 Ca 0.15 0.25 0.00 0.00 -0.00 0.00 0.00 57.72 58.13 2qsf n HIS 472 Cb 0.48 -1.83 0.00 0.00 -0.00 0.00 0.00 29.99 28.64 2qsf n HIS 472 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 2qsf n GLY 473 N 1.06 2.69 0.24 -1.41 0.00 -1.26 -4.48 105.19 102.03 2qsf n GLY 473 Ca 0.08 -2.06 -0.14 0.00 0.00 0.00 0.00 46.02 43.90 2qsf n GLY 473 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 2qsf h LYS 474 N 0.00 -0.43 -1.76 1.61 1.63 -2.06 -2.36 116.57 113.20 2qsf h LYS 474 Ca 0.00 0.03 -0.53 0.00 -0.85 0.00 0.00 60.65 59.30 2qsf h LYS 474 Cb 0.00 0.10 -0.20 0.00 -0.60 0.00 0.00 32.23 31.53 2qsf h LYS 474 CO 0.00 -0.28 0.58 1.33 -3.45 0.00 0.00 179.45 177.63 2qsf n VAL 475 N -5.33 3.29 -3.10 2.00 0.24 -1.26 -4.95 118.33 109.22 2qsf n VAL 475 Ca -0.08 -2.92 -0.39 0.00 -2.04 0.00 0.00 64.34 58.91 2qsf n VAL 475 Cb 0.24 -1.42 -0.05 0.00 -1.47 0.00 0.00 33.84 31.14 2qsf n VAL 475 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 2qsf s GLY 476 N -0.23 2.55 0.18 7.63 0.00 -0.89 -5.06 107.32 111.50 2qsf s GLY 476 Ca 0.52 0.05 0.05 0.00 0.00 0.00 0.00 44.72 45.34 2qsf s GLY 476 CO -0.18 1.11 0.17 0.54 0.00 0.00 0.00 173.10 174.73 2qsf s LYS 477 N 0.82 2.97 -0.17 2.90 1.02 -1.21 -4.81 119.74 121.25 2qsf s LYS 477 Ca 0.35 -0.88 -0.14 0.00 0.02 0.00 0.00 55.97 55.32 2qsf s LYS 477 Cb -0.17 -2.66 -0.05 0.00 -0.52 0.00 0.00 37.83 34.43 2qsf s LYS 477 CO 0.16 0.47 0.30 0.08 -0.92 0.00 0.00 175.35 175.44 2qsf s VAL 478 N -1.83 5.29 -0.05 3.17 1.01 -1.26 -0.51 120.40 126.21 2qsf s VAL 478 Ca 0.32 0.55 0.01 0.00 0.00 0.00 0.00 61.98 62.86 2qsf s VAL 478 Cb -0.10 -3.64 -0.03 0.00 0.00 0.00 0.00 36.38 32.61 2qsf s VAL 478 CO 0.24 0.36 -0.07 -0.76 0.00 0.00 0.00 175.10 174.87 2qsf s LEU 479 N 0.67 3.17 0.11 3.92 1.43 0.60 -4.95 118.68 123.63 2qsf s LEU 479 Ca 0.16 -0.05 -0.23 0.00 -1.03 0.00 0.00 54.13 52.98 2qsf s LEU 479 Cb -0.13 -1.72 -0.07 0.00 0.03 0.00 0.00 46.19 44.30 2qsf s LEU 479 CO 0.05 0.34 0.69 -0.54 0.23 0.00 0.00 176.35 177.12 2qsf s LYS 480 N -0.95 4.42 -0.11 1.70 1.02 -1.26 -1.38 119.74 123.17 2qsf s LYS 480 Ca 0.14 0.98 0.02 0.00 0.02 0.00 0.00 55.97 57.12 2qsf s LYS 480 Cb -0.11 -3.28 -0.01 0.00 -0.52 0.00 0.00 37.83 33.92 2qsf s LYS 480 CO 0.03 0.54 -0.19 0.08 -0.92 0.00 0.00 175.35 174.89 2qsf s VAL 481 N -0.90 2.54 0.18 3.17 1.01 0.07 -1.68 120.40 124.79 2qsf s VAL 481 Ca 0.34 -0.85 0.08 0.00 0.00 0.00 0.00 61.98 61.55 2qsf s VAL 481 Cb -0.21 -2.02 -0.04 0.00 0.00 0.00 0.00 36.38 34.11 2qsf s VAL 481 CO 0.23 0.54 -0.06 -0.31 0.00 0.00 0.00 175.10 175.50 2qsf s TYR 482 N 0.33 2.71 0.18 5.22 1.51 0.75 0.64 117.35 128.69 2qsf s TYR 482 Ca -0.15 -0.19 -0.29 0.00 -1.01 0.00 0.00 57.07 55.43 2qsf s TYR 482 Cb -0.17 -1.32 -0.08 0.00 -0.11 0.00 0.00 41.96 40.29 2qsf s TYR 482 CO 0.07 0.52 0.92 0.00 -1.11 0.00 0.00 175.55 175.95 2qsf s ALA 483 N -1.72 3.32 0.45 3.71 0.00 -1.26 -0.49 121.76 125.77 2qsf s ALA 483 Ca 0.26 0.56 0.18 0.00 0.00 0.00 0.00 51.96 52.96 2qsf s ALA 483 Cb -0.09 -3.20 1.13 0.00 0.00 0.00 0.00 23.12 20.97 2qsf s ALA 483 CO 0.16 0.14 2.02 0.87 0.00 0.00 0.00 175.76 178.95 2qsf h LYS 484 N 4.69 0.00 0.00 0.00 1.57 -1.51 -1.77 116.57 119.55 2qsf h LYS 484 Ca -0.44 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.34 2qsf h LYS 484 Cb 1.20 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.51 2qsf h LYS 484 CO 0.69 0.16 0.00 -2.13 -0.57 0.00 0.00 179.45 177.60 2qsf n ARG 485 N -4.17 0.13 -0.22 3.15 0.63 -1.26 -1.05 116.66 113.87 2qsf n ARG 485 Ca -0.02 0.62 0.06 0.00 -0.92 0.00 0.00 57.85 57.59 2qsf n ARG 485 Cb 0.23 -1.92 0.18 0.00 0.45 0.00 0.00 32.46 31.40 2qsf n ARG 485 CO 0.00 0.00 0.00 -0.25 -2.51 0.00 0.00 177.63 174.87 2qsf n ASP 486 N -2.20 3.11 -4.58 6.15 8.00 -0.66 -4.94 116.55 121.43 2qsf n ASP 486 Ca -0.01 -2.10 -0.34 0.00 0.71 0.00 0.00 54.79 53.04 2qsf n ASP 486 Cb 0.04 -0.28 -0.11 0.00 -0.02 0.00 0.00 41.12 40.75 2qsf n ASP 486 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 2qsf s ILE 487 N -1.19 4.20 -0.08 0.53 -1.09 -0.22 -1.01 121.20 122.33 2qsf s ILE 487 Ca 0.27 -0.26 -0.01 0.00 -2.23 0.00 0.00 60.65 58.42 2qsf s ILE 487 Cb 0.15 -2.83 -0.03 0.00 -1.58 0.00 0.00 42.46 38.18 2qsf s ILE 487 CO 0.16 0.52 -0.04 0.00 -1.23 0.00 0.00 174.94 174.35 2qsf s ALA 488 N -0.03 3.08 -0.16 9.38 0.00 0.25 -4.90 121.76 129.38 2qsf s ALA 488 Ca 0.03 -0.85 -0.20 0.00 0.00 0.00 0.00 51.96 50.94 2qsf s ALA 488 Cb -0.13 -1.35 -0.03 0.00 0.00 0.00 0.00 23.12 21.61 2qsf s ALA 488 CO 0.02 0.53 0.56 -0.51 0.00 0.00 0.00 175.76 176.36 2qsf s ASP 489 N -0.69 6.67 0.08 0.00 1.01 -1.26 -1.83 116.67 120.66 2qsf s ASP 489 Ca 0.11 0.81 0.03 0.00 0.71 0.00 0.00 52.55 54.21 2qsf s ASP 489 Cb -0.11 -2.32 -0.04 0.00 1.01 0.00 0.00 42.92 41.46 2qsf s ASP 489 CO 0.02 -0.15 0.07 -0.76 0.21 0.00 0.00 175.17 174.55 2qsf s LEU 490 N 1.36 3.75 0.02 1.23 1.43 0.46 -4.62 118.68 122.31 2qsf s LEU 490 Ca 0.27 -0.04 -0.02 0.00 -1.03 0.00 0.00 54.13 53.31 2qsf s LEU 490 Cb -0.16 -2.44 -0.01 0.00 0.03 0.00 0.00 46.19 43.61 2qsf s LEU 490 CO 0.11 0.17 0.02 -0.54 0.23 0.00 0.00 176.35 176.34 2qsf s LYS 491 N -2.39 0.38 1.07 1.70 1.02 -0.73 -4.79 119.74 116.00 2qsf s LYS 491 Ca 0.29 -0.58 -0.15 0.00 0.02 0.00 0.00 55.97 55.55 2qsf s LYS 491 Cb -0.12 0.14 0.22 0.00 -0.52 0.00 0.00 37.83 37.56 2qsf s LYS 491 CO 0.21 -0.07 1.10 -1.54 -0.92 0.00 0.00 175.35 174.13 2qsf s SER 492 N -1.52 2.04 0.28 2.83 1.04 -1.26 -1.04 113.70 116.07 2qsf s SER 492 Ca -0.14 0.99 -0.03 0.00 0.48 0.00 0.00 55.95 57.24 2qsf s SER 492 Cb -0.08 -1.53 0.37 0.00 0.10 0.00 0.00 66.02 64.88 2qsf s SER 492 CO -0.01 -3.47 1.93 0.00 0.98 0.00 0.00 173.24 172.67 2qsf h ALA 493 N -2.13 1.32 -0.17 5.32 0.00 -1.99 -1.24 119.26 120.38 2qsf h ALA 493 Ca -0.52 -0.09 -0.03 0.00 0.00 0.00 0.00 54.91 54.27 2qsf h ALA 493 Cb 1.32 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 18.77 2qsf h ALA 493 CO 0.51 0.59 -0.00 -0.09 0.00 0.00 0.00 179.25 180.25 2qsf h ARG 494 N 1.15 0.30 -0.77 0.00 9.65 -1.94 -2.49 114.38 120.28 2qsf h ARG 494 Ca 0.30 -0.10 0.05 0.00 -1.10 0.00 0.00 59.98 59.13 2qsf h ARG 494 Cb -0.06 -0.03 -0.05 0.00 -1.39 0.00 0.00 29.97 28.45 2qsf h ARG 494 CO -0.06 0.52 0.51 1.96 2.80 0.00 0.00 179.97 185.70 2qsf h GLN 495 N 0.05 0.87 0.00 0.20 4.20 -1.81 -0.30 115.11 118.32 2qsf h GLN 495 Ca 0.05 -0.05 -0.10 0.00 0.06 0.00 0.00 58.65 58.61 2qsf h GLN 495 Cb 0.39 -0.20 -0.01 0.00 0.30 0.00 0.00 27.48 27.96 2qsf h GLN 495 CO 0.01 0.58 -0.46 -1.49 -0.67 0.00 0.00 178.83 176.80 2qsf h TRP 496 N 0.90 0.00 -0.34 2.96 4.06 -1.11 -2.53 115.95 119.90 2qsf h TRP 496 Ca 0.32 0.00 -0.10 0.00 2.06 0.00 0.00 58.89 61.17 2qsf h TRP 496 Cb 0.12 0.00 -0.02 0.00 -1.00 0.00 0.00 29.16 28.27 2qsf h TRP 496 CO -0.00 0.46 -0.19 -0.92 -3.56 0.00 0.00 178.44 174.23 2qsf h TYR 497 N 0.00 0.69 0.00 0.49 3.20 -0.61 0.08 116.97 120.82 2qsf h TYR 497 Ca -0.00 -0.14 0.00 0.00 3.14 0.00 0.00 58.73 61.73 2qsf h TYR 497 Cb 0.83 -0.17 0.00 0.00 1.54 0.00 0.00 36.73 38.93 2qsf h TYR 497 CO 0.00 0.77 0.00 -1.33 -1.64 0.00 0.00 178.16 175.96 2qsf n MET 498 N -4.14 0.15 -0.03 1.82 2.81 -0.77 -0.24 117.12 116.72 2qsf n MET 498 Ca 0.00 0.18 0.01 0.00 -1.81 0.00 0.00 57.70 56.08 2qsf n MET 498 Cb 0.39 -1.50 0.03 0.00 -0.71 0.00 0.00 33.22 31.43 2qsf n MET 498 CO 0.00 0.00 0.00 0.09 1.51 0.00 0.00 175.97 177.57 2qsf n ASN 499 N -1.26 1.98 -1.24 7.83 4.13 -0.36 -4.72 115.26 121.61 2qsf n ASN 499 Ca 0.05 -1.77 -0.07 0.00 1.68 0.00 0.00 54.58 54.46 2qsf n ASN 499 Cb 0.07 -0.04 0.02 0.00 -1.54 0.00 0.00 39.78 38.29 2qsf n ASN 499 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2qsf n GLY 500 N -0.14 0.40 3.09 7.41 0.00 0.67 -4.87 105.19 111.74 2qsf n GLY 500 Ca 0.03 -0.46 -0.14 0.00 0.00 0.00 0.00 46.02 45.45 2qsf n GLY 500 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2qsf s ARG 501 N -5.11 0.60 0.16 1.61 0.52 -0.13 -0.90 118.95 115.70 2qsf s ARG 501 Ca 0.13 -0.81 0.07 0.00 -0.52 0.00 0.00 55.73 54.60 2qsf s ARG 501 Cb -0.06 -0.41 -0.04 0.00 0.52 0.00 0.00 34.95 34.96 2qsf s ARG 501 CO 0.16 0.08 -0.15 0.96 0.02 0.00 0.00 175.30 176.37 2qsf s ILE 502 N -1.38 1.60 0.23 1.52 -4.36 0.27 -2.88 121.20 116.20 2qsf s ILE 502 Ca -0.08 -1.97 -0.30 0.00 -0.26 0.00 0.00 60.65 58.04 2qsf s ILE 502 Cb -0.10 -1.82 -0.09 0.00 1.25 0.00 0.00 42.46 41.70 2qsf s ILE 502 CO 0.01 -0.47 1.20 -0.76 0.24 0.00 0.00 174.94 175.16 2qsf s LEU 503 N -2.86 4.47 0.77 0.37 1.43 -1.26 0.71 118.68 122.31 2qsf s LEU 503 Ca 0.16 2.33 -0.11 0.00 -1.03 0.00 0.00 54.13 55.48 2qsf s LEU 503 Cb -0.03 -3.62 0.06 0.00 0.03 0.00 0.00 46.19 42.63 2qsf s LEU 503 CO 0.05 -0.36 1.10 -0.54 0.23 0.00 0.00 176.35 176.84 2qsf s LYS 504 N -0.72 2.18 0.17 1.70 1.02 -0.73 -4.82 119.74 118.54 2qsf s LYS 504 Ca 0.51 1.26 -0.16 0.00 0.02 0.00 0.00 55.97 57.60 2qsf s LYS 504 Cb -0.34 -1.88 0.11 0.00 -0.52 0.00 0.00 37.83 35.20 2qsf s LYS 504 CO 0.40 -1.71 1.69 1.15 -0.92 0.00 0.00 175.35 175.96 2qsf h THR 505 N -1.04 0.68 -3.45 2.17 2.02 -1.95 -3.26 112.91 108.08 2qsf h THR 505 Ca -0.44 -0.03 -0.78 0.00 0.77 0.00 0.00 66.41 65.93 2qsf h THR 505 Cb 1.24 0.58 -0.25 0.00 -1.74 0.00 0.00 68.15 67.98 2qsf h THR 505 CO 0.50 0.02 0.41 -0.83 0.37 0.00 0.00 175.52 175.99 2qsf s GLY 506 N -2.96 2.79 -0.06 2.16 0.00 -1.26 -4.99 107.32 103.00 2qsf s GLY 506 Ca -0.13 -3.47 -0.03 0.00 0.00 0.00 0.00 44.72 41.09 2qsf s GLY 506 CO 0.71 1.42 0.13 -0.56 0.00 0.00 0.00 173.10 174.81 2qsf s SER 507 N 2.04 0.17 -0.08 1.64 0.01 -1.23 -5.06 113.70 111.19 2qsf s SER 507 Ca 0.26 0.26 0.03 0.00 1.31 0.00 0.00 55.95 57.81 2qsf s SER 507 Cb -0.09 0.16 -0.02 0.00 0.21 0.00 0.00 66.02 66.28 2qsf s SER 507 CO -0.08 -0.17 -0.15 -0.60 0.41 0.00 0.00 173.24 172.64 2qsf s ARG 508 N 1.47 2.78 1.04 12.44 6.06 -1.26 -5.02 118.95 136.46 2qsf s ARG 508 Ca -0.06 -0.72 -0.13 0.00 -2.50 0.00 0.00 55.73 52.32 2qsf s ARG 508 Cb -0.12 -2.42 0.17 0.00 0.06 0.00 0.00 34.95 32.63 2qsf s ARG 508 CO -0.05 0.46 0.77 0.00 -2.50 0.00 0.00 175.30 173.98 2qsf n LYS 510 N -3.62 0.72 -3.60 0.00 4.01 0.18 -4.98 118.16 110.87 2qsf n LYS 510 Ca 0.06 -0.07 -0.06 0.00 -0.51 0.00 0.00 58.31 57.74 2qsf n LYS 510 Cb 0.55 -1.41 -0.02 0.00 -0.51 0.00 0.00 35.03 33.63 2qsf n LYS 510 CO 0.00 0.00 0.00 0.21 -1.11 0.00 0.00 177.40 176.50 2qsf s LYS 511 N -2.99 0.83 -0.24 1.97 2.20 -1.21 -5.04 119.74 115.25 2qsf s LYS 511 Ca 0.02 -0.37 -0.03 0.00 -0.36 0.00 0.00 55.97 55.22 2qsf s LYS 511 Cb 0.13 0.34 0.08 0.00 -1.51 0.00 0.00 37.83 36.87 2qsf s LYS 511 CO 0.78 -0.37 0.09 0.08 -0.36 0.00 0.00 175.35 175.57 2qsf s VAL 512 N -3.02 0.29 0.02 4.02 1.01 -1.26 -1.34 120.40 120.12 2qsf s VAL 512 Ca 0.08 -0.68 -0.17 0.00 0.00 0.00 0.00 61.98 61.21 2qsf s VAL 512 Cb -0.01 -1.03 -0.06 0.00 0.00 0.00 0.00 36.38 35.28 2qsf s VAL 512 CO -0.05 -0.46 0.47 0.27 0.00 0.00 0.00 175.10 175.34 2qsf s ILE 513 N 1.94 4.93 0.61 2.22 -4.36 -0.78 -4.93 121.20 120.83 2qsf s ILE 513 Ca 0.04 0.99 -0.00 0.00 -0.26 0.00 0.00 60.65 61.42 2qsf s ILE 513 Cb -0.17 -3.79 0.06 0.00 1.25 0.00 0.00 42.46 39.81 2qsf s ILE 513 CO -0.19 0.55 0.85 -0.75 0.24 0.00 0.00 174.94 175.64 2qsf s LYS 514 N -0.96 2.32 0.15 0.37 2.20 -1.26 -1.33 119.74 121.23 2qsf s LYS 514 Ca 0.26 -0.77 0.00 0.00 -0.36 0.00 0.00 55.97 55.10 2qsf s LYS 514 Cb -0.18 -2.41 0.00 0.00 -1.51 0.00 0.00 37.83 33.73 2qsf s LYS 514 CO 0.15 -0.93 0.00 -2.13 -0.36 0.00 0.00 175.35 172.08 2qsf n ARG 515 N -2.53 0.00 -4.38 4.03 0.00 -1.26 -4.84 116.66 107.69 2qsf n ARG 515 Ca 0.09 0.00 -0.19 0.00 -0.00 0.00 0.00 57.85 57.75 2qsf n ARG 515 Cb 0.60 -0.34 -0.14 0.00 0.00 0.00 0.00 32.46 32.58 2qsf n ARG 515 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.63 177.12 2qsf s ASP 528 N -5.62 1.38 -0.04 6.15 -0.00 -1.26 -5.33 116.67 111.95 2qsf s ASP 528 Ca 0.00 -0.33 0.01 0.00 -0.00 0.00 0.00 52.55 52.23 2qsf s ASP 528 Cb 0.00 -0.11 -0.03 0.00 -0.00 0.00 0.00 42.92 42.78 2qsf s ASP 528 CO 0.00 0.06 -0.03 -1.61 -0.00 0.00 0.00 175.17 173.59 2qsf s GLU 529 N -0.73 2.78 -0.14 8.23 2.02 -0.44 -5.02 118.70 125.39 2qsf s GLU 529 Ca 0.02 -0.57 -0.06 0.00 0.02 0.00 0.00 54.97 54.39 2qsf s GLU 529 Cb -0.06 -2.65 -0.04 0.00 0.10 0.00 0.00 34.13 31.48 2qsf s GLU 529 CO 0.00 0.65 0.05 1.03 0.02 0.00 0.00 175.26 177.02 2qsf s ARG 530 N -1.20 3.58 -0.03 1.61 0.52 -1.26 -1.87 118.95 120.30 2qsf s ARG 530 Ca 0.16 -0.33 0.04 0.00 -0.52 0.00 0.00 55.73 55.08 2qsf s ARG 530 Cb -0.11 -3.08 -0.03 0.00 0.52 0.00 0.00 34.95 32.25 2qsf s ARG 530 CO 0.06 0.49 -0.13 -0.51 0.02 0.00 0.00 175.30 175.23 2qsf s LEU 531 N -0.25 2.83 0.45 2.53 1.43 -0.45 -4.13 118.68 121.09 2qsf s LEU 531 Ca 0.08 -0.20 0.03 0.00 -1.03 0.00 0.00 54.13 53.01 2qsf s LEU 531 Cb -0.12 -1.60 -0.03 0.00 0.03 0.00 0.00 46.19 44.47 2qsf s LEU 531 CO 0.02 0.33 0.05 -0.31 0.23 0.00 0.00 176.35 176.66 2qsf s TYR 532 N -0.81 1.92 0.39 0.29 1.51 -0.21 -0.65 117.35 119.80 2qsf s TYR 532 Ca 0.13 -1.03 0.08 0.00 -1.01 0.00 0.00 57.07 55.24 2qsf s TYR 532 Cb -0.11 -1.46 -0.06 0.00 -0.11 0.00 0.00 41.96 40.22 2qsf s TYR 532 CO 0.02 0.07 0.09 -1.54 -1.11 0.00 0.00 175.55 173.08 2qsf s SER 533 N -3.74 4.22 0.45 2.29 1.04 -1.26 -1.77 113.70 114.93 2qsf s SER 533 Ca 0.17 -1.11 0.24 0.00 0.48 0.00 0.00 55.95 55.73 2qsf s SER 533 Cb 0.03 -0.48 1.25 0.00 0.10 0.00 0.00 66.02 66.93 2qsf s SER 533 CO 0.09 -0.42 1.81 0.15 0.98 0.00 0.00 173.24 175.84 2qsf h PHE 534 N 1.63 0.41 0.00 5.02 3.57 -1.95 0.20 116.94 125.82 2qsf h PHE 534 Ca -0.43 0.01 -0.08 0.00 3.53 0.00 0.00 57.97 61.00 2qsf h PHE 534 Cb 1.25 -0.12 -0.01 0.00 2.79 0.00 0.00 35.95 39.86 2qsf h PHE 534 CO 0.68 0.05 -0.37 0.93 -2.23 0.00 0.00 178.31 177.36 2qsf h GLU 535 N 0.25 0.00 -0.03 1.11 3.07 -1.99 -2.68 114.58 114.30 2qsf h GLU 535 Ca 0.55 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.41 2qsf h GLU 535 Cb 1.66 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.57 2qsf h GLU 535 CO -0.18 0.37 0.00 -0.25 -1.40 0.00 0.00 179.01 177.56 2qsf n ASP 536 N -3.51 0.49 -4.55 1.42 8.00 0.06 -4.86 116.55 113.60 2qsf n ASP 536 Ca -0.00 -1.38 -0.24 0.00 0.71 0.00 0.00 54.79 53.88 2qsf n ASP 536 Cb 0.52 -0.02 -0.09 0.00 -0.02 0.00 0.00 41.12 41.51 2qsf n ASP 536 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 2qsf s THR 537 N -1.96 2.89 0.16 -3.53 -4.23 -1.01 -1.78 115.64 106.18 2qsf s THR 537 Ca 0.35 -2.19 0.07 0.00 -1.18 0.00 0.00 61.69 58.74 2qsf s THR 537 Cb 0.17 -2.55 -0.04 0.00 1.34 0.00 0.00 72.50 71.42 2qsf s THR 537 CO 0.27 -0.38 -0.14 -0.70 -0.54 0.00 0.00 174.62 173.13 2qsf s GLU 538 N -3.59 1.17 0.23 3.99 2.12 0.22 -4.80 118.70 118.04 2qsf s GLU 538 Ca 0.31 -1.42 -0.30 0.00 0.36 0.00 0.00 54.97 53.92 2qsf s GLU 538 Cb -0.05 -0.98 -0.09 0.00 0.26 0.00 0.00 34.13 33.26 2qsf s GLU 538 CO 0.17 0.17 1.25 -1.17 -0.54 0.00 0.00 175.26 175.15 2qsf s LEU 539 N -2.90 4.45 -0.02 2.70 2.96 -1.26 -0.57 118.68 124.03 2qsf s LEU 539 Ca 0.16 2.40 -0.27 0.00 -0.22 0.00 0.00 54.13 56.19 2qsf s LEU 539 Cb -0.02 -3.62 -0.03 0.00 0.50 0.00 0.00 46.19 43.02 2qsf s LEU 539 CO 0.04 -0.44 0.87 -0.47 -1.32 0.00 0.00 176.35 175.04 2qsf s TYR 540 N -0.34 3.63 -0.24 5.38 5.04 -0.08 -4.72 117.35 126.02 2qsf s TYR 540 Ca 0.53 1.53 0.02 0.00 -2.44 0.00 0.00 57.07 56.71 2qsf s TYR 540 Cb -0.36 -3.00 0.05 0.00 0.35 0.00 0.00 41.96 39.01 2qsf s TYR 540 CO 0.41 0.04 -0.14 0.42 -1.34 0.00 0.00 175.55 174.94 2qsf s ILE 541 N 0.89 2.14 0.49 3.14 1.01 -1.26 -4.67 121.20 122.94 2qsf s ILE 541 Ca 0.46 -1.44 -0.19 0.00 0.00 0.00 0.00 60.65 59.48 2qsf s ILE 541 Cb -0.20 -2.16 -0.08 0.00 0.01 0.00 0.00 42.46 40.03 2qsf s ILE 541 CO 0.24 0.13 1.01 -2.16 0.00 0.00 0.00 174.94 174.16 2qsf s PRO 542 N 1.15 3.87 0.79 2.79 0.04 -1.26 -5.03 135.00 137.35 2qsf s PRO 542 Ca -0.05 1.20 -0.13 0.00 0.04 0.00 0.00 61.00 62.06 2qsf s PRO 542 Cb -0.18 -2.12 0.07 0.00 0.04 0.00 0.00 34.50 32.32 2qsf s PRO 542 CO -0.07 -0.35 1.18 -2.14 0.04 0.00 0.00 177.00 175.65 2qsf s PRO 543 N -3.49 1.81 0.49 0.56 0.02 -1.26 -4.61 135.00 128.53 2qsf s PRO 543 Ca 0.64 1.64 -0.14 0.00 0.02 0.00 0.00 61.00 63.15 2qsf s PRO 543 Cb -0.13 -1.81 -0.07 0.00 0.02 0.00 0.00 34.50 32.51 2qsf s PRO 543 CO 0.22 -2.06 0.93 -0.51 -0.33 0.00 0.00 177.00 175.25 2qsf s LEU 544 N -5.67 3.65 0.53 -5.54 1.02 -1.26 -4.63 118.68 106.79 2qsf s LEU 544 Ca 0.71 1.43 -0.18 0.00 0.02 0.00 0.00 54.13 56.10 2qsf s LEU 544 Cb -0.26 -4.36 -0.06 0.00 0.02 0.00 0.00 46.19 41.53 2qsf s LEU 544 CO 0.50 -0.55 1.05 0.00 0.02 0.00 0.00 176.35 177.37 2qsf s ALA 545 N -2.59 2.81 1.19 4.21 0.00 -1.26 -4.81 121.76 121.30 2qsf s ALA 545 Ca 0.56 0.55 -0.18 0.00 0.00 0.00 0.00 51.96 52.89 2qsf s ALA 545 Cb -0.10 -3.25 0.28 0.00 0.00 0.00 0.00 23.12 20.04 2qsf s ALA 545 CO 0.33 -0.54 1.09 -1.54 0.00 0.00 0.00 175.76 175.10 2qsf s SER 546 N -2.27 0.99 0.57 0.00 1.04 0.52 -4.81 113.70 109.75 2qsf s SER 546 Ca 0.66 0.76 0.34 0.00 0.48 0.00 0.00 55.95 58.19 2qsf s SER 546 Cb -0.17 -1.10 1.71 0.00 0.10 0.00 0.00 66.02 66.57 2qsf s SER 546 CO 0.27 -4.09 2.14 0.00 0.98 0.00 0.00 173.24 172.54 2qsf h ALA 547 N -2.56 1.15 -0.28 5.32 0.00 -1.96 -0.10 119.26 120.83 2qsf h ALA 547 Ca -0.47 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.39 2qsf h ALA 547 Cb 1.31 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.09 2qsf h ALA 547 CO 0.38 0.07 0.00 -1.13 0.00 0.00 0.00 179.25 178.57 2qsf n SER 548 N -3.37 2.09 0.00 0.00 3.41 -1.26 -4.90 113.62 109.59 2qsf n SER 548 Ca -0.02 -1.84 0.00 0.00 -0.26 0.00 0.00 58.87 56.75 2qsf n SER 548 Cb 0.20 -0.18 0.00 0.00 -0.26 0.00 0.00 64.21 63.97 2qsf n SER 548 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2qsf n GLY 549 N 1.19 0.63 3.76 5.00 0.00 -0.05 -4.74 105.19 110.98 2qsf n GLY 549 Ca 0.16 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.77 2qsf n GLY 549 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2qsf s GLU 550 N -0.11 4.41 -0.08 1.61 2.12 -1.26 -4.46 118.70 120.93 2qsf s GLU 550 Ca 0.00 2.12 0.03 0.00 0.36 0.00 0.00 54.97 57.48 2qsf s GLU 550 Cb 0.00 -3.12 -0.02 0.00 0.26 0.00 0.00 34.13 31.25 2qsf s GLU 550 CO 0.00 -0.15 -0.18 0.42 -0.54 0.00 0.00 175.26 174.81 2qsf s ILE 551 N -0.80 2.66 0.00 -3.70 1.01 -1.26 -0.36 121.20 118.76 2qsf s ILE 551 Ca 0.50 -0.84 -0.30 0.00 0.00 0.00 0.00 60.65 60.02 2qsf s ILE 551 Cb -0.38 -2.05 -0.06 0.00 0.01 0.00 0.00 42.46 39.99 2qsf s ILE 551 CO 0.47 0.56 1.43 0.42 0.00 0.00 0.00 174.94 177.82 2qsf s THR 552 N -0.14 3.65 0.27 2.92 -4.23 -1.26 -4.99 115.64 111.87 2qsf s THR 552 Ca -0.02 1.03 0.11 0.00 -1.18 0.00 0.00 61.69 61.63 2qsf s THR 552 Cb -0.14 -3.66 -0.05 0.00 1.34 0.00 0.00 72.50 69.99 2qsf s THR 552 CO 0.04 -0.01 -0.13 -0.54 -0.54 0.00 0.00 174.62 173.44 2qsf s LYS 553 N 2.52 1.91 1.06 3.99 1.02 -1.26 -4.82 119.74 124.16 2qsf s LYS 553 Ca 0.65 -1.62 -0.17 0.00 0.02 0.00 0.00 55.97 54.84 2qsf s LYS 553 Cb -0.32 -1.92 0.23 0.00 -0.52 0.00 0.00 37.83 35.30 2qsf s LYS 553 CO 0.27 0.35 1.22 0.54 -0.92 0.00 0.00 175.35 176.80 2qsf s ASN 554 N -3.53 2.22 0.44 2.83 2.20 0.30 -4.82 114.94 114.57 2qsf s ASN 554 Ca 0.30 0.48 0.23 0.00 -0.94 0.00 0.00 52.86 52.93 2qsf s ASN 554 Cb -0.06 -0.66 1.22 0.00 -2.00 0.00 0.00 41.25 39.75 2qsf s ASN 554 CO 0.17 -3.31 1.79 0.00 -2.94 0.00 0.00 177.10 172.81 2qsf h THR 555 N -2.03 0.51 -0.00 0.54 1.03 -2.01 0.54 112.91 111.49 2qsf h THR 555 Ca -0.45 -0.10 0.00 0.00 -0.01 0.00 0.00 66.41 65.85 2qsf h THR 555 Cb 1.27 0.20 0.00 0.00 -1.07 0.00 0.00 68.15 68.55 2qsf h THR 555 CO 0.39 0.05 -0.12 0.49 -0.01 0.00 0.00 175.52 176.31 2qsf n PHE 556 N -4.51 0.00 -0.27 0.00 0.99 -1.26 -4.93 117.46 107.47 2qsf n PHE 556 Ca 0.24 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.69 2qsf n PHE 556 Cb 0.94 -0.21 0.00 0.00 -1.00 0.00 0.00 39.48 39.21 2qsf n PHE 556 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 2qsf n GLY 557 N 1.31 0.85 3.73 1.37 0.00 0.18 -5.08 105.19 107.54 2qsf n GLY 557 Ca 0.13 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.89 2qsf n GLY 557 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2qsf s ASN 558 N -2.06 4.27 0.03 1.61 0.01 -1.26 -4.32 114.94 113.22 2qsf s ASN 558 Ca 0.00 -1.23 0.07 0.00 -0.71 0.00 0.00 52.86 50.99 2qsf s ASN 558 Cb 0.00 -0.26 -0.02 0.00 0.41 0.00 0.00 41.25 41.38 2qsf s ASN 558 CO 0.00 -0.61 -0.21 -0.51 -1.51 0.00 0.00 177.10 174.26 2qsf s ILE 559 N -2.68 1.70 -0.23 0.60 2.07 -0.82 -0.54 121.20 121.30 2qsf s ILE 559 Ca 0.35 -1.13 -0.10 0.00 -1.41 0.00 0.00 60.65 58.36 2qsf s ILE 559 Cb 0.05 -1.46 -0.05 0.00 0.13 0.00 0.00 42.46 41.13 2qsf s ILE 559 CO 0.19 0.29 0.15 -1.61 -1.91 0.00 0.00 174.94 172.05 2qsf s GLU 560 N -0.99 4.05 -0.36 3.50 2.02 -1.26 -1.56 118.70 124.09 2qsf s GLU 560 Ca 0.08 -0.28 0.00 0.00 0.02 0.00 0.00 54.97 54.79 2qsf s GLU 560 Cb -0.09 -3.50 0.12 0.00 0.10 0.00 0.00 34.13 30.76 2qsf s GLU 560 CO 0.01 0.08 0.17 0.08 0.02 0.00 0.00 175.26 175.61 2qsf s VAL 561 N 1.00 0.98 -2.57 2.63 1.01 -0.64 -4.89 120.40 117.92 2qsf s VAL 561 Ca 0.07 -1.87 0.21 0.00 0.00 0.00 0.00 61.98 60.39 2qsf s VAL 561 Cb -0.13 -1.71 0.15 0.00 0.00 0.00 0.00 36.38 34.68 2qsf s VAL 561 CO 0.04 -0.80 1.16 0.49 0.00 0.00 0.00 175.10 175.99 2qsf n PHE 562 N 4.26 0.00 -3.59 5.22 0.99 -1.26 -4.35 117.46 118.73 2qsf n PHE 562 Ca 0.04 0.00 -0.15 0.00 -0.00 0.00 0.00 57.45 57.34 2qsf n PHE 562 Cb 0.38 0.00 -0.07 0.00 -1.00 0.00 0.00 39.48 38.80 2qsf n PHE 562 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 2qsf s ALA 563 N -1.84 -1.79 0.64 4.37 0.00 -1.26 -4.77 121.76 117.11 2qsf s ALA 563 Ca 0.24 1.77 0.23 0.00 0.00 0.00 0.00 51.96 54.21 2qsf s ALA 563 Cb 0.18 -0.80 1.20 0.00 0.00 0.00 0.00 23.12 23.70 2qsf s ALA 563 CO 0.30 -0.34 1.67 -1.00 0.00 0.00 0.00 175.76 176.38 2qsf h PRO 564 N 4.22 0.00 0.00 0.00 0.13 -1.97 0.67 132.00 135.05 2qsf h PRO 564 Ca -0.28 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 64.81 2qsf h PRO 564 Cb 1.15 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.28 2qsf h PRO 564 CO 0.17 0.00 -0.20 1.15 -0.23 0.00 0.00 178.00 178.89 2qsf h THR 565 N 0.00 0.48 -0.04 1.56 2.02 -1.95 -2.93 112.91 112.05 2qsf h THR 565 Ca 0.09 -1.10 0.00 0.00 0.77 0.00 0.00 66.41 66.17 2qsf h THR 565 Cb 1.25 1.78 0.00 0.00 -1.74 0.00 0.00 68.15 69.44 2qsf h THR 565 CO -0.00 0.20 0.00 0.23 0.37 0.00 0.00 175.52 176.32 2qsf n MET 566 N -3.33 1.26 -3.09 6.66 2.81 0.23 -4.65 117.12 117.01 2qsf n MET 566 Ca 0.00 -0.39 -0.40 0.00 -1.81 0.00 0.00 57.70 55.11 2qsf n MET 566 Cb 0.43 -1.40 -0.05 0.00 -0.71 0.00 0.00 33.22 31.49 2qsf n MET 566 CO 0.00 0.00 0.00 0.42 1.51 0.00 0.00 175.97 177.90 2qsf s ILE 567 N -1.95 5.02 0.35 2.02 1.01 -1.11 -4.78 121.20 121.76 2qsf s ILE 567 Ca 0.36 1.26 -0.25 0.00 0.00 0.00 0.00 60.65 62.02 2qsf s ILE 567 Cb 0.17 -3.97 -0.14 0.00 0.01 0.00 0.00 42.46 38.53 2qsf s ILE 567 CO 0.28 0.13 0.62 -2.65 0.00 0.00 0.00 174.94 173.32 2qsf n PRO 568 N 4.84 0.61 -0.32 2.79 -0.02 -1.26 -4.84 135.00 136.80 2qsf n PRO 568 Ca -0.01 0.22 0.13 0.00 -2.02 0.00 0.00 63.50 61.82 2qsf n PRO 568 Cb 0.50 -1.46 0.31 0.00 -0.02 0.00 0.00 33.50 32.83 2qsf n PRO 568 CO 0.00 0.00 0.00 0.78 1.98 0.00 0.00 175.50 178.26 2qsf h GLY 569 N 1.07 1.61 -3.49 -1.23 0.00 -1.82 -1.60 103.07 97.61 2qsf h GLY 569 Ca -0.38 -0.23 0.00 0.00 0.00 0.00 0.00 47.33 46.72 2qsf h GLY 569 CO 0.54 -0.20 0.00 1.16 0.00 0.00 0.00 176.54 178.04 2qsf n ASN 570 N -4.95 5.62 -2.74 0.19 2.04 -1.26 -4.97 115.26 109.20 2qsf n ASN 570 Ca 0.22 -2.91 -0.11 0.00 -0.44 0.00 0.00 54.58 51.35 2qsf n ASN 570 Cb 0.62 -0.68 -0.02 0.00 -2.53 0.00 0.00 39.78 37.16 2qsf n ASN 570 CO 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 177.26 176.82 2qsf s LEU 573 N -2.58 3.61 -0.37 0.00 2.96 -1.26 -1.66 118.68 119.38 2qsf s LEU 573 Ca 0.01 -0.08 -0.06 0.00 -0.22 0.00 0.00 54.13 53.77 2qsf s LEU 573 Cb 0.01 -1.95 0.07 0.00 0.50 0.00 0.00 46.19 44.82 2qsf s LEU 573 CO -0.09 0.05 0.16 -0.69 -1.32 0.00 0.00 176.35 174.46 2qsf s VAL 574 N 1.12 3.74 -0.34 1.68 1.01 -0.06 -5.00 120.40 122.55 2qsf s VAL 574 Ca 0.04 -1.42 -0.13 0.00 0.00 0.00 0.00 61.98 60.47 2qsf s VAL 574 Cb -0.14 -3.26 -0.02 0.00 0.00 0.00 0.00 36.38 32.96 2qsf s VAL 574 CO 0.03 -0.37 0.26 -0.70 0.00 0.00 0.00 175.10 174.33 2qsf s GLU 575 N 1.34 3.51 -0.29 2.72 2.12 -1.26 -1.66 118.70 125.19 2qsf s GLU 575 Ca 0.01 -0.60 -0.20 0.00 0.36 0.00 0.00 54.97 54.54 2qsf s GLU 575 Cb -0.21 -3.81 0.15 0.00 0.26 0.00 0.00 34.13 30.52 2qsf s GLU 575 CO 0.01 -0.46 1.07 1.21 -0.54 0.00 0.00 175.26 176.55 2qsf s ASN 576 N 1.72 -0.40 0.06 -1.70 3.84 -0.84 -5.00 114.94 112.63 2qsf s ASN 576 Ca 0.07 0.69 0.04 0.00 0.21 0.00 0.00 52.86 53.86 2qsf s ASN 576 Cb -0.17 0.97 0.20 0.00 -0.55 0.00 0.00 41.25 41.70 2qsf s ASN 576 CO 0.11 -0.11 1.09 -0.81 -2.79 0.00 0.00 177.10 174.59 2qsf n PRO 577 N 2.96 0.02 -0.01 0.43 -0.04 -1.26 -1.61 135.00 135.49 2qsf n PRO 577 Ca -0.16 0.51 0.08 0.00 -0.04 0.00 0.00 63.50 63.89 2qsf n PRO 577 Cb 0.57 -1.60 -0.11 0.00 -0.04 0.00 0.00 33.50 32.31 2qsf n PRO 577 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 2qsf n VAL 578 N -1.61 0.00 -0.31 0.52 0.31 -1.26 -4.68 118.33 111.29 2qsf n VAL 578 Ca -0.00 -0.30 0.14 0.00 -0.01 0.00 0.00 64.34 64.18 2qsf n VAL 578 Cb 0.03 0.40 0.33 0.00 -0.91 0.00 0.00 33.84 33.68 2qsf n VAL 578 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2qsf h ALA 579 N 1.72 1.51 -0.40 3.52 0.00 -1.64 -1.35 119.26 122.61 2qsf h ALA 579 Ca 0.00 0.16 -0.06 0.00 0.00 0.00 0.00 54.91 55.01 2qsf h ALA 579 Cb 0.63 0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.54 2qsf h ALA 579 CO 0.00 -0.35 0.02 0.82 0.00 0.00 0.00 179.25 179.74 2qsf h ILE 580 N 0.41 1.25 0.17 0.00 5.03 -1.83 -1.20 117.51 121.34 2qsf h ILE 580 Ca 0.58 -0.96 -0.01 0.00 -0.12 0.00 0.00 64.86 64.35 2qsf h ILE 580 Cb 1.12 1.09 0.00 0.00 -3.03 0.00 0.00 36.82 36.00 2qsf h ILE 580 CO -0.53 0.33 -0.08 0.50 -0.68 0.00 0.00 178.15 177.68 2qsf h LYS 581 N 0.54 -0.22 -0.78 2.37 3.64 -1.64 0.25 116.57 120.72 2qsf h LYS 581 Ca 0.12 0.02 0.11 0.00 -1.27 0.00 0.00 60.65 59.62 2qsf h LYS 581 Cb 0.44 0.05 -0.08 0.00 -0.41 0.00 0.00 32.23 32.23 2qsf h LYS 581 CO 0.02 -0.06 0.40 0.00 -2.27 0.00 0.00 179.45 177.54 2qsf h ALA 582 N 0.46 1.11 -0.34 5.00 0.00 -1.26 0.10 119.26 124.34 2qsf h ALA 582 Ca -0.02 0.06 -0.10 0.00 0.00 0.00 0.00 54.91 54.84 2qsf h ALA 582 Cb 0.27 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 2qsf h ALA 582 CO 0.04 -0.02 -0.19 0.00 0.00 0.00 0.00 179.25 179.08 2qsf h ALA 583 N 1.47 0.47 -0.24 0.00 0.00 -1.02 -1.95 119.26 118.00 2qsf h ALA 583 Ca 0.39 -0.36 -0.08 0.00 0.00 0.00 0.00 54.91 54.87 2qsf h ALA 583 Cb 0.44 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 2qsf h ALA 583 CO -0.29 0.41 -0.20 0.00 0.00 0.00 0.00 179.25 179.17 2qsf h ARG 584 N 0.49 0.42 -0.20 0.00 3.08 -0.40 -2.37 114.38 115.41 2qsf h ARG 584 Ca 0.07 -0.14 -0.02 0.00 0.07 0.00 0.00 59.98 59.97 2qsf h ARG 584 Cb 0.73 -0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.74 2qsf h ARG 584 CO 0.05 0.60 0.05 0.35 -1.07 0.00 0.00 179.97 179.96 2qsf h PHE 585 N 0.38 0.33 0.00 3.04 3.04 -0.69 -2.26 116.94 120.78 2qsf h PHE 585 Ca 0.06 -0.04 0.00 0.00 3.98 0.00 0.00 57.97 61.98 2qsf h PHE 585 Cb 0.57 -0.09 0.00 0.00 2.56 0.00 0.00 35.95 38.98 2qsf h PHE 585 CO 0.02 0.42 0.00 1.28 -2.02 0.00 0.00 178.31 178.01 2qsf n LEU 586 N -4.78 0.00 -2.52 0.59 4.77 -0.74 -4.85 117.00 109.46 2qsf n LEU 586 Ca -0.04 0.48 -0.13 0.00 -0.03 0.00 0.00 56.01 56.28 2qsf n LEU 586 Cb 0.16 -0.48 -0.00 0.00 -2.33 0.00 0.00 43.42 40.77 2qsf n LEU 586 CO 0.36 -0.28 -0.15 0.61 -1.33 0.00 0.00 177.39 176.61 2qsf n GLY 587 N -0.23 -0.50 3.98 -0.72 0.00 -0.85 -4.94 105.19 101.93 2qsf n GLY 587 Ca 0.03 0.01 -0.22 0.00 0.00 0.00 0.00 46.02 45.84 2qsf n GLY 587 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qsf s VAL 588 N -2.65 2.45 -0.06 1.61 0.11 -1.21 -5.06 120.40 115.59 2qsf s VAL 588 Ca 0.04 -0.64 -0.28 0.00 -2.93 0.00 0.00 61.98 58.17 2qsf s VAL 588 Cb -0.02 -2.81 -0.02 0.00 -1.53 0.00 0.00 36.38 31.99 2qsf s VAL 588 CO 0.05 0.00 0.90 -0.70 -3.33 0.00 0.00 175.10 172.02 2qsf s GLU 589 N -4.90 4.46 0.00 1.54 2.56 -1.26 -4.89 118.70 116.21 2qsf s GLU 589 Ca 0.61 1.24 0.00 0.00 0.00 0.00 0.00 54.97 56.81 2qsf s GLU 589 Cb -0.08 -3.49 0.00 0.00 2.00 0.00 0.00 34.13 32.55 2qsf s GLU 589 CO 0.41 -0.13 0.00 1.97 -0.56 0.00 0.00 175.26 176.95 2qsf n PHE 590 N 4.33 -0.43 -3.66 5.30 1.16 -1.26 -4.68 117.46 118.22 2qsf n PHE 590 Ca 0.05 0.00 -0.05 0.00 -1.87 0.00 0.00 57.45 55.57 2qsf n PHE 590 Cb 0.50 0.00 -0.07 0.00 -1.61 0.00 0.00 39.48 38.30 2qsf n PHE 590 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 2qsf s ALA 591 N -1.00 -1.60 0.27 1.98 0.00 -0.95 -4.62 121.76 115.83 2qsf s ALA 591 Ca 0.00 1.97 -0.31 0.00 0.00 0.00 0.00 51.96 53.63 2qsf s ALA 591 Cb 0.00 -1.48 -0.12 0.00 0.00 0.00 0.00 23.12 21.52 2qsf s ALA 591 CO 0.00 -0.72 1.62 -2.30 0.00 0.00 0.00 175.76 174.35 2qsf n PRO 592 N 5.15 2.68 -3.56 0.00 -0.02 -1.26 -1.25 135.00 136.74 2qsf n PRO 592 Ca -0.13 0.96 -0.40 0.00 -2.02 0.00 0.00 63.50 61.91 2qsf n PRO 592 Cb 0.51 -2.75 -0.11 0.00 -0.02 0.00 0.00 33.50 31.14 2qsf n PRO 592 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2qsf s ALA 593 N 0.28 3.47 -0.36 3.55 0.00 0.13 -1.94 121.76 126.89 2qsf s ALA 593 Ca 0.67 -1.32 -0.21 0.00 0.00 0.00 0.00 51.96 51.10 2qsf s ALA 593 Cb -0.51 -2.58 0.00 0.00 0.00 0.00 0.00 23.12 20.03 2qsf s ALA 593 CO 0.45 -0.87 0.64 0.08 0.00 0.00 0.00 175.76 176.05 2qsf s VAL 594 N 1.71 4.88 -1.01 0.00 1.01 -0.60 -1.65 120.40 124.73 2qsf s VAL 594 Ca 0.06 0.54 0.09 0.00 0.00 0.00 0.00 61.98 62.68 2qsf s VAL 594 Cb -0.17 -4.09 0.04 0.00 0.00 0.00 0.00 36.38 32.15 2qsf s VAL 594 CO 0.10 -0.35 0.70 0.35 0.00 0.00 0.00 175.10 175.90 2qsf n THR 595 N 5.62 0.00 -3.90 3.92 -2.24 -0.44 -1.62 114.28 115.62 2qsf n THR 595 Ca -0.01 -0.46 -0.02 0.00 -2.27 0.00 0.00 64.05 61.29 2qsf n THR 595 Cb 0.48 1.15 0.02 0.00 -2.10 0.00 0.00 70.33 69.89 2qsf n THR 595 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 2qsf n SER 596 N 0.15 -1.59 -4.34 3.42 3.41 -1.23 -4.71 113.62 108.72 2qsf n SER 596 Ca 0.05 -1.77 -0.18 0.00 -0.26 0.00 0.00 58.87 56.71 2qsf n SER 596 Cb 0.21 2.57 -0.10 0.00 -0.26 0.00 0.00 64.21 66.63 2qsf n SER 596 CO 0.00 0.00 0.00 -0.36 -0.16 0.00 0.00 175.04 174.52 2qsf s PHE 597 N -2.23 1.61 -0.10 7.33 0.40 -1.26 -0.64 117.98 123.10 2qsf s PHE 597 Ca 0.23 -0.92 0.04 0.00 -0.60 0.00 0.00 56.93 55.68 2qsf s PHE 597 Cb -0.02 -0.94 0.00 0.00 0.51 0.00 0.00 43.02 42.56 2qsf s PHE 597 CO 0.04 -0.03 -0.23 0.15 0.70 0.00 0.00 175.22 175.85 2qsf s LYS 598 N -3.86 2.95 -0.58 0.44 -0.14 -1.26 -4.87 119.74 112.42 2qsf s LYS 598 Ca 0.29 -0.86 0.06 0.00 -1.36 0.00 0.00 55.97 54.11 2qsf s LYS 598 Cb 0.06 -2.24 0.27 0.00 -1.68 0.00 0.00 37.83 34.24 2qsf s LYS 598 CO 0.10 0.18 0.75 1.97 -0.76 0.00 0.00 175.35 177.59 2qsf n PHE 599 N 3.51 2.96 0.07 3.18 1.16 -1.26 -4.75 117.46 122.33 2qsf n PHE 599 Ca -0.19 -4.02 0.00 0.00 -1.87 0.00 0.00 57.45 51.37 2qsf n PHE 599 Cb 0.53 -0.51 0.00 0.00 -1.61 0.00 0.00 39.48 37.89 2qsf n PHE 599 CO 0.00 0.00 0.00 1.63 -1.87 0.00 0.00 176.76 176.52 2qsf n LYS 606 N 0.70 0.00 -2.46 3.97 4.76 -1.26 -5.33 118.16 118.54 2qsf n LYS 606 Ca 0.29 0.00 -0.40 0.00 -2.87 0.00 0.00 58.31 55.32 2qsf n LYS 606 Cb 0.44 -0.18 -0.04 0.00 -1.84 0.00 0.00 35.03 33.41 2qsf n LYS 606 CO 0.00 0.00 0.00 -2.14 -1.37 0.00 0.00 177.40 173.89 2qsf s PRO 607 N -2.00 4.61 -0.32 1.97 0.02 -1.26 -4.38 135.00 133.64 2qsf s PRO 607 Ca 0.00 1.81 -0.07 0.00 0.02 0.00 0.00 61.00 62.76 2qsf s PRO 607 Cb 0.00 -3.20 0.02 0.00 0.02 0.00 0.00 34.50 31.34 2qsf s PRO 607 CO 0.00 0.15 0.10 0.08 -0.33 0.00 0.00 177.00 177.00 2qsf s VAL 608 N -0.90 3.93 -0.30 3.83 1.01 0.19 -4.86 120.40 123.30 2qsf s VAL 608 Ca 0.46 -0.90 -0.21 0.00 0.00 0.00 0.00 61.98 61.33 2qsf s VAL 608 Cb -0.32 -3.13 -0.01 0.00 0.00 0.00 0.00 36.38 32.92 2qsf s VAL 608 CO 0.40 -0.06 0.66 -0.76 0.00 0.00 0.00 175.10 175.34 2qsf s LEU 609 N 1.46 4.13 0.00 3.92 1.02 -1.26 -1.33 118.68 126.61 2qsf s LEU 609 Ca 0.01 0.51 0.15 0.00 0.02 0.00 0.00 54.13 54.82 2qsf s LEU 609 Cb -0.18 -2.87 0.02 0.00 0.02 0.00 0.00 46.19 43.17 2qsf s LEU 609 CO 0.03 -0.49 0.84 -1.54 0.02 0.00 0.00 176.35 175.21 2qsf n SER 610 N 5.92 1.67 0.00 2.29 3.41 -0.66 -4.97 113.62 121.28 2qsf n SER 610 Ca 0.00 -1.33 0.00 0.00 -0.26 0.00 0.00 58.87 57.28 2qsf n SER 610 Cb 0.49 0.40 0.00 0.00 -0.26 0.00 0.00 64.21 64.83 2qsf n SER 610 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2qsf n GLY 611 N 1.07 -0.67 3.25 5.00 0.00 -1.25 -1.98 105.19 110.61 2qsf n GLY 611 Ca 0.07 -0.48 -0.14 0.00 0.00 0.00 0.00 46.02 45.47 2qsf n GLY 611 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2qsf s ILE 612 N -4.00 0.57 -0.11 -0.61 -4.36 -0.66 0.22 121.20 112.25 2qsf s ILE 612 Ca 0.00 -1.98 0.03 0.00 -0.26 0.00 0.00 60.65 58.44 2qsf s ILE 612 Cb 0.00 -2.25 -0.00 0.00 1.25 0.00 0.00 42.46 41.46 2qsf s ILE 612 CO 0.00 -0.35 -0.21 -0.69 0.24 0.00 0.00 174.94 173.93 2qsf s VAL 613 N -3.73 2.28 0.05 8.37 1.01 -0.38 -0.88 120.40 127.12 2qsf s VAL 613 Ca 0.28 -0.94 0.00 0.00 0.00 0.00 0.00 61.98 61.32 2qsf s VAL 613 Cb 0.07 -1.89 -0.03 0.00 0.00 0.00 0.00 36.38 34.52 2qsf s VAL 613 CO 0.06 0.55 -0.05 0.68 0.00 0.00 0.00 175.10 176.35 2qsf s VAL 614 N 0.37 0.35 0.78 2.92 -7.23 -0.66 -2.24 120.40 114.69 2qsf s VAL 614 Ca -0.17 -1.51 -0.15 0.00 -1.81 0.00 0.00 61.98 58.35 2qsf s VAL 614 Cb -0.17 -1.11 0.02 0.00 0.56 0.00 0.00 36.38 35.68 2qsf s VAL 614 CO 0.08 -0.75 0.84 0.00 -0.31 0.00 0.00 175.10 174.95 2qsf n ALA 615 N 0.65 -0.84 0.26 1.32 0.00 -1.26 -0.79 120.51 119.85 2qsf n ALA 615 Ca -0.17 -0.30 0.14 0.00 0.00 0.00 0.00 53.44 53.11 2qsf n ALA 615 Cb 0.59 -2.04 0.69 0.00 0.00 0.00 0.00 19.45 18.68 2qsf n ALA 615 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 2qsf h LYS 616 N -0.65 0.00 -0.01 0.00 1.57 -1.61 -2.62 116.57 113.26 2qsf h LYS 616 Ca -0.46 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.32 2qsf h LYS 616 Cb 1.32 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.63 2qsf h LYS 616 CO 0.44 0.11 -0.10 -2.67 -0.57 0.00 0.00 179.45 176.66 2qsf n TRP 617 N -3.39 0.00 0.68 -1.35 2.14 -1.26 -3.20 117.44 111.06 2qsf n TRP 617 Ca -0.01 0.00 0.07 0.00 2.07 0.00 0.00 57.50 59.64 2qsf n TRP 617 Cb 0.29 -0.11 -0.01 0.00 -0.81 0.00 0.00 31.31 30.68 2qsf n TRP 617 CO 0.00 0.00 0.00 1.28 2.07 0.00 0.00 177.69 181.04 2qsf n LEU 618 N -0.65 1.50 -0.16 5.67 4.77 -0.99 -4.61 117.00 122.52 2qsf n LEU 618 Ca 0.16 -0.74 -0.03 0.00 -0.03 0.00 0.00 56.01 55.37 2qsf n LEU 618 Cb 0.29 0.00 0.06 0.00 -2.33 0.00 0.00 43.42 41.44 2qsf n LEU 618 CO 0.22 0.29 0.93 -0.09 -1.33 0.00 0.00 177.39 177.41 2qsf h ARG 619 N 1.56 0.27 -0.12 3.23 1.12 -1.51 -2.64 114.38 116.27 2qsf h ARG 619 Ca 0.00 -0.02 -0.00 0.00 -1.11 0.00 0.00 59.98 58.85 2qsf h ARG 619 Cb 0.50 -0.06 -0.01 0.00 -0.01 0.00 0.00 29.97 30.40 2qsf h ARG 619 CO 0.00 0.18 0.07 0.93 -3.11 0.00 0.00 179.97 178.03 2qsf h GLU 620 N 0.27 0.17 -0.66 0.20 4.39 -1.82 -0.52 114.58 116.61 2qsf h GLU 620 Ca 0.24 -0.02 0.07 0.00 0.34 0.00 0.00 59.36 60.00 2qsf h GLU 620 Cb 0.30 -0.03 -0.06 0.00 -0.10 0.00 0.00 28.75 28.86 2qsf h GLU 620 CO -0.29 0.19 0.34 0.00 -1.16 0.00 0.00 179.01 178.09 2qsf h ALA 621 N 0.97 0.89 0.00 3.43 0.00 -1.82 -0.01 119.26 122.72 2qsf h ALA 621 Ca 0.04 0.04 -0.12 0.00 0.00 0.00 0.00 54.91 54.87 2qsf h ALA 621 Cb 0.07 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 2qsf h ALA 621 CO -0.01 -0.02 -0.56 0.82 0.00 0.00 0.00 179.25 179.48 2qsf h ILE 622 N 0.61 1.26 -0.45 0.00 2.04 -1.37 -2.23 117.51 117.38 2qsf h ILE 622 Ca 0.31 -2.02 -0.09 0.00 1.00 0.00 0.00 64.86 64.06 2qsf h ILE 622 Cb 0.26 2.14 -0.01 0.00 -0.74 0.00 0.00 36.82 38.47 2qsf h ILE 622 CO -0.22 0.55 -0.08 -0.08 0.00 0.00 0.00 178.15 178.32 2qsf h GLU 623 N 0.00 0.85 0.75 2.37 4.57 -0.13 -1.39 114.58 121.59 2qsf h GLU 623 Ca -0.01 -0.31 -0.04 0.00 -1.18 0.00 0.00 59.36 57.83 2qsf h GLU 623 Cb 1.09 -0.06 0.01 0.00 -0.16 0.00 0.00 28.75 29.63 2qsf h GLU 623 CO 0.07 0.94 -0.36 1.15 -1.18 0.00 0.00 179.01 179.63 2qsf h THR 624 N 0.68 0.27 -0.83 0.32 2.02 -0.84 -1.38 112.91 113.15 2qsf h THR 624 Ca 0.12 -0.01 0.15 0.00 0.77 0.00 0.00 66.41 67.44 2qsf h THR 624 Cb 0.61 0.27 -0.10 0.00 -1.74 0.00 0.00 68.15 67.19 2qsf h THR 624 CO 0.04 0.00 0.40 0.00 0.37 0.00 0.00 175.52 176.33 2qsf h ALA 625 N -0.75 1.23 -0.58 6.16 0.00 -1.36 -0.90 119.26 123.06 2qsf h ALA 625 Ca -0.10 0.10 -0.06 0.00 0.00 0.00 0.00 54.91 54.84 2qsf h ALA 625 Cb 0.77 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.55 2qsf h ALA 625 CO 0.17 -0.13 0.13 0.82 0.00 0.00 0.00 179.25 180.24 2qsf h ILE 626 N 0.57 1.25 -0.72 0.00 2.04 -1.09 -2.41 117.51 117.15 2qsf h ILE 626 Ca 0.45 -0.92 -0.02 0.00 1.00 0.00 0.00 64.86 65.38 2qsf h ILE 626 Cb 0.67 0.73 -0.03 0.00 -0.74 0.00 0.00 36.82 37.44 2qsf h ILE 626 CO -0.38 0.34 0.37 -0.78 0.00 0.00 0.00 178.15 177.70 2qsf h ASP 627 N 0.84 0.90 -1.67 1.72 3.58 -0.06 -3.16 116.42 118.58 2qsf h ASP 627 Ca 0.18 -0.09 -0.66 0.00 0.42 0.00 0.00 57.03 56.88 2qsf h ASP 627 Cb 0.36 -0.23 -0.36 0.00 1.72 0.00 0.00 39.33 40.83 2qsf h ASP 627 CO 0.00 0.75 0.02 0.61 -2.88 0.00 0.00 179.24 177.74 2qsf n GLY 628 N -1.15 5.83 0.00 -0.78 0.00 -0.52 -4.72 105.19 103.85 2qsf n GLY 628 Ca 0.07 -2.64 0.12 0.00 0.00 0.00 0.00 46.02 43.57 2qsf n GLY 628 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 2qsf n ILE 629 N -0.52 0.18 0.17 -0.61 -6.64 -0.93 -2.84 119.36 108.15 2qsf n ILE 629 Ca 0.46 0.04 0.05 0.00 -1.77 0.00 0.00 62.75 61.53 2qsf n ILE 629 Cb 0.50 -0.64 0.49 0.00 -1.44 0.00 0.00 39.64 38.55 2qsf n ILE 629 CO 0.00 0.00 0.00 -0.33 -1.77 0.00 0.00 176.55 174.45 2qsf h GLU 630 N 0.00 0.16 -0.64 6.28 5.08 -1.88 -2.14 114.58 121.43 2qsf h GLU 630 Ca 0.00 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.34 2qsf h GLU 630 Cb 0.18 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.40 2qsf h GLU 630 CO 0.00 0.22 0.00 1.19 -1.00 0.00 0.00 179.01 179.42 2qsf n PHE 631 N -4.39 1.57 0.58 4.33 3.01 -1.13 -5.29 117.46 116.13 2qsf n PHE 631 Ca -0.01 -0.60 0.07 0.00 1.01 0.00 0.00 57.45 57.92 2qsf n PHE 631 Cb 0.18 -0.31 0.06 0.00 -0.01 0.00 0.00 39.48 39.40 2qsf n PHE 631 CO 0.00 0.00 0.00 -0.89 1.01 0.00 0.00 176.76 176.88