#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1nrl s LEU 143 N 0.00 4.18 0.82 0.99 1.02 -1.26 -5.02 118.68 119.41 1nrl s LEU 143 Ca 0.00 0.72 -0.10 0.00 0.02 0.00 0.00 54.13 54.77 1nrl s LEU 143 Cb 0.00 -3.49 0.08 0.00 0.02 0.00 0.00 46.19 42.81 1nrl s LEU 143 CO 0.00 -0.06 1.11 0.42 0.02 0.00 0.00 176.35 177.84 1nrl s THR 144 N -1.84 2.92 0.32 5.49 -4.23 -1.26 -4.77 115.64 112.27 1nrl s THR 144 Ca 0.44 0.30 0.03 0.00 -1.18 0.00 0.00 61.69 61.27 1nrl s THR 144 Cb -0.11 -2.64 0.17 0.00 1.34 0.00 0.00 72.50 71.25 1nrl s THR 144 CO 0.25 -0.39 1.88 -0.08 -0.54 0.00 0.00 174.62 175.74 1nrl h GLU 145 N -1.35 0.64 -0.17 3.99 4.57 -1.99 -0.27 114.58 120.00 1nrl h GLU 145 Ca -0.43 -0.12 -0.10 0.00 -1.18 0.00 0.00 59.36 57.52 1nrl h GLU 145 Cb 1.24 -0.10 -0.01 0.00 -0.16 0.00 0.00 28.75 29.72 1nrl h GLU 145 CO 0.48 0.60 -0.34 1.49 -1.18 0.00 0.00 179.01 180.06 1nrl h GLU 146 N 0.62 0.35 -0.09 1.92 4.81 -1.99 -2.00 114.58 118.20 1nrl h GLU 146 Ca 0.14 -0.15 -0.10 0.00 -0.13 0.00 0.00 59.36 59.12 1nrl h GLU 146 Cb 0.27 -0.01 0.00 0.00 0.63 0.00 0.00 28.75 29.65 1nrl h GLU 146 CO 0.00 0.66 -0.33 1.96 -0.73 0.00 0.00 179.01 180.57 1nrl h GLN 147 N 0.30 0.38 -0.90 1.92 4.20 -1.69 -1.95 115.11 117.39 1nrl h GLN 147 Ca 0.04 -0.29 0.07 0.00 0.06 0.00 0.00 58.65 58.53 1nrl h GLN 147 Cb 0.76 0.05 -0.07 0.00 0.30 0.00 0.00 27.48 28.52 1nrl h GLN 147 CO 0.06 0.92 0.56 0.00 -0.67 0.00 0.00 178.83 179.70 1nrl h ARG 148 N -0.07 0.97 -0.11 1.46 3.08 -0.97 -0.56 114.38 118.19 1nrl h ARG 148 Ca -0.01 -0.06 -0.14 0.00 0.07 0.00 0.00 59.98 59.84 1nrl h ARG 148 Cb 0.96 -0.22 -0.01 0.00 0.08 0.00 0.00 29.97 30.78 1nrl h ARG 148 CO 0.07 0.64 -0.53 0.00 -1.07 0.00 0.00 179.97 179.08 1nrl h MET 149 N 1.00 0.31 0.04 0.04 -0.00 -1.35 -1.45 114.93 113.52 1nrl h MET 149 Ca 0.40 -0.18 -0.00 0.00 -0.00 0.00 0.00 59.70 59.91 1nrl h MET 149 Cb 0.21 0.02 0.00 0.00 -0.00 0.00 0.00 31.60 31.83 1nrl h MET 149 CO -0.19 0.76 -0.02 1.98 -0.00 0.00 0.00 176.91 179.44 1nrl h MET 150 N 0.24 -0.05 -0.64 -0.10 1.85 -0.43 -0.89 114.93 114.90 1nrl h MET 150 Ca 0.01 0.00 -0.04 0.00 -0.61 0.00 0.00 59.70 59.05 1nrl h MET 150 Cb 1.01 0.01 -0.03 0.00 0.43 0.00 0.00 31.60 33.02 1nrl h MET 150 CO 0.09 0.18 0.22 0.82 -0.40 0.00 0.00 176.91 177.82 1nrl h ILE 151 N -0.28 1.23 -0.47 1.77 2.04 -1.11 -1.54 117.51 119.16 1nrl h ILE 151 Ca -0.01 -0.78 -0.00 0.00 1.00 0.00 0.00 64.86 65.08 1nrl h ILE 151 Cb 0.25 0.50 -0.02 0.00 -0.74 0.00 0.00 36.82 36.81 1nrl h ILE 151 CO 0.01 0.30 0.29 0.03 0.00 0.00 0.00 178.15 178.79 1nrl h ARG 152 N 0.94 0.63 -0.26 2.37 3.08 -1.06 0.14 114.38 120.22 1nrl h ARG 152 Ca 0.21 -0.05 -0.02 0.00 0.07 0.00 0.00 59.98 60.19 1nrl h ARG 152 Cb 0.23 -0.14 -0.01 0.00 0.08 0.00 0.00 29.97 30.14 1nrl h ARG 152 CO -0.01 0.45 0.07 1.49 -1.07 0.00 0.00 179.97 180.90 1nrl h GLU 153 N 0.63 0.40 -0.04 0.04 4.81 -0.80 -0.57 114.58 119.06 1nrl h GLU 153 Ca 0.17 -0.09 0.02 0.00 -0.13 0.00 0.00 59.36 59.33 1nrl h GLU 153 Cb -0.03 -0.06 -0.02 0.00 0.63 0.00 0.00 28.75 29.27 1nrl h GLU 153 CO -0.03 0.49 -0.08 -0.07 -0.73 0.00 0.00 179.01 178.59 1nrl h LEU 154 N 0.24 -0.25 -0.97 1.64 4.07 -1.02 0.12 115.31 119.15 1nrl h LEU 154 Ca 0.08 0.04 -0.02 0.00 0.08 0.00 0.00 57.88 58.06 1nrl h LEU 154 Cb 0.26 0.11 -0.04 0.00 1.08 0.00 0.00 40.66 42.08 1nrl h LEU 154 CO -0.00 -0.12 0.43 0.24 -1.08 0.00 0.00 178.44 177.92 1nrl h MET 155 N -0.12 1.16 -0.57 1.13 2.86 -0.67 0.33 114.93 119.04 1nrl h MET 155 Ca 0.05 -0.14 -0.10 0.00 -2.06 0.00 0.00 59.70 57.44 1nrl h MET 155 Cb 0.19 -0.22 -0.02 0.00 0.06 0.00 0.00 31.60 31.60 1nrl h MET 155 CO -0.11 0.86 -0.04 0.22 1.06 0.00 0.00 176.91 178.90 1nrl h ASP 156 N 1.16 1.03 -0.57 1.22 1.82 -0.72 -1.35 116.42 119.01 1nrl h ASP 156 Ca 0.29 -0.32 -0.08 0.00 -0.39 0.00 0.00 57.03 56.53 1nrl h ASP 156 Cb 0.05 -0.28 -0.02 0.00 0.68 0.00 0.00 39.33 39.76 1nrl h ASP 156 CO -0.04 1.10 0.07 0.00 -1.61 0.00 0.00 179.24 178.76 1nrl h ALA 157 N 0.96 0.99 -0.04 -0.78 0.00 -0.13 -1.75 119.26 118.51 1nrl h ALA 157 Ca 0.16 -0.27 -0.00 0.00 0.00 0.00 0.00 54.91 54.80 1nrl h ALA 157 Cb 0.60 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 18.16 1nrl h ALA 157 CO 0.04 0.63 0.02 0.37 0.00 0.00 0.00 179.25 180.31 1nrl h GLN 158 N 0.93 0.06 -0.58 0.00 5.75 -0.70 -1.83 115.11 118.74 1nrl h GLN 158 Ca 0.18 -0.01 -0.00 0.00 -0.15 0.00 0.00 58.65 58.67 1nrl h GLN 158 Cb 0.44 -0.01 -0.03 0.00 1.07 0.00 0.00 27.48 28.95 1nrl h GLN 158 CO 0.02 0.21 0.36 1.98 -2.65 0.00 0.00 178.83 178.74 1nrl h MET 159 N -0.10 0.78 0.00 1.69 4.05 -1.09 -0.86 114.93 119.40 1nrl h MET 159 Ca 0.01 -0.06 0.00 0.00 -0.28 0.00 0.00 59.70 59.37 1nrl h MET 159 Cb 0.17 -0.17 0.00 0.00 -0.80 0.00 0.00 31.60 30.80 1nrl h MET 159 CO -0.00 0.54 0.00 0.87 0.23 0.00 0.00 176.91 178.55 1nrl h LYS 160 N 0.80 0.00 0.00 0.39 1.57 -1.10 -3.36 116.57 114.87 1nrl h LYS 160 Ca 0.21 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.99 1nrl h LYS 160 Cb -0.04 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.27 1nrl h LYS 160 CO -0.04 0.00 0.00 0.25 -0.57 0.00 0.00 179.45 179.09 1nrl n THR 161 N -2.69 0.30 -3.99 -0.16 -2.24 -0.71 -4.93 114.28 99.87 1nrl n THR 161 Ca 0.04 -0.54 -0.31 0.00 -2.27 0.00 0.00 64.05 60.98 1nrl n THR 161 Cb 0.46 0.98 -0.15 0.00 -2.10 0.00 0.00 70.33 69.53 1nrl n THR 161 CO 0.00 0.00 0.00 0.12 -0.57 0.00 0.00 175.07 174.62 1nrl s PHE 162 N -0.30 3.51 -0.89 4.78 5.99 -0.37 -4.63 117.98 126.07 1nrl s PHE 162 Ca 0.00 -3.00 -0.24 0.00 0.00 0.00 0.00 56.93 53.70 1nrl s PHE 162 Cb 0.00 -2.84 0.05 0.00 0.00 0.00 0.00 43.02 40.24 1nrl s PHE 162 CO 0.00 -0.89 1.32 0.34 -0.00 0.00 0.00 175.22 175.99 1nrl s ASP 163 N 0.60 6.38 0.59 6.13 2.15 -1.26 -4.81 116.67 126.44 1nrl s ASP 163 Ca 0.13 -1.15 0.38 0.00 0.43 0.00 0.00 52.55 52.33 1nrl s ASP 163 Cb -0.21 -2.53 1.80 0.00 -0.30 0.00 0.00 42.92 41.68 1nrl s ASP 163 CO -0.06 -1.56 2.14 0.71 -0.17 0.00 0.00 175.17 176.22 1nrl h THR 164 N 6.37 0.00 -0.01 1.71 1.35 -1.95 -1.62 112.91 118.76 1nrl h THR 164 Ca -0.00 -0.29 0.00 0.00 -0.55 0.00 0.00 66.41 65.57 1nrl h THR 164 Cb 1.03 1.27 0.00 0.00 -1.73 0.00 0.00 68.15 68.72 1nrl h THR 164 CO 1.32 0.00 -0.11 0.35 -0.25 0.00 0.00 175.52 176.83 1nrl n THR 165 N -3.06 0.00 -2.27 6.82 -2.24 -1.26 -4.22 114.28 108.06 1nrl n THR 165 Ca -0.01 -0.22 -0.10 0.00 -2.27 0.00 0.00 64.05 61.45 1nrl n THR 165 Cb 0.20 0.57 -0.01 0.00 -2.10 0.00 0.00 70.33 68.99 1nrl n THR 165 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 1nrl n PHE 166 N -0.05 -1.37 0.30 4.78 3.72 -0.61 -4.04 117.46 120.19 1nrl n PHE 166 Ca 0.16 0.00 0.12 0.00 -0.05 0.00 0.00 57.45 57.67 1nrl n PHE 166 Cb 0.38 -2.38 0.53 0.00 -0.94 0.00 0.00 39.48 37.07 1nrl n PHE 166 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 1nrl n SER 167 N -1.49 0.63 -0.75 4.37 3.41 -1.26 -2.33 113.62 116.20 1nrl n SER 167 Ca -0.12 0.71 0.06 0.00 -0.26 0.00 0.00 58.87 59.27 1nrl n SER 167 Cb 0.55 -0.82 0.18 0.00 -0.26 0.00 0.00 64.21 63.86 1nrl n SER 167 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 1nrl n HIS 168 N -2.26 0.56 -3.19 7.33 8.25 -1.26 -4.89 115.22 119.76 1nrl n HIS 168 Ca 0.01 -0.51 -0.43 0.00 -0.26 0.00 0.00 57.72 56.52 1nrl n HIS 168 Cb 0.15 -0.04 -0.07 0.00 1.12 0.00 0.00 29.99 31.15 1nrl n HIS 168 CO 0.00 0.00 0.00 0.12 0.64 0.00 0.00 176.34 177.10 1nrl s PHE 169 N -1.07 3.09 0.26 4.41 5.36 -0.98 -5.01 117.98 124.04 1nrl s PHE 169 Ca 0.27 -0.28 -0.06 0.00 -0.96 0.00 0.00 56.93 55.91 1nrl s PHE 169 Cb 0.15 -3.25 -0.01 0.00 -0.34 0.00 0.00 43.02 39.57 1nrl s PHE 169 CO 0.18 -0.86 0.37 0.15 -1.46 0.00 0.00 175.22 173.60 1nrl s LYS 170 N 2.55 1.55 -1.42 10.12 1.02 -1.26 -4.93 119.74 127.37 1nrl s LYS 170 Ca 0.17 -1.52 -0.07 0.00 0.02 0.00 0.00 55.97 54.57 1nrl s LYS 170 Cb -0.16 0.40 0.01 0.00 -0.52 0.00 0.00 37.83 37.56 1nrl s LYS 170 CO 0.16 -0.61 0.97 0.09 -0.92 0.00 0.00 175.35 175.04 1nrl n ASN 171 N -0.66 -6.29 -4.95 2.83 3.02 -1.26 -5.00 115.26 102.95 1nrl n ASN 171 Ca 0.00 -0.45 -0.23 0.00 -0.03 0.00 0.00 54.58 53.88 1nrl n ASN 171 Cb 0.63 -4.99 -0.02 0.00 -0.61 0.00 0.00 39.78 34.80 1nrl n ASN 171 CO 0.00 0.00 0.00 0.72 -2.62 0.00 0.00 177.26 175.36 1nrl s PHE 172 N -3.27 3.47 0.62 3.10 -0.12 -1.26 -5.10 117.98 115.43 1nrl s PHE 172 Ca 0.48 0.16 -0.11 0.00 -0.05 0.00 0.00 56.93 57.41 1nrl s PHE 172 Cb -0.21 -1.72 -0.04 0.00 -0.63 0.00 0.00 43.02 40.42 1nrl s PHE 172 CO 0.60 0.33 1.03 1.03 -0.05 0.00 0.00 175.22 178.16 1nrl s ARG 173 N -3.95 3.53 0.01 1.99 0.52 -1.26 -5.06 118.95 114.73 1nrl s ARG 173 Ca 0.37 0.79 -0.03 0.00 -0.52 0.00 0.00 55.73 56.34 1nrl s ARG 173 Cb -0.10 -2.07 -0.01 0.00 0.52 0.00 0.00 34.95 33.29 1nrl s ARG 173 CO 0.31 -0.63 0.04 -0.51 0.02 0.00 0.00 175.30 174.53 1nrl s LEU 174 N -5.16 1.97 0.48 2.53 1.43 -1.26 -4.17 118.68 114.50 1nrl s LEU 174 Ca 0.56 -0.39 -0.24 0.00 -1.03 0.00 0.00 54.13 53.03 1nrl s LEU 174 Cb -0.11 0.32 -0.07 0.00 0.03 0.00 0.00 46.19 46.36 1nrl s LEU 174 CO 0.53 -0.33 1.40 -2.16 0.23 0.00 0.00 176.35 176.02 1nrl s PRO 175 N -1.43 3.54 0.64 1.29 0.04 -1.26 -4.92 135.00 132.90 1nrl s PRO 175 Ca -0.15 2.34 -0.17 0.00 0.04 0.00 0.00 61.00 63.05 1nrl s PRO 175 Cb -0.09 -2.54 -0.05 0.00 0.04 0.00 0.00 34.50 31.86 1nrl s PRO 175 CO 0.00 -0.91 0.71 0.41 0.04 0.00 0.00 177.00 177.25 1nrl n GLY 176 N 0.62 -1.02 1.80 0.56 0.00 -1.26 -5.13 105.19 100.76 1nrl n GLY 176 Ca 0.07 -0.24 -0.15 0.00 0.00 0.00 0.00 46.02 45.69 1nrl n GLY 176 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 1nrl n VAL 177 N -2.01 2.55 -0.01 1.61 3.14 -1.26 -5.19 118.33 117.15 1nrl n VAL 177 Ca 0.12 -1.42 -0.12 0.00 -2.96 0.00 0.00 64.34 59.96 1nrl n VAL 177 Cb 0.48 -1.13 -0.10 0.00 -1.06 0.00 0.00 33.84 32.04 1nrl n VAL 177 CO 0.00 0.00 0.00 0.03 -6.46 0.00 0.00 176.83 170.40 1nrl h ARG 193 N 1.14 -0.06 -0.16 1.45 2.47 -2.05 -3.55 114.38 113.61 1nrl h ARG 193 Ca 0.30 0.00 -0.01 0.00 -1.26 0.00 0.00 59.98 59.02 1nrl h ARG 193 Cb 1.26 0.01 -0.01 0.00 -1.65 0.00 0.00 29.97 29.58 1nrl h ARG 193 CO 0.69 0.56 0.08 1.05 0.56 0.00 0.00 179.97 182.92 1nrl h GLU 194 N -0.77 0.23 -0.43 0.04 -0.00 -2.06 -1.60 114.58 109.98 1nrl h GLU 194 Ca -0.01 -0.03 0.07 0.00 -0.00 0.00 0.00 59.36 59.39 1nrl h GLU 194 Cb 0.65 -0.04 -0.06 0.00 -0.00 0.00 0.00 28.75 29.30 1nrl h GLU 194 CO 0.01 0.27 0.08 1.49 -0.00 0.00 0.00 179.01 180.86 1nrl h GLU 195 N 0.13 0.20 -0.45 1.06 4.57 -2.07 -0.54 114.58 117.49 1nrl h GLU 195 Ca 0.05 -0.01 0.01 0.00 -1.18 0.00 0.00 59.36 58.23 1nrl h GLU 195 Cb 0.12 -0.05 -0.02 0.00 -0.16 0.00 0.00 28.75 28.64 1nrl h GLU 195 CO -0.01 0.13 0.30 0.00 -1.18 0.00 0.00 179.01 178.25 1nrl h ALA 196 N 1.33 1.69 -0.98 2.92 0.00 -1.97 -1.53 119.26 120.73 1nrl h ALA 196 Ca 0.21 -0.03 0.09 0.00 0.00 0.00 0.00 54.91 55.18 1nrl h ALA 196 Cb 0.27 -0.18 -0.07 0.00 0.00 0.00 0.00 17.79 17.81 1nrl h ALA 196 CO -0.28 0.28 0.63 0.00 0.00 0.00 0.00 179.25 179.88 1nrl h ALA 197 N 1.72 1.50 -0.36 0.00 0.00 -0.09 -0.62 119.26 121.41 1nrl h ALA 197 Ca 0.17 -0.00 0.02 0.00 0.00 0.00 0.00 54.91 55.10 1nrl h ALA 197 Cb -0.05 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.46 1nrl h ALA 197 CO -0.04 0.31 0.19 0.87 0.00 0.00 0.00 179.25 180.58 1nrl h LYS 198 N 1.05 0.39 -0.45 0.00 1.57 -1.05 -2.42 116.57 115.65 1nrl h LYS 198 Ca 0.46 -0.02 0.04 0.00 -1.87 0.00 0.00 60.65 59.25 1nrl h LYS 198 Cb 0.34 -0.09 -0.04 0.00 0.08 0.00 0.00 32.23 32.53 1nrl h LYS 198 CO -0.21 0.25 0.22 -1.49 -0.57 0.00 0.00 179.45 177.65 1nrl h TRP 199 N 0.40 0.40 -0.93 -1.35 4.06 -1.09 0.15 115.95 117.58 1nrl h TRP 199 Ca 0.15 0.02 0.09 0.00 2.06 0.00 0.00 58.89 61.20 1nrl h TRP 199 Cb 0.04 -0.11 -0.07 0.00 -1.00 0.00 0.00 29.16 28.02 1nrl h TRP 199 CO -0.09 0.19 0.58 1.03 -3.56 0.00 0.00 178.44 176.59 1nrl h SER 200 N 0.43 0.88 -0.07 -3.49 0.87 -1.09 0.47 113.55 111.55 1nrl h SER 200 Ca 0.20 0.03 -0.02 0.00 -1.23 0.00 0.00 61.79 60.77 1nrl h SER 200 Cb 0.12 -0.15 -0.00 0.00 -0.44 0.00 0.00 62.40 61.92 1nrl h SER 200 CO -0.15 0.52 -0.02 -0.61 -0.53 0.00 0.00 176.83 176.05 1nrl h GLN 201 N 0.99 0.14 -0.65 2.24 5.75 -0.83 -2.68 115.11 120.08 1nrl h GLN 201 Ca 0.43 -0.05 0.06 0.00 -0.15 0.00 0.00 58.65 58.94 1nrl h GLN 201 Cb 0.30 -0.01 -0.06 0.00 1.07 0.00 0.00 27.48 28.79 1nrl h GLN 201 CO -0.22 0.47 0.34 0.28 -2.65 0.00 0.00 178.83 177.05 1nrl h VAL 202 N -0.20 0.94 -0.13 2.39 2.07 -0.08 -0.41 116.25 120.83 1nrl h VAL 202 Ca 0.02 -0.22 -0.01 0.00 0.82 0.00 0.00 66.70 67.31 1nrl h VAL 202 Cb 0.41 0.25 -0.01 0.00 -1.52 0.00 0.00 31.29 30.43 1nrl h VAL 202 CO 0.01 0.12 0.02 0.03 0.02 0.00 0.00 177.57 177.76 1nrl h ARG 203 N 0.63 0.18 -0.00 1.57 3.08 -0.89 -0.67 114.38 118.27 1nrl h ARG 203 Ca 0.29 -0.02 -0.16 0.00 0.07 0.00 0.00 59.98 60.17 1nrl h ARG 203 Cb 0.21 -0.04 -0.02 0.00 0.08 0.00 0.00 29.97 30.20 1nrl h ARG 203 CO -0.20 0.18 -0.74 0.87 -1.07 0.00 0.00 179.97 179.01 1nrl h LYS 204 N 0.18 0.03 0.00 0.04 1.79 -0.78 -1.57 116.57 116.26 1nrl h LYS 204 Ca 0.05 -0.03 0.00 0.00 -2.18 0.00 0.00 60.65 58.48 1nrl h LYS 204 Cb 0.09 0.01 0.00 0.00 -1.58 0.00 0.00 32.23 30.75 1nrl h LYS 204 CO -0.00 0.76 0.00 -0.25 -1.08 0.00 0.00 179.45 178.88 1nrl n ASP 205 N -3.68 0.10 -0.00 0.86 8.00 -0.29 -4.04 116.55 117.50 1nrl n ASP 205 Ca -0.01 0.51 -0.00 0.00 0.71 0.00 0.00 54.79 56.00 1nrl n ASP 205 Cb 0.72 -0.54 -0.00 0.00 -0.02 0.00 0.00 41.12 41.28 1nrl n ASP 205 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 1nrl n LEU 206 N -1.60 0.00 0.26 0.64 4.77 -1.02 -4.75 117.00 115.29 1nrl n LEU 206 Ca 0.06 0.00 0.17 0.00 -0.03 0.00 0.00 56.01 56.20 1nrl n LEU 206 Cb 0.29 0.01 0.90 0.00 -2.33 0.00 0.00 43.42 42.29 1nrl n LEU 206 CO 0.23 0.01 1.02 0.00 -1.33 0.00 0.00 177.39 177.31 1nrl n SER 208 N -2.67 2.75 -0.69 0.00 7.64 -1.26 -4.41 113.62 114.96 1nrl n SER 208 Ca -0.02 -1.80 0.05 0.00 1.01 0.00 0.00 58.87 58.10 1nrl n SER 208 Cb 0.08 -0.13 0.20 0.00 -1.01 0.00 0.00 64.21 63.34 1nrl n SER 208 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 1nrl n LEU 209 N 0.94 2.76 -4.73 -3.43 4.77 -0.59 -4.98 117.00 111.75 1nrl n LEU 209 Ca 0.12 -3.89 -0.41 0.00 -0.03 0.00 0.00 56.01 51.80 1nrl n LEU 209 Cb 0.45 -0.50 -0.03 0.00 -2.33 0.00 0.00 43.42 41.00 1nrl n LEU 209 CO 0.11 1.41 0.85 -0.54 -1.33 0.00 0.00 177.39 177.89 1nrl s LYS 210 N -3.16 4.50 0.03 3.23 1.02 -1.24 -5.04 119.74 119.08 1nrl s LYS 210 Ca 0.38 1.78 0.01 0.00 0.02 0.00 0.00 55.97 58.16 1nrl s LYS 210 Cb 0.37 -3.30 -0.02 0.00 -0.52 0.00 0.00 37.83 34.37 1nrl s LYS 210 CO -0.07 -0.10 -0.05 0.14 -0.92 0.00 0.00 175.35 174.36 1nrl s VAL 211 N 0.33 0.25 0.37 3.17 -7.23 -1.26 -2.41 120.40 113.61 1nrl s VAL 211 Ca 0.54 -0.94 0.02 0.00 -1.81 0.00 0.00 61.98 59.78 1nrl s VAL 211 Cb -0.30 -0.37 -0.02 0.00 0.56 0.00 0.00 36.38 36.25 1nrl s VAL 211 CO 0.33 -0.45 0.56 -0.94 -0.31 0.00 0.00 175.10 174.30 1nrl s SER 212 N -1.46 6.09 -0.03 4.85 1.04 0.07 -4.62 113.70 119.64 1nrl s SER 212 Ca -0.14 0.27 0.06 0.00 0.48 0.00 0.00 55.95 56.62 1nrl s SER 212 Cb -0.10 -1.73 -0.01 0.00 0.10 0.00 0.00 66.02 64.28 1nrl s SER 212 CO -0.01 -0.44 -0.21 -0.22 0.98 0.00 0.00 173.24 173.35 1nrl s LEU 213 N -4.35 2.01 -0.06 2.42 0.20 -0.27 -1.67 118.68 116.96 1nrl s LEU 213 Ca 0.43 -0.39 0.02 0.00 0.69 0.00 0.00 54.13 54.88 1nrl s LEU 213 Cb -0.10 -1.09 0.01 0.00 -0.43 0.00 0.00 46.19 44.58 1nrl s LEU 213 CO 0.35 0.23 -0.12 -1.58 -0.29 0.00 0.00 176.35 174.94 1nrl s GLN 214 N -0.29 1.59 -0.24 1.98 0.74 -0.25 0.42 119.66 123.60 1nrl s GLN 214 Ca 0.03 -0.39 0.03 0.00 0.05 0.00 0.00 55.36 55.07 1nrl s GLN 214 Cb -0.10 -1.33 0.05 0.00 1.10 0.00 0.00 33.01 32.73 1nrl s GLN 214 CO 0.01 0.04 -0.12 -0.51 -0.55 0.00 0.00 175.29 174.15 1nrl s LEU 215 N 0.61 3.17 -0.34 3.68 1.43 0.35 -1.08 118.68 126.50 1nrl s LEU 215 Ca -0.13 -1.25 -0.16 0.00 -1.03 0.00 0.00 54.13 51.56 1nrl s LEU 215 Cb -0.15 -1.52 -0.01 0.00 0.03 0.00 0.00 46.19 44.54 1nrl s LEU 215 CO 0.03 -0.16 0.42 -0.13 0.23 0.00 0.00 176.35 176.74 1nrl s ARG 216 N 1.15 3.61 0.66 1.70 0.52 0.07 -0.83 118.95 125.82 1nrl s ARG 216 Ca -0.06 -0.29 -0.12 0.00 -0.52 0.00 0.00 55.73 54.73 1nrl s ARG 216 Cb -0.19 -3.80 -0.01 0.00 0.52 0.00 0.00 34.95 31.48 1nrl s ARG 216 CO -0.06 -0.56 1.05 0.20 0.02 0.00 0.00 175.30 175.95 1nrl s GLY 217 N 1.74 1.78 0.28 -3.53 0.00 0.16 -4.78 107.32 102.96 1nrl s GLY 217 Ca 0.15 0.14 -0.03 0.00 0.00 0.00 0.00 44.72 44.97 1nrl s GLY 217 CO 0.12 0.44 1.92 -2.09 0.00 0.00 0.00 173.10 173.49 1nrl h GLU 218 N -0.37 1.11 0.00 2.90 4.57 -1.97 -1.59 114.58 119.23 1nrl h GLU 218 Ca -0.45 -0.10 0.00 0.00 -1.18 0.00 0.00 59.36 57.63 1nrl h GLU 218 Cb 1.21 -0.23 0.00 0.00 -0.16 0.00 0.00 28.75 29.57 1nrl h GLU 218 CO 0.58 0.79 0.00 -0.40 -1.18 0.00 0.00 179.01 178.79 1nrl n ASP 219 N -4.37 0.00 0.00 1.04 5.68 -1.26 -4.82 116.55 112.82 1nrl n ASP 219 Ca 0.09 0.47 0.00 0.00 -0.50 0.00 0.00 54.79 54.85 1nrl n ASP 219 Cb 0.07 -0.48 0.00 0.00 -1.14 0.00 0.00 41.12 39.57 1nrl n ASP 219 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1nrl n GLY 220 N -0.79 2.21 3.64 6.12 0.00 -0.60 -5.10 105.19 110.68 1nrl n GLY 220 Ca 0.02 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.75 1nrl n GLY 220 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1nrl s SER 221 N -1.65 2.47 -0.06 1.61 1.04 -1.26 -4.74 113.70 111.12 1nrl s SER 221 Ca 0.00 1.46 -0.02 0.00 0.48 0.00 0.00 55.95 57.86 1nrl s SER 221 Cb 0.00 -2.14 0.04 0.00 0.10 0.00 0.00 66.02 64.02 1nrl s SER 221 CO 0.00 -3.26 0.12 -0.69 0.98 0.00 0.00 173.24 170.38 1nrl s VAL 222 N -2.79 -0.13 -0.17 5.02 1.01 -1.26 -0.66 120.40 121.41 1nrl s VAL 222 Ca 0.66 0.28 -0.05 0.00 0.00 0.00 0.00 61.98 62.87 1nrl s VAL 222 Cb -0.20 -0.22 -0.03 0.00 0.00 0.00 0.00 36.38 35.92 1nrl s VAL 222 CO 0.59 0.12 0.01 0.26 0.00 0.00 0.00 175.10 176.08 1nrl s TRP 223 N 1.68 3.13 -0.08 5.22 0.52 -0.01 -4.97 118.94 124.42 1nrl s TRP 223 Ca -0.03 -0.13 0.03 0.00 0.02 0.00 0.00 56.10 55.99 1nrl s TRP 223 Cb -0.12 -2.01 0.01 0.00 -1.15 0.00 0.00 33.47 30.20 1nrl s TRP 223 CO -0.05 0.06 -0.17 1.21 0.02 0.00 0.00 176.95 178.02 1nrl s ASN 224 N 0.34 2.27 -0.20 2.95 3.84 -1.26 -0.49 114.94 122.39 1nrl s ASN 224 Ca -0.01 -0.40 -0.02 0.00 0.21 0.00 0.00 52.86 52.64 1nrl s ASN 224 Cb -0.13 -1.04 -0.00 0.00 -0.55 0.00 0.00 41.25 39.52 1nrl s ASN 224 CO 0.02 0.08 -0.09 -0.47 -2.79 0.00 0.00 177.10 173.84 1nrl s TYR 225 N 0.56 2.89 -0.20 0.43 5.04 0.17 -5.00 117.35 121.25 1nrl s TYR 225 Ca -0.16 -1.03 -0.06 0.00 -2.44 0.00 0.00 57.07 53.38 1nrl s TYR 225 Cb -0.17 -2.02 -0.03 0.00 0.35 0.00 0.00 41.96 40.09 1nrl s TYR 225 CO 0.05 -0.54 0.03 0.21 -1.34 0.00 0.00 175.55 173.96 1nrl s LYS 226 N 1.23 3.73 0.64 4.97 2.20 -1.26 -1.11 119.74 130.13 1nrl s LYS 226 Ca 0.03 -0.46 -0.17 0.00 -0.36 0.00 0.00 55.97 55.01 1nrl s LYS 226 Cb -0.14 -3.15 -0.01 0.00 -1.51 0.00 0.00 37.83 33.01 1nrl s LYS 226 CO -0.04 0.06 1.15 -1.25 -0.36 0.00 0.00 175.35 174.91 1nrl s PRO 227 N 0.91 2.83 0.62 4.03 0.04 -1.26 -5.02 135.00 137.15 1nrl s PRO 227 Ca 0.02 1.58 -0.14 0.00 0.04 0.00 0.00 61.00 62.50 1nrl s PRO 227 Cb -0.14 -1.94 -0.02 0.00 0.04 0.00 0.00 34.50 32.44 1nrl s PRO 227 CO 0.02 -1.26 1.06 -1.25 0.04 0.00 0.00 177.00 175.61 1nrl s PRO 228 N -3.75 3.20 0.71 0.56 0.04 -1.26 -5.03 135.00 129.46 1nrl s PRO 228 Ca 0.71 1.12 -0.11 0.00 0.04 0.00 0.00 61.00 62.77 1nrl s PRO 228 Cb -0.24 -2.02 0.02 0.00 0.04 0.00 0.00 34.50 32.29 1nrl s PRO 228 CO 0.37 -0.90 1.07 0.00 0.04 0.00 0.00 177.00 177.59 1nrl s ALA 229 N -2.64 2.68 -0.63 8.56 0.00 -1.26 -4.88 121.76 123.58 1nrl s ALA 229 Ca 0.62 -0.08 -0.27 0.00 0.00 0.00 0.00 51.96 52.23 1nrl s ALA 229 Cb -0.15 -3.12 -0.01 0.00 0.00 0.00 0.00 23.12 19.84 1nrl s ALA 229 CO 0.42 -1.24 1.77 0.34 0.00 0.00 0.00 175.76 177.06 1nrl s ASP 230 N -3.97 5.40 -0.38 0.00 3.68 -1.26 -4.79 116.67 115.35 1nrl s ASP 230 Ca 0.58 0.22 0.05 0.00 2.13 0.00 0.00 52.55 55.53 1nrl s ASP 230 Cb -0.13 -2.53 0.47 0.00 -1.45 0.00 0.00 42.92 39.27 1nrl s ASP 230 CO 0.54 -2.30 1.45 -0.24 0.13 0.00 0.00 175.17 174.75 1nrl n SER 231 N 12.25 5.00 0.00 -0.34 2.88 -1.26 -4.96 113.62 127.19 1nrl n SER 231 Ca 0.18 -3.78 0.00 0.00 -1.33 0.00 0.00 58.87 53.94 1nrl n SER 231 Cb 0.52 -0.56 0.00 0.00 -0.75 0.00 0.00 64.21 63.42 1nrl n SER 231 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1nrl n GLY 232 N -0.86 0.96 0.00 0.46 0.00 -1.26 -5.05 105.19 99.44 1nrl n GLY 232 Ca 0.46 -0.27 0.00 0.00 0.00 0.00 0.00 46.02 46.20 1nrl n GLY 232 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1nrl n GLY 233 N 0.00 1.15 0.00 -0.02 0.00 -1.26 -5.02 105.19 100.04 1nrl n GLY 233 Ca 0.00 0.50 0.00 0.00 0.00 0.00 0.00 46.02 46.52 1nrl n GLY 233 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1nrl n LYS 234 N 0.00 0.00 0.26 1.61 3.00 -1.26 -4.89 118.16 116.88 1nrl n LYS 234 Ca 0.00 0.00 0.14 0.00 -0.00 0.00 0.00 58.31 58.45 1nrl n LYS 234 Cb 0.00 0.00 0.65 0.00 0.00 0.00 0.00 35.03 35.68 1nrl n LYS 234 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 177.40 178.45 1nrl h GLU 235 N 0.00 0.00 0.00 1.64 9.09 -1.95 -1.96 114.58 121.40 1nrl h GLU 235 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.41 1nrl h GLU 235 Cb 0.00 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.10 1nrl h GLU 235 CO 0.00 0.11 0.00 0.44 0.05 0.00 0.00 179.01 179.61 1nrl n ILE 236 N -3.32 0.88 0.62 -1.06 -5.35 -1.26 -2.13 119.36 107.75 1nrl n ILE 236 Ca -0.00 0.22 0.09 0.00 -0.27 0.00 0.00 62.75 62.78 1nrl n ILE 236 Cb 0.32 -0.97 0.09 0.00 -1.74 0.00 0.00 39.64 37.34 1nrl n ILE 236 CO 0.00 0.00 0.00 0.49 -1.76 0.00 0.00 176.55 175.28 1nrl n PHE 237 N -1.45 0.07 -0.35 4.28 0.99 -0.74 -4.69 117.46 115.58 1nrl n PHE 237 Ca 0.04 -0.05 0.30 0.00 -0.00 0.00 0.00 57.45 57.75 1nrl n PHE 237 Cb 0.16 -0.00 0.63 0.00 -1.00 0.00 0.00 39.48 39.27 1nrl n PHE 237 CO 0.00 0.00 0.00 0.66 -0.00 0.00 0.00 176.76 177.42 1nrl h SER 238 N 3.34 0.24 0.13 4.37 4.64 -1.52 -0.84 113.55 123.91 1nrl h SER 238 Ca 0.00 0.06 0.00 0.00 -0.47 0.00 0.00 61.79 61.38 1nrl h SER 238 Cb 0.73 0.02 0.00 0.00 -0.31 0.00 0.00 62.40 62.84 1nrl h SER 238 CO 0.00 0.02 -0.52 0.18 -0.87 0.00 0.00 176.83 175.64 1nrl n LEU 239 N -4.45 1.35 -0.20 5.97 4.77 -1.26 -4.15 117.00 119.02 1nrl n LEU 239 Ca 0.27 -0.47 -0.05 0.00 -0.03 0.00 0.00 56.01 55.73 1nrl n LEU 239 Cb 1.11 -0.07 0.04 0.00 -2.33 0.00 0.00 43.42 42.18 1nrl n LEU 239 CO 0.31 0.27 1.11 -0.07 -1.33 0.00 0.00 177.39 177.68 1nrl h LEU 240 N 1.30 0.64 -0.75 2.23 3.38 -1.48 -0.51 115.31 120.12 1nrl h LEU 240 Ca 0.00 -0.01 0.04 0.00 0.09 0.00 0.00 57.88 58.00 1nrl h LEU 240 Cb 0.60 -0.15 -0.05 0.00 0.09 0.00 0.00 40.66 41.15 1nrl h LEU 240 CO 0.00 0.46 0.47 -0.65 0.09 0.00 0.00 178.44 178.80 1nrl h PRO 241 N 0.76 0.87 -0.17 1.13 0.11 -1.79 0.26 132.00 133.17 1nrl h PRO 241 Ca 0.23 -0.05 -0.01 0.00 0.11 0.00 0.00 66.00 66.27 1nrl h PRO 241 Cb -0.04 -0.20 -0.01 0.00 0.11 0.00 0.00 31.00 30.86 1nrl h PRO 241 CO -0.07 0.57 0.07 1.25 -0.21 0.00 0.00 178.00 179.62 1nrl h HIS 242 N 0.89 0.26 -0.96 0.65 -0.00 -1.64 -2.16 115.15 112.18 1nrl h HIS 242 Ca 0.31 -0.02 0.09 0.00 -0.00 0.00 0.00 60.37 60.76 1nrl h HIS 242 Cb 0.07 -0.08 -0.07 0.00 -0.00 0.00 0.00 27.41 27.33 1nrl h HIS 242 CO -0.04 0.31 0.62 0.52 -0.00 0.00 0.00 177.93 179.33 1nrl h MET 243 N 0.13 0.98 -0.43 5.26 2.86 -0.35 -0.63 114.93 122.75 1nrl h MET 243 Ca 0.06 -0.06 -0.03 0.00 -2.06 0.00 0.00 59.70 57.61 1nrl h MET 243 Cb 0.16 -0.22 -0.02 0.00 0.06 0.00 0.00 31.60 31.58 1nrl h MET 243 CO -0.01 0.65 0.17 0.00 1.06 0.00 0.00 176.91 178.78 1nrl h ALA 244 N 1.52 0.56 -0.58 6.32 0.00 -0.20 0.09 119.26 126.98 1nrl h ALA 244 Ca 0.45 -0.15 -0.07 0.00 0.00 0.00 0.00 54.91 55.14 1nrl h ALA 244 Cb 0.36 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.96 1nrl h ALA 244 CO -0.20 0.18 0.07 -0.44 0.00 0.00 0.00 179.25 178.85 1nrl h ASP 245 N 0.56 0.94 -0.25 0.00 3.32 -0.65 -0.20 116.42 120.13 1nrl h ASP 245 Ca 0.14 -0.27 -0.04 0.00 0.02 0.00 0.00 57.03 56.88 1nrl h ASP 245 Cb 0.20 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 39.49 1nrl h ASP 245 CO -0.01 0.97 -0.00 -0.03 -1.72 0.00 0.00 179.24 178.45 1nrl h MET 246 N 0.86 0.45 -0.65 3.56 1.85 -1.01 -1.59 114.93 118.41 1nrl h MET 246 Ca 0.17 -0.15 -0.04 0.00 -0.61 0.00 0.00 59.70 59.08 1nrl h MET 246 Cb 0.45 -0.04 -0.03 0.00 0.43 0.00 0.00 31.60 32.41 1nrl h MET 246 CO 0.02 0.62 0.24 0.77 -0.40 0.00 0.00 176.91 178.16 1nrl h SER 247 N 0.23 0.88 -0.59 1.39 0.02 -0.88 -1.16 113.55 113.43 1nrl h SER 247 Ca 0.07 -0.13 -0.09 0.00 -0.84 0.00 0.00 61.79 60.80 1nrl h SER 247 Cb 0.42 -0.23 -0.02 0.00 0.14 0.00 0.00 62.40 62.71 1nrl h SER 247 CO 0.01 0.80 0.01 0.74 -1.14 0.00 0.00 176.83 177.25 1nrl h THR 248 N 0.94 1.26 -0.54 -2.27 2.02 -0.90 0.11 112.91 113.53 1nrl h THR 248 Ca 0.22 -1.13 -0.01 0.00 0.77 0.00 0.00 66.41 66.26 1nrl h THR 248 Cb 0.20 0.79 -0.03 0.00 -1.74 0.00 0.00 68.15 67.37 1nrl h THR 248 CO -0.02 0.41 0.31 0.22 0.37 0.00 0.00 175.52 176.82 1nrl h TYR 249 N 0.96 0.74 -0.49 3.16 3.20 -0.80 -1.31 116.97 122.43 1nrl h TYR 249 Ca 0.17 -0.01 -0.04 0.00 3.14 0.00 0.00 58.73 61.99 1nrl h TYR 249 Cb 0.54 -0.24 -0.02 0.00 1.54 0.00 0.00 36.73 38.55 1nrl h TYR 249 CO 0.04 0.53 0.15 0.52 -1.64 0.00 0.00 178.16 177.75 1nrl h MET 250 N 0.73 0.76 -0.64 1.82 2.86 -0.77 -2.74 114.93 116.95 1nrl h MET 250 Ca 0.19 -0.17 0.00 0.00 -2.06 0.00 0.00 59.70 57.67 1nrl h MET 250 Cb 0.02 -0.11 -0.03 0.00 0.06 0.00 0.00 31.60 31.54 1nrl h MET 250 CO -0.03 0.72 0.41 0.74 1.06 0.00 0.00 176.91 179.80 1nrl h PHE 251 N 0.65 0.81 -0.67 -0.22 0.05 -0.43 -0.76 116.94 116.38 1nrl h PHE 251 Ca 0.16 0.01 -0.08 0.00 3.82 0.00 0.00 57.97 61.88 1nrl h PHE 251 Cb 0.28 -0.27 -0.03 0.00 2.00 0.00 0.00 35.95 37.93 1nrl h PHE 251 CO 0.02 0.53 0.11 0.87 -0.18 0.00 0.00 178.31 179.65 1nrl h LYS 252 N 0.87 1.10 -0.35 1.51 1.57 -0.99 -0.62 116.57 119.66 1nrl h LYS 252 Ca 0.23 -0.29 -0.07 0.00 -1.87 0.00 0.00 60.65 58.65 1nrl h LYS 252 Cb -0.07 -0.13 -0.02 0.00 0.08 0.00 0.00 32.23 32.09 1nrl h LYS 252 CO -0.05 1.00 -0.08 0.78 -0.57 0.00 0.00 179.45 180.54 1nrl h GLY 253 N 1.05 0.63 1.41 3.86 0.00 -1.00 -1.40 103.07 107.62 1nrl h GLY 253 Ca 0.20 -0.42 -0.13 0.00 0.00 0.00 0.00 47.33 46.99 1nrl h GLY 253 CO 0.01 0.39 -0.34 -2.22 0.00 0.00 0.00 176.54 174.38 1nrl h ILE 254 N 0.54 1.29 -0.40 2.60 1.08 -0.63 -0.94 117.51 121.05 1nrl h ILE 254 Ca 0.10 -1.48 -0.12 0.00 -0.39 0.00 0.00 64.86 62.98 1nrl h ILE 254 Cb 0.46 1.42 -0.01 0.00 -3.07 0.00 0.00 36.82 35.62 1nrl h ILE 254 CO 0.02 0.48 -0.20 0.40 -0.69 0.00 0.00 178.15 178.16 1nrl h ILE 255 N 0.56 1.28 -0.74 -0.67 2.04 -0.81 -2.02 117.51 117.14 1nrl h ILE 255 Ca 0.06 -1.35 -0.04 0.00 1.00 0.00 0.00 64.86 64.54 1nrl h ILE 255 Cb 0.84 1.30 -0.03 0.00 -0.74 0.00 0.00 36.82 38.19 1nrl h ILE 255 CO 0.07 0.45 0.32 0.28 0.00 0.00 0.00 178.15 179.27 1nrl h SER 256 N 0.65 0.98 -0.13 1.72 0.02 -1.05 -0.36 113.55 115.38 1nrl h SER 256 Ca 0.09 -0.13 0.02 0.00 -0.84 0.00 0.00 61.79 60.92 1nrl h SER 256 Cb 0.76 -0.25 -0.02 0.00 0.14 0.00 0.00 62.40 63.03 1nrl h SER 256 CO 0.06 0.86 0.01 0.15 -1.14 0.00 0.00 176.83 176.77 1nrl h PHE 257 N 1.06 0.01 -0.42 3.45 3.57 -0.96 -2.37 116.94 121.29 1nrl h PHE 257 Ca 0.25 0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.75 1nrl h PHE 257 Cb 0.17 0.01 -0.02 0.00 2.79 0.00 0.00 35.95 38.90 1nrl h PHE 257 CO 0.02 -0.00 0.23 0.00 -2.23 0.00 0.00 178.31 176.32 1nrl h ALA 258 N 1.10 0.53 -0.64 2.41 0.00 -0.88 -3.05 119.26 118.73 1nrl h ALA 258 Ca 0.06 -0.08 0.10 0.00 0.00 0.00 0.00 54.91 54.99 1nrl h ALA 258 Cb 0.06 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 17.65 1nrl h ALA 258 CO -0.09 0.05 0.43 0.87 0.00 0.00 0.00 179.25 180.51 1nrl h LYS 259 N 0.54 0.45 -0.00 0.00 1.57 -0.71 -2.00 116.57 116.43 1nrl h LYS 259 Ca 0.15 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.90 1nrl h LYS 259 Cb 0.04 -0.10 0.00 0.00 0.08 0.00 0.00 32.23 32.25 1nrl h LYS 259 CO -0.02 0.30 -0.11 1.33 -0.57 0.00 0.00 179.45 180.38 1nrl n VAL 260 N -4.48 0.00 -2.86 0.50 0.24 -0.92 -4.67 118.33 106.14 1nrl n VAL 260 Ca 0.11 -0.01 -0.42 0.00 -2.04 0.00 0.00 64.34 61.97 1nrl n VAL 260 Cb 0.37 -0.29 -0.04 0.00 -1.47 0.00 0.00 33.84 32.41 1nrl n VAL 260 CO 0.00 0.00 0.00 -0.63 -2.14 0.00 0.00 176.83 174.06 1nrl s ILE 261 N -2.81 4.65 0.19 1.34 1.01 -0.75 -4.96 121.20 119.87 1nrl s ILE 261 Ca 0.19 1.11 -0.19 0.00 0.00 0.00 0.00 60.65 61.76 1nrl s ILE 261 Cb 0.19 -4.28 0.15 0.00 0.01 0.00 0.00 42.46 38.53 1nrl s ILE 261 CO 0.54 -0.47 1.60 0.77 0.00 0.00 0.00 174.94 177.37 1nrl h SER 262 N 8.43 -0.96 -0.49 3.58 4.64 -1.86 0.12 113.55 127.01 1nrl h SER 262 Ca -0.24 0.21 0.13 0.00 -0.47 0.00 0.00 61.79 61.42 1nrl h SER 262 Cb 1.08 0.50 -0.02 0.00 -0.31 0.00 0.00 62.40 63.66 1nrl h SER 262 CO 0.95 -0.28 0.35 1.88 -0.87 0.00 0.00 176.83 178.86 1nrl h TYR 263 N -0.13 0.06 0.01 4.77 -1.99 -1.94 -1.78 116.97 115.97 1nrl h TYR 263 Ca 0.24 0.00 -0.10 0.00 2.00 0.00 0.00 58.73 60.88 1nrl h TYR 263 Cb 0.52 -0.02 0.01 0.00 2.00 0.00 0.00 36.73 39.24 1nrl h TYR 263 CO -0.58 0.03 -0.38 0.35 -0.00 0.00 0.00 178.16 177.58 1nrl h PHE 264 N 0.06 0.36 0.00 4.88 3.57 -1.27 -3.31 116.94 121.23 1nrl h PHE 264 Ca 0.23 -0.20 -0.00 0.00 3.53 0.00 0.00 57.97 61.53 1nrl h PHE 264 Cb 0.86 -0.04 -0.00 0.00 2.79 0.00 0.00 35.95 39.56 1nrl h PHE 264 CO -0.00 1.03 -0.01 0.00 -2.23 0.00 0.00 178.31 177.10 1nrl h ARG 265 N -0.41 0.00 0.00 1.11 3.08 -0.53 -2.13 114.38 115.50 1nrl h ARG 265 Ca -0.05 0.00 -0.05 0.00 0.07 0.00 0.00 59.98 59.95 1nrl h ARG 265 Cb 1.14 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 31.19 1nrl h ARG 265 CO 0.07 0.01 -0.22 -0.44 -1.07 0.00 0.00 179.97 178.32 1nrl h ASP 266 N 0.00 0.00 -4.23 7.04 3.32 -1.47 -3.45 116.42 117.63 1nrl h ASP 266 Ca -0.00 0.00 -0.52 0.00 0.02 0.00 0.00 57.03 56.53 1nrl h ASP 266 Cb 0.01 0.00 0.13 0.00 0.22 0.00 0.00 39.33 39.69 1nrl h ASP 266 CO 0.00 0.22 0.35 -0.76 -1.72 0.00 0.00 179.24 177.33 1nrl s LEU 267 N -6.67 3.24 0.64 1.55 1.43 -0.80 -4.97 118.68 113.10 1nrl s LEU 267 Ca 0.01 2.05 -0.18 0.00 -1.03 0.00 0.00 54.13 54.99 1nrl s LEU 267 Cb 0.10 -4.55 -0.01 0.00 0.03 0.00 0.00 46.19 41.75 1nrl s LEU 267 CO 0.64 -2.01 1.28 -2.84 0.23 0.00 0.00 176.35 173.65 1nrl s PRO 268 N -4.30 2.59 0.47 1.29 0.02 -1.26 -4.80 135.00 129.02 1nrl s PRO 268 Ca 0.67 2.02 0.16 0.00 0.02 0.00 0.00 61.00 63.87 1nrl s PRO 268 Cb -0.22 -1.86 1.14 0.00 0.02 0.00 0.00 34.50 33.58 1nrl s PRO 268 CO 0.47 -1.55 2.03 0.97 -0.33 0.00 0.00 177.00 178.59 1nrl h ILE 269 N 0.56 0.91 -0.36 2.83 6.09 -1.93 -1.73 117.51 123.89 1nrl h ILE 269 Ca -0.51 -0.09 -0.06 0.00 -1.37 0.00 0.00 64.86 62.83 1nrl h ILE 269 Cb 1.33 0.63 -0.01 0.00 0.47 0.00 0.00 36.82 39.24 1nrl h ILE 269 CO 0.53 0.05 -0.02 -0.33 -3.07 0.00 0.00 178.15 175.30 1nrl h GLU 270 N 0.25 0.65 -0.13 2.19 3.07 -1.98 -2.40 114.58 116.23 1nrl h GLU 270 Ca 0.20 -0.22 -0.12 0.00 -0.50 0.00 0.00 59.36 58.72 1nrl h GLU 270 Cb 0.46 -0.05 -0.01 0.00 -0.84 0.00 0.00 28.75 28.30 1nrl h GLU 270 CO -0.04 0.78 -0.43 -0.44 -1.40 0.00 0.00 179.01 177.48 1nrl h ASP 271 N 0.46 0.32 -0.71 1.42 3.45 -1.67 -1.11 116.42 118.57 1nrl h ASP 271 Ca 0.10 -0.14 0.01 0.00 0.43 0.00 0.00 57.03 57.43 1nrl h ASP 271 Cb 0.50 -0.09 -0.03 0.00 -0.56 0.00 0.00 39.33 39.14 1nrl h ASP 271 CO 0.02 0.71 0.46 1.56 -1.57 0.00 0.00 179.24 180.43 1nrl h GLN 272 N 0.25 0.93 -0.17 3.56 4.20 -1.21 0.27 115.11 122.94 1nrl h GLN 272 Ca 0.02 -0.06 -0.03 0.00 0.06 0.00 0.00 58.65 58.64 1nrl h GLN 272 Cb 0.86 -0.21 -0.01 0.00 0.30 0.00 0.00 27.48 28.43 1nrl h GLN 272 CO 0.07 0.63 -0.01 0.82 -0.67 0.00 0.00 178.83 179.66 1nrl h ILE 273 N 0.96 1.27 -0.85 2.54 2.04 -1.11 -1.82 117.51 120.53 1nrl h ILE 273 Ca 0.26 -0.90 -0.03 0.00 1.00 0.00 0.00 64.86 65.19 1nrl h ILE 273 Cb -0.10 1.52 -0.04 0.00 -0.74 0.00 0.00 36.82 37.46 1nrl h ILE 273 CO -0.05 0.27 0.43 0.28 0.00 0.00 0.00 178.15 179.08 1nrl h SER 274 N 0.05 1.09 -0.45 1.72 0.02 -0.78 -0.98 113.55 114.22 1nrl h SER 274 Ca 0.05 -0.12 -0.14 0.00 -0.84 0.00 0.00 61.79 60.74 1nrl h SER 274 Cb 0.41 -0.28 -0.01 0.00 0.14 0.00 0.00 62.40 62.66 1nrl h SER 274 CO 0.01 0.90 -0.27 -0.07 -1.14 0.00 0.00 176.83 176.26 1nrl h LEU 275 N 1.20 1.02 -0.60 5.07 3.38 -0.40 -1.84 115.31 123.15 1nrl h LEU 275 Ca 0.30 -0.42 -0.12 0.00 0.09 0.00 0.00 57.88 57.73 1nrl h LEU 275 Cb 0.08 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.53 1nrl h LEU 275 CO -0.04 1.22 -0.15 -0.07 0.09 0.00 0.00 178.44 179.49 1nrl h LEU 276 N 0.83 0.96 -0.69 1.67 3.38 -1.06 -0.97 115.31 119.43 1nrl h LEU 276 Ca 0.09 -0.33 -0.03 0.00 0.09 0.00 0.00 57.88 57.70 1nrl h LEU 276 Cb 0.86 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 41.32 1nrl h LEU 276 CO 0.08 1.10 0.29 0.11 0.09 0.00 0.00 178.44 180.11 1nrl h LYS 277 N 0.84 1.02 0.00 1.13 1.57 -1.11 -0.17 116.57 119.85 1nrl h LYS 277 Ca 0.13 -0.17 -0.05 0.00 -1.87 0.00 0.00 60.65 58.68 1nrl h LYS 277 Cb 0.70 -0.17 -0.01 0.00 0.08 0.00 0.00 32.23 32.83 1nrl h LYS 277 CO 0.05 0.83 -0.25 0.78 -0.57 0.00 0.00 179.45 180.29 1nrl h GLY 278 N 0.97 0.00 -0.06 3.86 0.00 -1.06 -3.35 103.07 103.43 1nrl h GLY 278 Ca 0.23 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.56 1nrl h GLY 278 CO -0.02 0.00 -0.32 0.00 0.00 0.00 0.00 176.54 176.20 1nrl n ALA 279 N -2.20 2.92 -0.27 3.60 0.00 -0.39 -4.77 120.51 119.39 1nrl n ALA 279 Ca 0.01 -0.24 -0.01 0.00 0.00 0.00 0.00 53.44 53.20 1nrl n ALA 279 Cb 0.52 -0.27 0.05 0.00 0.00 0.00 0.00 19.45 19.76 1nrl n ALA 279 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1nrl h ALA 280 N 1.08 0.24 -0.25 0.00 0.00 -1.17 -0.42 119.26 118.75 1nrl h ALA 280 Ca 0.00 0.25 0.00 0.00 0.00 0.00 0.00 54.91 55.16 1nrl h ALA 280 Cb 0.19 0.76 -0.01 0.00 0.00 0.00 0.00 17.79 18.73 1nrl h ALA 280 CO 0.00 -0.55 0.16 0.35 0.00 0.00 0.00 179.25 179.21 1nrl h PHE 281 N -0.06 0.32 -0.03 0.00 3.57 -1.86 -1.67 116.94 117.21 1nrl h PHE 281 Ca 0.32 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.83 1nrl h PHE 281 Cb 0.58 -0.11 -0.00 0.00 2.79 0.00 0.00 35.95 39.21 1nrl h PHE 281 CO -0.69 0.22 0.02 0.93 -2.23 0.00 0.00 178.31 176.56 1nrl h GLU 282 N 0.33 0.04 -0.76 1.11 5.08 -1.55 -0.68 114.58 118.16 1nrl h GLU 282 Ca 0.09 -0.00 -0.05 0.00 -1.00 0.00 0.00 59.36 58.40 1nrl h GLU 282 Cb -0.02 -0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.19 1nrl h GLU 282 CO -0.02 0.03 0.28 -0.07 -1.00 0.00 0.00 179.01 178.23 1nrl h LEU 283 N 0.05 1.07 -0.29 1.33 -0.00 -1.10 -0.63 115.31 115.73 1nrl h LEU 283 Ca 0.01 -0.19 -0.00 0.00 -0.00 0.00 0.00 57.88 57.71 1nrl h LEU 283 Cb -0.00 -0.28 -0.01 0.00 -0.00 0.00 0.00 40.66 40.36 1nrl h LEU 283 CO -0.00 0.96 0.18 0.00 -0.00 0.00 0.00 178.44 179.58 1nrl h GLN 285 N 0.38 0.95 -0.70 0.00 1.08 -0.86 0.53 115.11 116.49 1nrl h GLN 285 Ca 0.11 -0.26 -0.01 0.00 -1.45 0.00 0.00 58.65 57.04 1nrl h GLN 285 Cb -0.00 -0.11 -0.03 0.00 -0.05 0.00 0.00 27.48 27.28 1nrl h GLN 285 CO -0.02 0.91 0.40 -0.07 -0.95 0.00 0.00 178.83 179.10 1nrl h LEU 286 N 0.89 0.86 -0.52 1.46 3.38 -0.90 0.63 115.31 121.11 1nrl h LEU 286 Ca 0.17 -0.08 -0.07 0.00 0.09 0.00 0.00 57.88 58.00 1nrl h LEU 286 Cb 0.45 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.96 1nrl h LEU 286 CO 0.02 0.69 0.06 0.03 0.09 0.00 0.00 178.44 179.32 1nrl h ARG 287 N 0.96 0.87 -0.79 1.13 3.08 -0.87 -2.65 114.38 116.12 1nrl h ARG 287 Ca 0.25 -0.25 0.01 0.00 0.07 0.00 0.00 59.98 60.06 1nrl h ARG 287 Cb 0.00 -0.09 -0.04 0.00 0.08 0.00 0.00 29.97 29.92 1nrl h ARG 287 CO -0.04 0.87 0.52 0.74 -1.07 0.00 0.00 179.97 180.98 1nrl h PHE 288 N 0.75 1.00 -0.44 3.04 0.05 -0.42 -2.06 116.94 118.86 1nrl h PHE 288 Ca 0.15 0.02 0.03 0.00 3.82 0.00 0.00 57.97 61.99 1nrl h PHE 288 Cb 0.44 -0.34 -0.02 0.00 2.00 0.00 0.00 35.95 38.03 1nrl h PHE 288 CO 0.03 0.63 0.29 -0.97 -0.18 0.00 0.00 178.31 178.12 1nrl h ASN 289 N 1.07 0.43 0.76 2.17 -0.73 -0.52 -1.01 115.58 117.75 1nrl h ASN 289 Ca 0.29 -0.01 0.00 0.00 1.87 0.00 0.00 56.30 58.45 1nrl h ASN 289 Cb -0.11 -0.10 0.00 0.00 0.27 0.00 0.00 38.32 38.38 1nrl h ASN 289 CO -0.06 0.30 0.00 0.71 -0.37 0.00 0.00 177.43 178.01 1nrl h THR 290 N 0.50 0.00 -0.41 -3.57 1.35 -1.28 -1.95 112.91 107.54 1nrl h THR 290 Ca 0.17 -0.35 0.00 0.00 -0.55 0.00 0.00 66.41 65.68 1nrl h THR 290 Cb 0.08 1.27 0.00 0.00 -1.73 0.00 0.00 68.15 67.77 1nrl h THR 290 CO -0.04 0.00 0.00 1.33 -0.25 0.00 0.00 175.52 176.56 1nrl n VAL 291 N -2.86 1.16 -2.88 6.82 0.24 -0.43 -4.98 118.33 115.39 1nrl n VAL 291 Ca 0.00 -1.09 -0.41 0.00 -2.04 0.00 0.00 64.34 60.81 1nrl n VAL 291 Cb 0.24 0.42 -0.04 0.00 -1.47 0.00 0.00 33.84 32.99 1nrl n VAL 291 CO 0.00 0.00 0.00 0.12 -2.14 0.00 0.00 176.83 174.81 1nrl s PHE 292 N -1.20 3.63 -0.45 6.34 5.36 -0.74 -0.93 117.98 129.98 1nrl s PHE 292 Ca 0.30 1.49 -0.14 0.00 -0.96 0.00 0.00 56.93 57.62 1nrl s PHE 292 Cb 0.17 -2.96 0.07 0.00 -0.34 0.00 0.00 43.02 39.96 1nrl s PHE 292 CO 0.18 0.05 0.35 1.21 -1.46 0.00 0.00 175.22 175.56 1nrl s ASN 293 N 0.84 6.04 0.39 6.13 3.84 0.28 -4.94 114.94 127.51 1nrl s ASN 293 Ca 0.45 -1.29 0.17 0.00 0.21 0.00 0.00 52.86 52.40 1nrl s ASN 293 Cb -0.20 -2.14 0.81 0.00 -0.55 0.00 0.00 41.25 39.17 1nrl s ASN 293 CO 0.23 -0.59 1.82 0.00 -2.79 0.00 0.00 177.10 175.77 1nrl h ALA 294 N 8.66 1.19 -0.46 1.71 0.00 -1.95 0.69 119.26 129.10 1nrl h ALA 294 Ca -0.27 -0.32 -0.12 0.00 0.00 0.00 0.00 54.91 54.20 1nrl h ALA 294 Cb 1.11 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.83 1nrl h ALA 294 CO 0.83 0.43 -0.20 0.93 0.00 0.00 0.00 179.25 181.24 1nrl h GLU 295 N 0.00 0.92 -0.02 0.00 4.39 -1.96 -3.24 114.58 114.67 1nrl h GLU 295 Ca -0.00 -0.38 0.00 0.00 0.34 0.00 0.00 59.36 59.32 1nrl h GLU 295 Cb 0.72 -0.04 0.00 0.00 -0.10 0.00 0.00 28.75 29.33 1nrl h GLU 295 CO 0.05 1.03 -0.07 0.25 -1.16 0.00 0.00 179.01 179.11 1nrl n THR 296 N -4.12 0.00 -3.54 1.13 -2.24 -1.17 -5.00 114.28 99.35 1nrl n THR 296 Ca 0.00 -0.46 -0.23 0.00 -2.27 0.00 0.00 64.05 61.09 1nrl n THR 296 Cb 0.44 1.32 0.08 0.00 -2.10 0.00 0.00 70.33 70.07 1nrl n THR 296 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1nrl n GLY 297 N 1.01 -0.47 2.92 3.38 0.00 0.21 -4.68 105.19 107.55 1nrl n GLY 297 Ca 0.09 0.21 -0.11 0.00 0.00 0.00 0.00 46.02 46.21 1nrl n GLY 297 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1nrl s THR 298 N -3.31 0.09 -0.36 2.61 -1.32 -1.02 -0.54 115.64 111.79 1nrl s THR 298 Ca 0.54 -0.36 -0.21 0.00 -1.21 0.00 0.00 61.69 60.46 1nrl s THR 298 Cb -0.24 -0.14 0.00 0.00 -1.51 0.00 0.00 72.50 70.61 1nrl s THR 298 CO 0.70 -0.17 0.66 0.26 -2.21 0.00 0.00 174.62 173.85 1nrl s TRP 299 N -0.54 3.14 -0.73 9.09 0.51 -0.11 -0.56 118.94 129.74 1nrl s TRP 299 Ca -0.05 0.38 -0.20 0.00 -2.12 0.00 0.00 56.10 54.10 1nrl s TRP 299 Cb -0.04 -3.18 0.11 0.00 -0.81 0.00 0.00 33.47 29.55 1nrl s TRP 299 CO -0.00 -0.65 0.93 -1.21 -0.51 0.00 0.00 176.95 175.51 1nrl s GLU 300 N 2.77 3.26 -0.98 4.98 2.02 -0.11 -1.88 118.70 128.76 1nrl s GLU 300 Ca 0.25 -1.34 -0.03 0.00 0.02 0.00 0.00 54.97 53.87 1nrl s GLU 300 Cb -0.14 -4.46 0.28 0.00 0.10 0.00 0.00 34.13 29.91 1nrl s GLU 300 CO 0.15 -1.70 1.17 0.00 0.02 0.00 0.00 175.26 174.91 1nrl n GLY 302 N 1.67 3.55 0.00 0.00 0.00 -1.26 -1.62 105.19 107.53 1nrl n GLY 302 Ca 0.26 -0.07 0.14 0.00 0.00 0.00 0.00 46.02 46.34 1nrl n GLY 302 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1nrl n ARG 303 N 13.51 0.15 -4.24 1.61 1.74 -1.26 -4.77 116.66 123.40 1nrl n ARG 303 Ca 0.00 0.02 -0.34 0.00 -0.77 0.00 0.00 57.85 56.75 1nrl n ARG 303 Cb 0.00 -1.50 -0.08 0.00 -1.02 0.00 0.00 32.46 29.86 1nrl n ARG 303 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1nrl s LEU 304 N -2.84 3.74 -0.01 0.55 1.43 -0.64 -0.75 118.68 120.16 1nrl s LEU 304 Ca 0.19 0.17 0.01 0.00 -1.03 0.00 0.00 54.13 53.46 1nrl s LEU 304 Cb 0.19 -1.97 0.01 0.00 0.03 0.00 0.00 46.19 44.45 1nrl s LEU 304 CO 0.49 0.35 -0.02 -0.44 0.23 0.00 0.00 176.35 176.95 1nrl s SER 305 N -1.16 0.41 -0.23 2.29 0.01 -0.24 -0.26 113.70 114.51 1nrl s SER 305 Ca 0.16 -0.05 0.00 0.00 1.31 0.00 0.00 55.95 57.38 1nrl s SER 305 Cb -0.12 -0.12 0.03 0.00 0.21 0.00 0.00 66.02 66.03 1nrl s SER 305 CO 0.06 -0.01 -0.11 -0.31 0.41 0.00 0.00 173.24 173.28 1nrl s TYR 306 N 0.32 3.05 -0.20 2.43 1.51 -0.79 -1.09 117.35 122.59 1nrl s TYR 306 Ca -0.03 -1.80 -0.05 0.00 -1.01 0.00 0.00 57.07 54.18 1nrl s TYR 306 Cb -0.06 -1.99 -0.03 0.00 -0.11 0.00 0.00 41.96 39.78 1nrl s TYR 306 CO -0.01 -0.79 0.00 0.00 -1.11 0.00 0.00 175.55 173.64 1nrl s LEU 308 N 0.91 4.35 -0.41 0.00 1.02 0.29 -0.75 118.68 124.10 1nrl s LEU 308 Ca 0.01 2.90 -0.23 0.00 0.02 0.00 0.00 54.13 56.83 1nrl s LEU 308 Cb -0.14 -3.64 0.02 0.00 0.02 0.00 0.00 46.19 42.44 1nrl s LEU 308 CO 0.02 -0.84 0.77 -1.61 0.02 0.00 0.00 176.35 174.71 1nrl s GLU 309 N -0.88 3.55 -0.37 1.70 2.02 -1.01 -4.88 118.70 118.83 1nrl s GLU 309 Ca 0.59 0.05 -0.25 0.00 0.02 0.00 0.00 54.97 55.38 1nrl s GLU 309 Cb -0.46 -3.88 0.01 0.00 0.10 0.00 0.00 34.13 29.90 1nrl s GLU 309 CO 0.50 -0.99 0.89 -0.51 0.02 0.00 0.00 175.26 175.17 1nrl s ASP 310 N 2.00 6.64 0.00 -0.19 1.01 -1.26 -4.95 116.67 119.92 1nrl s ASP 310 Ca 0.30 0.52 0.00 0.00 0.71 0.00 0.00 52.55 54.08 1nrl s ASP 310 Cb -0.13 -2.44 0.00 0.00 1.01 0.00 0.00 42.92 41.36 1nrl s ASP 310 CO 0.20 -0.82 0.00 0.35 0.21 0.00 0.00 175.17 175.11 1nrl n THR 311 N 5.92 0.00 -1.78 -1.27 -2.24 -1.26 -5.00 114.28 108.65 1nrl n THR 311 Ca 0.06 0.00 -0.42 0.00 -2.27 0.00 0.00 64.05 61.42 1nrl n THR 311 Cb 0.48 -0.37 -0.03 0.00 -2.10 0.00 0.00 70.33 68.31 1nrl n THR 311 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1nrl s ALA 312 N -2.04 2.59 0.00 6.98 0.00 -1.26 -2.55 121.76 125.48 1nrl s ALA 312 Ca 0.00 0.37 0.00 0.00 0.00 0.00 0.00 51.96 52.33 1nrl s ALA 312 Cb 0.00 -4.11 0.00 0.00 0.00 0.00 0.00 23.12 19.01 1nrl s ALA 312 CO 0.00 -3.04 0.00 0.41 0.00 0.00 0.00 175.76 173.13 1nrl n GLY 313 N 5.66 1.93 7.00 0.00 0.00 -1.26 -4.92 105.19 113.60 1nrl n GLY 313 Ca 0.27 -0.12 0.00 0.00 0.00 0.00 0.00 46.02 46.18 1nrl n GLY 313 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1nrl n GLY 314 N 0.00 0.12 0.40 -0.02 0.00 -1.06 -3.36 105.19 101.28 1nrl n GLY 314 Ca 0.00 -0.97 -0.07 0.00 0.00 0.00 0.00 46.02 44.98 1nrl n GLY 314 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1nrl n PHE 315 N -0.17 -0.25 -0.26 1.61 3.72 -1.26 0.40 117.46 121.25 1nrl n PHE 315 Ca 0.00 1.23 0.33 0.00 -0.05 0.00 0.00 57.45 58.96 1nrl n PHE 315 Cb 0.00 -0.70 0.72 0.00 -0.94 0.00 0.00 39.48 38.57 1nrl n PHE 315 CO 0.00 0.00 0.00 1.96 -0.05 0.00 0.00 176.76 178.67 1nrl h GLN 316 N 0.00 0.00 0.06 -1.08 7.50 -1.98 0.64 115.11 120.24 1nrl h GLN 316 Ca 0.23 0.00 -0.10 0.00 0.50 0.00 0.00 58.65 59.29 1nrl h GLN 316 Cb 0.48 0.00 0.01 0.00 0.05 0.00 0.00 27.48 28.02 1nrl h GLN 316 CO -0.95 0.00 -0.41 0.37 -1.50 0.00 0.00 178.83 176.34 1nrl h GLN 317 N 0.00 0.18 -0.47 1.46 4.15 -0.06 -3.29 115.11 117.07 1nrl h GLN 317 Ca 0.51 -0.27 -0.11 0.00 0.77 0.00 0.00 58.65 59.56 1nrl h GLN 317 Cb 2.20 0.09 -0.02 0.00 0.21 0.00 0.00 27.48 29.97 1nrl h GLN 317 CO -0.01 1.09 -0.13 -0.07 -1.93 0.00 0.00 178.83 177.78 1nrl h LEU 318 N -0.60 0.88 0.00 -2.39 3.38 -0.25 -2.37 115.31 113.96 1nrl h LEU 318 Ca -0.07 -0.28 0.00 0.00 0.09 0.00 0.00 57.88 57.62 1nrl h LEU 318 Cb 1.27 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 41.79 1nrl h LEU 318 CO 0.08 1.01 0.00 0.18 0.09 0.00 0.00 178.44 179.80 1nrl n LEU 319 N -4.15 0.00 0.11 1.67 4.77 0.20 -1.14 117.00 118.47 1nrl n LEU 319 Ca 0.01 0.40 -0.03 0.00 -0.03 0.00 0.00 56.01 56.36 1nrl n LEU 319 Cb 0.39 -0.40 0.07 0.00 -2.33 0.00 0.00 43.42 41.16 1nrl n LEU 319 CO 0.44 -0.34 0.37 -0.07 -1.33 0.00 0.00 177.39 176.47 1nrl h LEU 320 N 0.00 0.00 -8.96 2.23 3.38 -1.49 -3.42 115.31 107.05 1nrl h LEU 320 Ca 0.00 -0.00 -0.58 0.00 0.09 0.00 0.00 57.88 57.38 1nrl h LEU 320 Cb 0.06 -0.00 -0.07 0.00 0.09 0.00 0.00 40.66 40.73 1nrl h LEU 320 CO 0.00 0.75 0.71 -0.70 0.09 0.00 0.00 178.44 179.29 1nrl s GLU 321 N -3.31 4.07 0.19 1.13 2.56 -0.29 -4.96 118.70 118.09 1nrl s GLU 321 Ca -0.01 0.98 -0.20 0.00 0.00 0.00 0.00 54.97 55.74 1nrl s GLU 321 Cb 0.12 -3.72 0.13 0.00 2.00 0.00 0.00 34.13 32.66 1nrl s GLU 321 CO 0.78 -0.79 1.59 -1.35 -0.56 0.00 0.00 175.26 174.93 1nrl h PRO 322 N 8.00 -0.15 -0.55 4.30 0.11 -1.85 -0.18 132.00 141.67 1nrl h PRO 322 Ca -0.21 0.01 -0.03 0.00 0.11 0.00 0.00 66.00 65.87 1nrl h PRO 322 Cb 1.07 0.03 -0.03 0.00 0.11 0.00 0.00 31.00 32.19 1nrl h PRO 322 CO 0.98 -0.10 0.20 1.98 -0.21 0.00 0.00 178.00 180.86 1nrl h MET 323 N -0.16 0.80 -0.37 1.05 4.05 -1.94 0.12 114.93 118.49 1nrl h MET 323 Ca 0.23 -0.13 -0.06 0.00 -0.28 0.00 0.00 59.70 59.46 1nrl h MET 323 Cb 0.54 -0.14 -0.01 0.00 -0.80 0.00 0.00 31.60 31.19 1nrl h MET 323 CO -0.65 0.67 -0.00 -0.07 0.23 0.00 0.00 176.91 177.09 1nrl h LEU 324 N 0.79 0.64 -0.86 3.39 4.07 -1.63 -1.63 115.31 120.08 1nrl h LEU 324 Ca 0.19 -0.31 -0.07 0.00 0.08 0.00 0.00 57.88 57.77 1nrl h LEU 324 Cb 0.18 -0.17 -0.02 0.00 1.08 0.00 0.00 40.66 41.72 1nrl h LEU 324 CO -0.02 0.79 0.07 0.50 -1.08 0.00 0.00 178.44 178.71 1nrl h LYS 325 N 0.47 0.92 -0.25 1.13 3.64 -0.59 -2.62 116.57 119.27 1nrl h LYS 325 Ca 0.10 -0.23 0.02 0.00 -1.27 0.00 0.00 60.65 59.27 1nrl h LYS 325 Cb 0.47 -0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 32.15 1nrl h LYS 325 CO 0.02 0.87 0.12 0.35 -2.27 0.00 0.00 179.45 178.54 1nrl h PHE 326 N 0.86 0.23 -0.73 1.91 3.57 -0.46 0.23 116.94 122.55 1nrl h PHE 326 Ca 0.17 0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.67 1nrl h PHE 326 Cb 0.41 -0.06 -0.03 0.00 2.79 0.00 0.00 35.95 39.05 1nrl h PHE 326 CO 0.03 0.12 0.41 0.45 -2.23 0.00 0.00 178.31 177.09 1nrl h HIS 327 N 0.26 0.99 -0.39 0.41 3.86 -1.01 0.19 115.15 119.46 1nrl h HIS 327 Ca 0.10 -0.02 -0.10 0.00 -1.16 0.00 0.00 60.37 59.19 1nrl h HIS 327 Cb 0.03 -0.32 -0.01 0.00 1.06 0.00 0.00 27.41 28.18 1nrl h HIS 327 CO -0.10 0.69 -0.16 1.88 0.86 0.00 0.00 177.93 181.10 1nrl h TYR 328 N 1.00 0.91 -0.48 2.45 -1.99 -1.24 -2.01 116.97 115.60 1nrl h TYR 328 Ca 0.26 -0.22 -0.05 0.00 2.00 0.00 0.00 58.73 60.72 1nrl h TYR 328 Cb 0.02 -0.21 -0.02 0.00 2.00 0.00 0.00 36.73 38.52 1nrl h TYR 328 CO -0.00 0.95 0.10 0.52 -0.00 0.00 0.00 178.16 179.73 1nrl h MET 329 N 0.60 0.79 -0.41 4.88 2.86 -0.67 -2.31 114.93 120.65 1nrl h MET 329 Ca 0.09 -0.20 -0.10 0.00 -2.06 0.00 0.00 59.70 57.43 1nrl h MET 329 Cb 0.70 -0.10 -0.01 0.00 0.06 0.00 0.00 31.60 32.25 1nrl h MET 329 CO 0.05 0.77 -0.13 1.25 1.06 0.00 0.00 176.91 179.91 1nrl h LEU 330 N 0.67 0.83 -1.00 1.22 5.85 -0.97 -2.99 115.31 118.92 1nrl h LEU 330 Ca 0.15 -0.38 0.00 0.00 0.84 0.00 0.00 57.88 58.50 1nrl h LEU 330 Cb 0.35 -0.23 -0.05 0.00 0.37 0.00 0.00 40.66 41.11 1nrl h LEU 330 CO 0.00 1.02 0.63 0.50 -0.34 0.00 0.00 178.44 180.26 1nrl h LYS 331 N 0.64 1.31 0.00 1.25 1.63 -1.31 -1.92 116.57 118.17 1nrl h LYS 331 Ca 0.10 -0.09 0.00 0.00 -0.85 0.00 0.00 60.65 59.81 1nrl h LYS 331 Cb 0.67 -0.29 0.00 0.00 -0.60 0.00 0.00 32.23 32.02 1nrl h LYS 331 CO 0.05 0.88 0.00 -0.22 -3.45 0.00 0.00 179.45 176.71 1nrl h LYS 332 N 1.34 0.00 0.00 1.90 3.64 -1.26 -1.24 116.57 120.94 1nrl h LYS 332 Ca 0.36 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.74 1nrl h LYS 332 Cb -0.12 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.70 1nrl h LYS 332 CO -0.07 0.00 0.00 1.28 -2.27 0.00 0.00 179.45 178.39 1nrl n LEU 333 N -3.02 0.00 -3.85 5.20 4.77 -0.72 -4.94 117.00 114.44 1nrl n LEU 333 Ca -0.02 0.48 -0.34 0.00 -0.03 0.00 0.00 56.01 56.10 1nrl n LEU 333 Cb 0.13 -0.48 0.02 0.00 -2.33 0.00 0.00 43.42 40.76 1nrl n LEU 333 CO 0.21 -0.06 -0.14 0.00 -1.33 0.00 0.00 177.39 176.07 1nrl n GLN 334 N -1.48 -1.38 -1.96 3.23 6.02 -0.47 -4.93 117.38 116.41 1nrl n GLN 334 Ca 0.07 0.34 -0.33 0.00 -0.01 0.00 0.00 57.00 57.07 1nrl n GLN 334 Cb 0.29 -3.80 0.02 0.00 1.02 0.00 0.00 30.24 27.77 1nrl n GLN 334 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1nrl s LEU 335 N -6.84 3.47 0.54 1.08 1.43 -1.26 -5.05 118.68 112.05 1nrl s LEU 335 Ca 0.37 1.89 -0.06 0.00 -1.03 0.00 0.00 54.13 55.31 1nrl s LEU 335 Cb -0.16 -4.54 -0.02 0.00 0.03 0.00 0.00 46.19 41.51 1nrl s LEU 335 CO 0.90 -1.32 0.85 -1.00 0.23 0.00 0.00 176.35 176.01 1nrl s HIS 336 N -2.39 3.43 0.26 0.29 3.76 -1.26 -4.93 115.29 114.45 1nrl s HIS 336 Ca 0.65 0.76 -0.03 0.00 -0.15 0.00 0.00 55.06 56.29 1nrl s HIS 336 Cb -0.18 -2.52 0.41 0.00 1.11 0.00 0.00 32.58 31.40 1nrl s HIS 336 CO 0.38 -0.54 1.85 0.93 -0.85 0.00 0.00 174.74 176.51 1nrl h GLU 337 N 0.02 0.98 -0.81 1.40 4.39 -2.00 -1.54 114.58 117.02 1nrl h GLU 337 Ca -0.46 -0.06 0.06 0.00 0.34 0.00 0.00 59.36 59.24 1nrl h GLU 337 Cb 1.23 -0.22 -0.06 0.00 -0.10 0.00 0.00 28.75 29.60 1nrl h GLU 337 CO 0.61 0.65 0.50 0.93 -1.16 0.00 0.00 179.01 180.54 1nrl h GLU 338 N 1.01 0.89 -0.38 2.33 3.07 -1.98 -0.90 114.58 118.63 1nrl h GLU 338 Ca 0.42 -0.05 -0.14 0.00 -0.50 0.00 0.00 59.36 59.09 1nrl h GLU 338 Cb 0.27 -0.20 -0.01 0.00 -0.84 0.00 0.00 28.75 27.97 1nrl h GLU 338 CO -0.21 0.59 -0.31 0.93 -1.40 0.00 0.00 179.01 178.62 1nrl h GLU 339 N 0.92 0.83 -0.35 2.33 5.08 -1.68 -1.69 114.58 120.01 1nrl h GLU 339 Ca 0.35 -0.38 -0.02 0.00 -1.00 0.00 0.00 59.36 58.31 1nrl h GLU 339 Cb 0.15 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.38 1nrl h GLU 339 CO -0.17 1.02 0.13 1.88 -1.00 0.00 0.00 179.01 180.88 1nrl h TYR 340 N 0.70 0.54 -0.21 4.33 -1.99 -0.78 -1.20 116.97 118.36 1nrl h TYR 340 Ca 0.08 -0.04 -0.08 0.00 2.00 0.00 0.00 58.73 60.69 1nrl h TYR 340 Cb 0.85 -0.16 -0.01 0.00 2.00 0.00 0.00 36.73 39.41 1nrl h TYR 340 CO 0.05 0.51 -0.21 -0.24 -0.00 0.00 0.00 178.16 178.27 1nrl h VAL 341 N 0.42 1.24 -0.29 -2.88 3.04 -1.08 -0.78 116.25 115.92 1nrl h VAL 341 Ca 0.12 -1.11 -0.13 0.00 -1.01 0.00 0.00 66.70 64.57 1nrl h VAL 341 Cb 0.20 1.32 -0.01 0.00 -2.01 0.00 0.00 31.29 30.78 1nrl h VAL 341 CO -0.01 0.35 -0.34 -0.07 -1.01 0.00 0.00 177.57 176.49 1nrl h LEU 342 N 0.33 0.67 -0.71 3.16 3.38 -1.11 -1.61 115.31 119.43 1nrl h LEU 342 Ca 0.06 -0.28 -0.03 0.00 0.09 0.00 0.00 57.88 57.72 1nrl h LEU 342 Cb 0.56 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 41.09 1nrl h LEU 342 CO 0.04 0.96 0.33 0.24 0.09 0.00 0.00 178.44 180.10 1nrl h MET 343 N 0.54 1.02 -0.53 1.13 2.86 -0.47 -0.93 114.93 118.57 1nrl h MET 343 Ca 0.06 -0.16 -0.00 0.00 -2.06 0.00 0.00 59.70 57.54 1nrl h MET 343 Cb 0.84 -0.18 -0.03 0.00 0.06 0.00 0.00 31.60 32.29 1nrl h MET 343 CO 0.07 0.81 0.31 1.96 1.06 0.00 0.00 176.91 181.12 1nrl h GLN 344 N 0.99 0.72 -0.48 1.72 4.20 -0.82 -1.11 115.11 120.34 1nrl h GLN 344 Ca 0.24 -0.07 -0.03 0.00 0.06 0.00 0.00 58.65 58.85 1nrl h GLN 344 Cb 0.13 -0.15 -0.02 0.00 0.30 0.00 0.00 27.48 27.74 1nrl h GLN 344 CO -0.03 0.53 0.18 0.00 -0.67 0.00 0.00 178.83 178.84 1nrl h ALA 345 N 1.15 0.62 -0.78 3.87 0.00 -0.96 0.21 119.26 123.37 1nrl h ALA 345 Ca 0.19 -0.16 -0.02 0.00 0.00 0.00 0.00 54.91 54.92 1nrl h ALA 345 Cb 0.00 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 17.57 1nrl h ALA 345 CO -0.03 0.24 0.43 0.82 0.00 0.00 0.00 179.25 180.71 1nrl h ILE 346 N 0.63 1.23 -0.30 0.00 2.04 -0.95 0.28 117.51 120.44 1nrl h ILE 346 Ca 0.16 -0.59 -0.08 0.00 1.00 0.00 0.00 64.86 65.35 1nrl h ILE 346 Cb 0.22 0.20 -0.01 0.00 -0.74 0.00 0.00 36.82 36.49 1nrl h ILE 346 CO -0.01 0.26 -0.13 -1.28 0.00 0.00 0.00 178.15 176.99 1nrl h SER 347 N 1.09 0.64 0.12 1.72 0.87 -0.93 -3.25 113.55 113.81 1nrl h SER 347 Ca 0.28 -0.40 -0.00 0.00 -1.23 0.00 0.00 61.79 60.43 1nrl h SER 347 Cb 0.04 -0.17 -0.00 0.00 -0.44 0.00 0.00 62.40 61.82 1nrl h SER 347 CO -0.04 0.89 -0.07 0.25 -0.53 0.00 0.00 176.83 177.32 1nrl h LEU 348 N 0.38 -0.18 -5.33 2.23 5.85 -0.17 -3.15 115.31 114.93 1nrl h LEU 348 Ca 0.07 0.01 -0.69 0.00 0.84 0.00 0.00 57.88 58.12 1nrl h LEU 348 Cb 0.64 0.05 -0.09 0.00 0.37 0.00 0.00 40.66 41.64 1nrl h LEU 348 CO 0.04 -0.12 2.55 0.49 -0.34 0.00 0.00 178.44 181.06 1nrl n PHE 349 N -5.18 2.38 -3.10 1.25 3.01 0.05 -4.84 117.46 111.03 1nrl n PHE 349 Ca -0.08 -2.78 -0.42 0.00 1.01 0.00 0.00 57.45 55.18 1nrl n PHE 349 Cb 0.11 -1.97 -0.07 0.00 -0.01 0.00 0.00 39.48 37.55 1nrl n PHE 349 CO 0.00 0.00 0.00 -1.12 1.01 0.00 0.00 176.76 176.65 1nrl s SER 350 N 0.90 6.42 0.57 4.37 0.01 -1.19 -4.18 113.70 120.60 1nrl s SER 350 Ca 0.59 0.11 0.32 0.00 1.31 0.00 0.00 55.95 58.28 1nrl s SER 350 Cb 0.20 -2.33 1.70 0.00 0.21 0.00 0.00 66.02 65.80 1nrl s SER 350 CO -0.09 -0.62 2.15 1.55 0.41 0.00 0.00 173.24 176.64 1nrl h PRO 351 N 8.50 0.00 -0.76 12.44 0.13 -1.87 -3.15 132.00 147.28 1nrl h PRO 351 Ca -0.26 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.82 1nrl h PRO 351 Cb 1.11 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.21 1nrl h PRO 351 CO 0.84 0.06 0.07 -0.40 -0.23 0.00 0.00 178.00 178.34 1nrl n ASP 352 N -3.46 4.07 -4.77 1.44 5.68 -1.26 -4.79 116.55 113.46 1nrl n ASP 352 Ca -0.02 -2.69 -0.38 0.00 -0.50 0.00 0.00 54.79 51.20 1nrl n ASP 352 Cb 0.19 -0.64 -0.06 0.00 -1.14 0.00 0.00 41.12 39.47 1nrl n ASP 352 CO 0.00 0.00 0.00 -0.13 -1.33 0.00 0.00 177.20 175.74 1nrl s ARG 353 N -2.18 4.66 0.33 0.11 1.81 -1.19 -5.00 118.95 117.49 1nrl s ARG 353 Ca 0.37 1.32 -0.29 0.00 -1.72 0.00 0.00 55.73 55.41 1nrl s ARG 353 Cb 0.28 -3.08 -0.10 0.00 -0.45 0.00 0.00 34.95 31.60 1nrl s ARG 353 CO 0.10 0.44 1.35 -1.25 -0.68 0.00 0.00 175.30 175.26 1nrl s PRO 354 N -1.54 4.30 0.00 3.54 0.04 -1.26 -3.15 135.00 136.94 1nrl s PRO 354 Ca 0.43 2.29 0.00 0.00 0.04 0.00 0.00 61.00 63.76 1nrl s PRO 354 Cb -0.22 -3.06 0.00 0.00 0.04 0.00 0.00 34.50 31.26 1nrl s PRO 354 CO 0.27 -0.27 0.00 0.41 0.04 0.00 0.00 177.00 177.45 1nrl n GLY 355 N 0.86 0.86 3.70 0.56 0.00 -1.26 -4.87 105.19 105.04 1nrl n GLY 355 Ca 0.01 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.61 1nrl n GLY 355 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1nrl s VAL 356 N -2.43 4.44 -0.21 1.61 1.01 -1.19 -4.76 120.40 118.87 1nrl s VAL 356 Ca 0.00 1.75 0.01 0.00 0.00 0.00 0.00 61.98 63.73 1nrl s VAL 356 Cb 0.00 -4.12 -0.20 0.00 0.00 0.00 0.00 36.38 32.06 1nrl s VAL 356 CO 0.00 0.06 -0.01 0.18 0.00 0.00 0.00 175.10 175.33 1nrl n LEU 357 N 4.61 2.64 -1.87 3.92 4.77 -1.26 -4.35 117.00 125.46 1nrl n LEU 357 Ca 0.09 -0.01 -0.10 0.00 -0.03 0.00 0.00 56.01 55.95 1nrl n LEU 357 Cb 0.48 -0.86 -0.06 0.00 -2.33 0.00 0.00 43.42 40.65 1nrl n LEU 357 CO 0.54 0.87 1.32 0.00 -1.33 0.00 0.00 177.39 178.80 1nrl n GLN 358 N -3.29 1.66 0.14 3.23 1.13 -1.26 -4.55 117.38 114.44 1nrl n GLN 358 Ca -0.40 -0.91 0.19 0.00 -1.94 0.00 0.00 57.00 53.94 1nrl n GLN 358 Cb 1.02 -1.59 0.77 0.00 0.11 0.00 0.00 30.24 30.54 1nrl n GLN 358 CO 0.00 0.00 0.00 0.45 -1.44 0.00 0.00 177.06 176.07 1nrl h HIS 359 N 2.02 0.00 0.32 1.08 3.86 -1.87 -1.71 115.15 118.85 1nrl h HIS 359 Ca 0.17 0.00 -0.02 0.00 -1.16 0.00 0.00 60.37 59.36 1nrl h HIS 359 Cb 1.12 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.60 1nrl h HIS 359 CO 1.02 0.00 -0.16 -0.09 0.86 0.00 0.00 177.93 179.56 1nrl h ARG 360 N 0.00 -0.42 -0.73 2.45 9.65 -1.94 -1.65 114.38 121.74 1nrl h ARG 360 Ca 0.16 0.03 -0.04 0.00 -1.10 0.00 0.00 59.98 59.02 1nrl h ARG 360 Cb 0.95 0.10 -0.03 0.00 -1.39 0.00 0.00 29.97 29.59 1nrl h ARG 360 CO -0.00 -0.09 0.29 0.28 2.80 0.00 0.00 179.97 183.25 1nrl h VAL 361 N -0.88 1.25 -0.49 0.20 2.07 -1.80 -2.19 116.25 114.40 1nrl h VAL 361 Ca -0.04 -0.79 -0.00 0.00 0.82 0.00 0.00 66.70 66.69 1nrl h VAL 361 Cb 0.52 0.39 -0.02 0.00 -1.52 0.00 0.00 31.29 30.66 1nrl h VAL 361 CO 0.07 0.32 0.30 0.58 0.02 0.00 0.00 177.57 178.86 1nrl h VAL 362 N 1.05 1.15 -0.73 2.57 2.07 -1.39 -0.11 116.25 120.86 1nrl h VAL 362 Ca 0.24 -0.33 -0.02 0.00 0.82 0.00 0.00 66.70 67.42 1nrl h VAL 362 Cb 0.21 0.48 -0.03 0.00 -1.52 0.00 0.00 31.29 30.43 1nrl h VAL 362 CO -0.02 0.15 0.37 -0.78 0.02 0.00 0.00 177.57 177.31 1nrl h ASP 363 N 0.66 0.93 -0.15 0.57 3.58 -1.09 0.20 116.42 121.11 1nrl h ASP 363 Ca 0.18 -0.09 -0.12 0.00 0.42 0.00 0.00 57.03 57.42 1nrl h ASP 363 Cb -0.02 -0.24 -0.01 0.00 1.72 0.00 0.00 39.33 40.78 1nrl h ASP 363 CO -0.03 0.77 -0.29 1.56 -2.88 0.00 0.00 179.24 178.37 1nrl h GLN 364 N 1.03 0.63 -0.14 0.28 1.08 -0.87 -2.09 115.11 115.03 1nrl h GLN 364 Ca 0.26 -0.27 -0.06 0.00 -1.45 0.00 0.00 58.65 57.13 1nrl h GLN 364 Cb 0.07 -0.02 -0.00 0.00 -0.05 0.00 0.00 27.48 27.48 1nrl h GLN 364 CO -0.04 0.85 -0.14 -0.07 -0.95 0.00 0.00 178.83 178.48 1nrl h LEU 365 N 0.54 0.36 -0.67 1.46 3.38 -0.38 -2.71 115.31 117.30 1nrl h LEU 365 Ca 0.07 -0.48 0.06 0.00 0.09 0.00 0.00 57.88 57.62 1nrl h LEU 365 Cb 0.77 -0.10 -0.05 0.00 0.09 0.00 0.00 40.66 41.36 1nrl h LEU 365 CO 0.06 0.77 0.37 -0.61 0.09 0.00 0.00 178.44 179.12 1nrl h GLN 366 N -0.03 0.66 -0.64 1.13 4.15 -0.87 -1.81 115.11 117.70 1nrl h GLN 366 Ca 0.02 -0.04 0.03 0.00 0.77 0.00 0.00 58.65 59.44 1nrl h GLN 366 Cb 0.66 -0.15 -0.04 0.00 0.21 0.00 0.00 27.48 28.16 1nrl h GLN 366 CO 0.03 0.44 0.39 1.49 -1.93 0.00 0.00 178.83 179.25 1nrl h GLU 367 N 0.68 0.73 -0.58 1.69 4.81 -1.35 -0.61 114.58 119.96 1nrl h GLU 367 Ca 0.30 -0.04 -0.06 0.00 -0.13 0.00 0.00 59.36 59.43 1nrl h GLU 367 Cb 0.19 -0.17 -0.03 0.00 0.63 0.00 0.00 28.75 29.37 1nrl h GLU 367 CO -0.18 0.49 0.13 1.96 -0.73 0.00 0.00 179.01 180.67 1nrl h GLN 368 N 0.76 0.91 -0.42 1.92 1.08 -1.03 0.62 115.11 118.95 1nrl h GLN 368 Ca 0.26 -0.20 -0.12 0.00 -1.45 0.00 0.00 58.65 57.14 1nrl h GLN 368 Cb 0.05 -0.13 -0.01 0.00 -0.05 0.00 0.00 27.48 27.34 1nrl h GLN 368 CO -0.12 0.82 -0.22 0.74 -0.95 0.00 0.00 178.83 179.11 1nrl h PHE 369 N 0.87 0.95 -0.39 2.96 0.05 -0.87 -1.48 116.94 119.03 1nrl h PHE 369 Ca 0.19 -0.22 -0.05 0.00 3.82 0.00 0.00 57.97 61.71 1nrl h PHE 369 Cb 0.33 -0.23 -0.02 0.00 2.00 0.00 0.00 35.95 38.04 1nrl h PHE 369 CO 0.02 0.97 0.06 0.00 -0.18 0.00 0.00 178.31 179.18 1nrl h ALA 370 N 1.03 0.52 -0.76 2.45 0.00 -0.61 -0.29 119.26 121.58 1nrl h ALA 370 Ca 0.10 -0.22 -0.02 0.00 0.00 0.00 0.00 54.91 54.78 1nrl h ALA 370 Cb 0.74 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 18.35 1nrl h ALA 370 CO 0.06 0.23 0.42 0.82 0.00 0.00 0.00 179.25 180.78 1nrl h ILE 371 N 0.50 1.23 -0.70 0.00 2.04 -0.77 -0.76 117.51 119.04 1nrl h ILE 371 Ca 0.12 -0.58 -0.06 0.00 1.00 0.00 0.00 64.86 65.34 1nrl h ILE 371 Cb 0.37 0.22 -0.03 0.00 -0.74 0.00 0.00 36.82 36.64 1nrl h ILE 371 CO 0.01 0.26 0.20 0.74 0.00 0.00 0.00 178.15 179.36 1nrl h THR 372 N 1.06 1.26 -0.20 -0.27 2.02 -1.01 -1.25 112.91 114.52 1nrl h THR 372 Ca 0.27 -0.91 -0.01 0.00 0.77 0.00 0.00 66.41 66.53 1nrl h THR 372 Cb 0.04 0.50 -0.01 0.00 -1.74 0.00 0.00 68.15 66.93 1nrl h THR 372 CO -0.04 0.35 0.07 0.25 0.37 0.00 0.00 175.52 176.52 1nrl h LEU 373 N 1.05 0.28 -0.72 2.58 5.85 -0.45 -0.51 115.31 123.39 1nrl h LEU 373 Ca 0.23 -0.19 0.05 0.00 0.84 0.00 0.00 57.88 58.81 1nrl h LEU 373 Cb 0.32 -0.07 -0.05 0.00 0.37 0.00 0.00 40.66 41.22 1nrl h LEU 373 CO -0.00 0.40 0.43 0.50 -0.34 0.00 0.00 178.44 179.42 1nrl h LYS 374 N 0.15 0.77 -0.40 1.25 3.64 -0.98 -1.70 116.57 119.30 1nrl h LYS 374 Ca 0.06 -0.05 -0.05 0.00 -1.27 0.00 0.00 60.65 59.35 1nrl h LYS 374 Cb 0.21 -0.17 -0.02 0.00 -0.41 0.00 0.00 32.23 31.84 1nrl h LYS 374 CO -0.00 0.51 0.06 0.77 -2.27 0.00 0.00 179.45 178.51 1nrl h SER 375 N 0.79 0.65 -0.49 4.20 0.02 -0.98 -1.89 113.55 115.85 1nrl h SER 375 Ca 0.31 -0.27 0.02 0.00 -0.84 0.00 0.00 61.79 61.02 1nrl h SER 375 Cb 0.14 -0.17 -0.03 0.00 0.14 0.00 0.00 62.40 62.48 1nrl h SER 375 CO -0.16 0.75 0.30 0.22 -1.14 0.00 0.00 176.83 176.80 1nrl h TYR 376 N 0.52 0.56 -0.57 3.45 5.03 -0.73 -1.01 116.97 124.22 1nrl h TYR 376 Ca 0.12 0.02 -0.01 0.00 2.58 0.00 0.00 58.73 61.44 1nrl h TYR 376 Cb 0.39 -0.18 -0.03 0.00 1.55 0.00 0.00 36.73 38.46 1nrl h TYR 376 CO 0.03 0.33 0.32 0.82 -1.32 0.00 0.00 178.16 178.33 1nrl h ILE 377 N 0.60 1.18 -0.85 1.81 2.04 -1.18 -1.56 117.51 119.55 1nrl h ILE 377 Ca 0.19 -0.44 -0.03 0.00 1.00 0.00 0.00 64.86 65.59 1nrl h ILE 377 Cb 0.00 0.44 -0.04 0.00 -0.74 0.00 0.00 36.82 36.49 1nrl h ILE 377 CO -0.08 0.19 0.43 -0.33 0.00 0.00 0.00 178.15 178.36 1nrl h GLU 378 N 0.76 1.20 0.00 2.37 5.08 -0.89 0.17 114.58 123.28 1nrl h GLU 378 Ca 0.20 -0.16 -0.08 0.00 -1.00 0.00 0.00 59.36 58.32 1nrl h GLU 378 Cb 0.02 -0.22 -0.01 0.00 0.50 0.00 0.00 28.75 29.04 1nrl h GLU 378 CO -0.03 0.91 -0.39 0.00 -1.00 0.00 0.00 179.01 178.49 1nrl n ASN 380 N -3.36 0.19 -3.40 0.00 3.02 -0.62 -4.89 115.26 106.20 1nrl n ASN 380 Ca 0.01 -0.59 -0.27 0.00 -0.03 0.00 0.00 54.58 53.70 1nrl n ASN 380 Cb 0.59 0.84 -0.08 0.00 -0.61 0.00 0.00 39.78 40.52 1nrl n ASN 380 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1nrl n ARG 381 N -0.84 2.21 0.18 3.52 1.74 0.59 -4.88 116.66 119.17 1nrl n ARG 381 Ca 0.00 -4.43 0.06 0.00 -0.77 0.00 0.00 57.85 52.71 1nrl n ARG 381 Cb 0.01 -2.09 0.27 0.00 -1.02 0.00 0.00 32.46 29.62 1nrl n ARG 381 CO 0.00 0.00 0.00 -1.00 -1.52 0.00 0.00 177.63 175.11 1nrl h PRO 382 N 4.20 0.00 -6.47 5.56 0.13 -1.83 -3.45 132.00 130.14 1nrl h PRO 382 Ca 0.18 0.00 -0.61 0.00 -0.87 0.00 0.00 66.00 64.70 1nrl h PRO 382 Cb 0.70 0.00 0.07 0.00 0.13 0.00 0.00 31.00 31.90 1nrl h PRO 382 CO 0.77 0.37 0.54 1.04 -0.23 0.00 0.00 178.00 180.49 1nrl n GLN 383 N -3.38 1.73 0.00 0.86 3.00 -1.26 -4.82 117.38 113.51 1nrl n GLN 383 Ca 0.01 0.62 0.00 0.00 -0.01 0.00 0.00 57.00 57.61 1nrl n GLN 383 Cb 0.56 -2.25 0.00 0.00 0.00 0.00 0.00 30.24 28.55 1nrl n GLN 383 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.06 174.76 1nrl n PRO 384 N 2.30 0.00 0.00 -1.09 -0.02 -1.26 -0.46 135.00 134.48 1nrl n PRO 384 Ca 0.14 0.42 0.14 0.00 -2.02 0.00 0.00 63.50 62.18 1nrl n PRO 384 Cb 0.28 -1.56 0.62 0.00 -0.02 0.00 0.00 33.50 32.82 1nrl n PRO 384 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1nrl n ALA 385 N -1.41 2.70 -1.15 3.55 0.00 -1.26 -3.59 120.51 119.34 1nrl n ALA 385 Ca 0.00 -0.22 0.08 0.00 0.00 0.00 0.00 53.44 53.30 1nrl n ALA 385 Cb 0.06 -1.37 0.18 0.00 0.00 0.00 0.00 19.45 18.31 1nrl n ALA 385 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1nrl n HIS 386 N -1.15 0.30 -2.18 0.00 8.25 0.40 -5.01 115.22 115.83 1nrl n HIS 386 Ca 0.13 -1.09 -0.41 0.00 -0.26 0.00 0.00 57.72 56.09 1nrl n HIS 386 Cb 0.28 -0.23 -0.03 0.00 1.12 0.00 0.00 29.99 31.13 1nrl n HIS 386 CO 0.00 0.00 0.00 1.03 0.64 0.00 0.00 176.34 178.01 1nrl s ARG 387 N -2.95 4.38 -1.00 -0.41 0.52 -1.24 -2.43 118.95 115.83 1nrl s ARG 387 Ca 0.36 2.12 0.00 0.00 -0.52 0.00 0.00 55.73 57.69 1nrl s ARG 387 Cb 0.32 -3.15 0.00 0.00 0.52 0.00 0.00 34.95 32.64 1nrl s ARG 387 CO 0.03 -0.22 0.00 1.19 0.02 0.00 0.00 175.30 176.31 1nrl n PHE 388 N 1.95 0.00 -0.08 -0.53 3.01 -1.26 -4.91 117.46 115.64 1nrl n PHE 388 Ca 0.04 0.00 -0.07 0.00 1.01 0.00 0.00 57.45 58.43 1nrl n PHE 388 Cb 0.42 -2.05 0.00 0.00 -0.01 0.00 0.00 39.48 37.84 1nrl n PHE 388 CO 0.00 0.00 0.00 1.25 1.01 0.00 0.00 176.76 179.02 1nrl h LEU 389 N 0.00 -0.12 -0.34 4.37 5.85 -1.87 0.10 115.31 123.30 1nrl h LEU 389 Ca -0.19 0.07 0.06 0.00 0.84 0.00 0.00 57.88 58.66 1nrl h LEU 389 Cb 0.79 0.12 -0.06 0.00 0.37 0.00 0.00 40.66 41.89 1nrl h LEU 389 CO 0.28 -0.03 -0.00 0.15 -0.34 0.00 0.00 178.44 178.50 1nrl h PHE 390 N 0.09 -0.03 -0.49 1.25 3.57 -1.91 -0.31 116.94 119.11 1nrl h PHE 390 Ca 0.15 0.03 -0.07 0.00 3.53 0.00 0.00 57.97 61.60 1nrl h PHE 390 Cb 0.20 0.06 -0.02 0.00 2.79 0.00 0.00 35.95 38.98 1nrl h PHE 390 CO -0.22 -0.07 0.01 -0.07 -2.23 0.00 0.00 178.31 175.73 1nrl h LEU 391 N 0.09 0.77 -0.33 0.59 3.38 -1.85 -1.05 115.31 116.90 1nrl h LEU 391 Ca 0.17 -0.18 -0.01 0.00 0.09 0.00 0.00 57.88 57.94 1nrl h LEU 391 Cb 0.23 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.76 1nrl h LEU 391 CO -0.28 0.83 0.16 0.11 0.09 0.00 0.00 178.44 179.35 1nrl h LYS 392 N 0.75 0.48 -0.28 1.13 1.57 -0.27 -1.63 116.57 118.32 1nrl h LYS 392 Ca 0.15 -0.07 -0.00 0.00 -1.87 0.00 0.00 60.65 58.86 1nrl h LYS 392 Cb 0.44 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.65 1nrl h LYS 392 CO 0.02 0.43 0.16 0.82 -0.57 0.00 0.00 179.45 180.31 1nrl h ILE 393 N 0.40 1.10 -0.86 1.86 2.04 -0.77 -0.78 117.51 120.51 1nrl h ILE 393 Ca 0.11 -0.25 -0.00 0.00 1.00 0.00 0.00 64.86 65.72 1nrl h ILE 393 Cb 0.11 0.77 -0.04 0.00 -0.74 0.00 0.00 36.82 36.92 1nrl h ILE 393 CO -0.02 0.10 0.52 0.24 0.00 0.00 0.00 178.15 179.00 1nrl h MET 394 N 0.35 1.16 -0.28 2.37 2.86 -1.09 -0.86 114.93 119.45 1nrl h MET 394 Ca 0.10 -0.10 -0.11 0.00 -2.06 0.00 0.00 59.70 57.53 1nrl h MET 394 Cb 0.02 -0.25 -0.01 0.00 0.06 0.00 0.00 31.60 31.42 1nrl h MET 394 CO -0.02 0.81 -0.29 0.00 1.06 0.00 0.00 176.91 178.47 1nrl h ALA 395 N 1.39 0.97 -0.42 6.32 0.00 -0.94 -2.43 119.26 124.15 1nrl h ALA 395 Ca 0.31 -0.38 -0.08 0.00 0.00 0.00 0.00 54.91 54.76 1nrl h ALA 395 Cb -0.05 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.59 1nrl h ALA 395 CO -0.06 0.60 -0.08 0.52 0.00 0.00 0.00 179.25 180.23 1nrl h MET 396 N 0.49 0.72 -0.26 0.00 2.07 -0.32 -1.96 114.93 115.69 1nrl h MET 396 Ca 0.06 -0.22 -0.09 0.00 -2.07 0.00 0.00 59.70 57.38 1nrl h MET 396 Cb 0.76 -0.07 -0.01 0.00 -1.87 0.00 0.00 31.60 30.40 1nrl h MET 396 CO 0.06 0.79 -0.24 -0.07 1.07 0.00 0.00 176.91 178.53 1nrl h LEU 397 N 0.67 0.49 -0.51 1.22 3.38 -0.86 0.13 115.31 119.83 1nrl h LEU 397 Ca 0.12 -0.16 -0.11 0.00 0.09 0.00 0.00 57.88 57.82 1nrl h LEU 397 Cb 0.53 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 41.13 1nrl h LEU 397 CO 0.03 0.73 -0.09 0.74 0.09 0.00 0.00 178.44 179.94 1nrl h THR 398 N 0.43 1.27 -0.37 0.22 2.02 -1.09 -2.27 112.91 113.12 1nrl h THR 398 Ca 0.07 -1.23 -0.05 0.00 0.77 0.00 0.00 66.41 65.97 1nrl h THR 398 Cb 0.65 1.01 -0.01 0.00 -1.74 0.00 0.00 68.15 68.05 1nrl h THR 398 CO 0.05 0.43 0.04 -0.33 0.37 0.00 0.00 175.52 176.08 1nrl h GLU 399 N 0.83 0.62 -0.69 6.66 3.07 -0.94 -2.69 114.58 121.45 1nrl h GLU 399 Ca 0.13 -0.18 0.11 0.00 -0.50 0.00 0.00 59.36 58.92 1nrl h GLU 399 Cb 0.65 -0.07 -0.04 0.00 -0.84 0.00 0.00 28.75 28.44 1nrl h GLU 399 CO 0.04 0.70 0.46 1.25 -1.40 0.00 0.00 179.01 180.06 1nrl h LEU 400 N 0.45 0.46 -0.83 1.33 5.85 -0.54 0.11 115.31 122.15 1nrl h LEU 400 Ca 0.11 0.01 -0.09 0.00 0.84 0.00 0.00 57.88 58.75 1nrl h LEU 400 Cb 0.39 -0.08 -0.02 0.00 0.37 0.00 0.00 40.66 41.32 1nrl h LEU 400 CO 0.01 0.27 -0.08 -0.09 -0.34 0.00 0.00 178.44 178.21 1nrl h ARG 401 N 0.51 0.80 -0.28 1.25 2.43 -1.09 0.09 114.38 118.08 1nrl h ARG 401 Ca 0.32 -0.25 -0.11 0.00 -0.81 0.00 0.00 59.98 59.13 1nrl h ARG 401 Cb 0.57 -0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 30.04 1nrl h ARG 401 CO -0.10 0.85 -0.24 1.03 -1.51 0.00 0.00 179.97 180.00 1nrl h SER 402 N 0.73 0.69 -0.42 -3.80 0.87 -0.68 -2.78 113.55 108.16 1nrl h SER 402 Ca 0.13 -0.46 -0.06 0.00 -1.23 0.00 0.00 61.79 60.17 1nrl h SER 402 Cb 0.56 -0.19 -0.02 0.00 -0.44 0.00 0.00 62.40 62.30 1nrl h SER 402 CO 0.03 1.00 0.07 0.40 -0.53 0.00 0.00 176.83 177.81 1nrl h ILE 403 N 0.39 1.23 0.03 2.23 2.04 -0.72 -2.34 117.51 120.37 1nrl h ILE 403 Ca 0.05 -0.87 0.01 0.00 1.00 0.00 0.00 64.86 65.04 1nrl h ILE 403 Cb 0.79 0.78 -0.01 0.00 -0.74 0.00 0.00 36.82 37.64 1nrl h ILE 403 CO 0.06 0.32 -0.07 -1.13 0.00 0.00 0.00 178.15 177.33 1nrl h ASN 404 N 0.74 -0.18 -0.81 1.72 -1.24 -0.89 0.16 115.58 115.07 1nrl h ASN 404 Ca 0.16 0.02 0.05 0.00 0.71 0.00 0.00 56.30 57.24 1nrl h ASN 404 Cb 0.35 0.07 -0.05 0.00 0.73 0.00 0.00 38.32 39.42 1nrl h ASN 404 CO 0.01 -0.10 0.51 0.00 -1.29 0.00 0.00 177.43 176.56 1nrl h ALA 405 N 0.83 1.09 -0.37 1.57 0.00 -1.31 0.14 119.26 121.21 1nrl h ALA 405 Ca 0.02 -0.02 -0.07 0.00 0.00 0.00 0.00 54.91 54.84 1nrl h ALA 405 Cb 0.15 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 1nrl h ALA 405 CO -0.05 0.29 -0.03 0.37 0.00 0.00 0.00 179.25 179.83 1nrl h GLN 406 N 0.97 0.68 -0.05 0.00 -0.00 -0.98 -1.94 115.11 113.78 1nrl h GLN 406 Ca 0.34 -0.23 -0.12 0.00 -0.00 0.00 0.00 58.65 58.63 1nrl h GLN 406 Cb 0.08 -0.05 -0.01 0.00 0.00 0.00 0.00 27.48 27.50 1nrl h GLN 406 CO -0.14 0.80 -0.53 0.45 0.00 0.00 0.00 178.83 179.41 1nrl h HIS 407 N 0.49 0.18 -0.30 3.99 3.86 -0.32 -2.20 115.15 120.85 1nrl h HIS 407 Ca 0.10 -0.06 -0.07 0.00 -1.16 0.00 0.00 60.37 59.18 1nrl h HIS 407 Cb 0.52 -0.04 -0.02 0.00 1.06 0.00 0.00 27.41 28.93 1nrl h HIS 407 CO 0.04 0.64 -0.10 1.15 0.86 0.00 0.00 177.93 180.53 1nrl h THR 408 N 0.11 1.22 -0.48 2.45 2.02 -0.57 -1.12 112.91 116.54 1nrl h THR 408 Ca 0.00 -0.97 -0.03 0.00 0.77 0.00 0.00 66.41 66.19 1nrl h THR 408 Cb 0.97 1.10 -0.02 0.00 -1.74 0.00 0.00 68.15 68.46 1nrl h THR 408 CO 0.08 0.32 0.20 1.56 0.37 0.00 0.00 175.52 178.05 1nrl h GLN 409 N 0.47 0.72 -0.78 6.66 4.20 -0.77 -2.44 115.11 123.18 1nrl h GLN 409 Ca 0.09 -0.13 -0.01 0.00 0.06 0.00 0.00 58.65 58.66 1nrl h GLN 409 Cb 0.46 -0.12 -0.04 0.00 0.30 0.00 0.00 27.48 28.08 1nrl h GLN 409 CO 0.03 0.64 0.43 0.00 -0.67 0.00 0.00 178.83 179.25 1nrl h ARG 410 N 0.64 1.08 -0.27 1.46 3.08 -0.88 -2.24 114.38 117.25 1nrl h ARG 410 Ca 0.16 -0.12 0.03 0.00 0.07 0.00 0.00 59.98 60.12 1nrl h ARG 410 Cb 0.18 -0.21 -0.03 0.00 0.08 0.00 0.00 29.97 29.99 1nrl h ARG 410 CO -0.01 0.79 0.09 1.25 -1.07 0.00 0.00 179.97 181.02 1nrl h LEU 411 N 1.07 0.09 -0.70 3.04 5.85 -0.91 -0.50 115.31 123.26 1nrl h LEU 411 Ca 0.27 0.03 -0.07 0.00 0.84 0.00 0.00 57.88 58.95 1nrl h LEU 411 Cb 0.02 0.02 -0.03 0.00 0.37 0.00 0.00 40.66 41.05 1nrl h LEU 411 CO -0.05 0.08 0.14 -0.07 -0.34 0.00 0.00 178.44 178.21 1nrl h LEU 412 N 0.21 1.08 0.20 2.25 3.38 -1.30 0.47 115.31 121.60 1nrl h LEU 412 Ca 0.12 -0.25 0.01 0.00 0.09 0.00 0.00 57.88 57.85 1nrl h LEU 412 Cb 0.09 -0.29 -0.02 0.00 0.09 0.00 0.00 40.66 40.54 1nrl h LEU 412 CO -0.13 1.05 -0.25 -0.09 0.09 0.00 0.00 178.44 179.11 1nrl h ARG 413 N 1.06 -0.48 -0.50 1.13 2.43 -1.03 0.29 114.38 117.27 1nrl h ARG 413 Ca 0.22 0.03 -0.02 0.00 -0.81 0.00 0.00 59.98 59.39 1nrl h ARG 413 Cb 0.41 0.11 -0.02 0.00 -0.42 0.00 0.00 29.97 30.05 1nrl h ARG 413 CO 0.01 -0.32 0.22 0.82 -1.51 0.00 0.00 179.97 179.19 1nrl h ILE 414 N -0.50 1.20 -0.90 1.20 2.04 -0.98 -2.63 117.51 116.95 1nrl h ILE 414 Ca 0.01 -0.60 0.03 0.00 1.00 0.00 0.00 64.86 65.29 1nrl h ILE 414 Cb 0.49 0.67 -0.05 0.00 -0.74 0.00 0.00 36.82 37.19 1nrl h ILE 414 CO -0.09 0.23 0.59 -0.61 0.00 0.00 0.00 178.15 178.28 1nrl h GLN 415 N 0.67 1.12 -0.55 2.37 5.75 -0.55 0.87 115.11 124.78 1nrl h GLN 415 Ca 0.17 -0.07 0.08 0.00 -0.15 0.00 0.00 58.65 58.68 1nrl h GLN 415 Cb 0.16 -0.25 -0.06 0.00 1.07 0.00 0.00 27.48 28.39 1nrl h GLN 415 CO -0.02 0.74 0.21 0.22 -2.65 0.00 0.00 178.83 177.34 1nrl h ASP 416 N 1.16 0.23 0.09 -0.69 -0.00 -0.06 -2.73 116.42 114.42 1nrl h ASP 416 Ca 0.35 0.06 -0.32 0.00 -0.00 0.00 0.00 57.03 57.12 1nrl h ASP 416 Cb -0.04 0.04 -0.02 0.00 -0.00 0.00 0.00 39.33 39.31 1nrl h ASP 416 CO -0.09 0.15 -1.75 -0.38 -0.00 0.00 0.00 179.24 177.16 1nrl n ILE 417 N -4.98 1.71 -3.66 2.25 5.41 -0.88 -4.76 119.36 114.45 1nrl n ILE 417 Ca 0.07 -0.45 -0.29 0.00 1.00 0.00 0.00 62.75 63.08 1nrl n ILE 417 Cb 0.22 -1.84 -0.12 0.00 -0.71 0.00 0.00 39.64 37.19 1nrl n ILE 417 CO 0.00 0.00 0.00 -2.28 0.00 0.00 0.00 176.55 174.27 1nrl s HIS 418 N -2.50 1.97 0.29 1.39 5.04 0.30 -5.11 115.29 116.67 1nrl s HIS 418 Ca -0.24 -2.51 -0.30 0.00 -1.54 0.00 0.00 55.06 50.47 1nrl s HIS 418 Cb 0.06 -1.75 -0.12 0.00 0.04 0.00 0.00 32.58 30.82 1nrl s HIS 418 CO 0.71 -0.75 1.51 -0.35 -2.34 0.00 0.00 174.74 173.52 1nrl n PRO 419 N 3.15 2.48 0.00 2.88 -0.04 -1.03 -4.16 135.00 138.27 1nrl n PRO 419 Ca 0.16 0.88 0.00 0.00 -0.04 0.00 0.00 63.50 64.49 1nrl n PRO 419 Cb 0.38 -2.61 0.00 0.00 -0.04 0.00 0.00 33.50 31.23 1nrl n PRO 419 CO 0.00 0.00 0.00 1.97 -0.04 0.00 0.00 175.50 177.43 1nrl n PHE 420 N 1.82 0.00 -1.76 0.54 1.16 -1.26 -5.05 117.46 112.91 1nrl n PHE 420 Ca 0.09 0.00 -0.41 0.00 -1.87 0.00 0.00 57.45 55.26 1nrl n PHE 420 Cb 0.35 0.00 0.01 0.00 -1.61 0.00 0.00 39.48 38.23 1nrl n PHE 420 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 1nrl n ALA 421 N 0.00 2.18 -1.61 1.98 0.00 -1.26 -4.88 120.51 116.92 1nrl n ALA 421 Ca 0.00 0.31 -0.30 0.00 0.00 0.00 0.00 53.44 53.46 1nrl n ALA 421 Cb 0.00 -2.40 0.09 0.00 0.00 0.00 0.00 19.45 17.14 1nrl n ALA 421 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1nrl s THR 422 N -1.14 2.95 0.21 0.00 -4.23 -1.26 -4.81 115.64 107.37 1nrl s THR 422 Ca 0.56 0.31 -0.09 0.00 -1.18 0.00 0.00 61.69 61.29 1nrl s THR 422 Cb -0.47 -3.10 0.15 0.00 1.34 0.00 0.00 72.50 70.42 1nrl s THR 422 CO 0.62 -0.40 1.81 -0.65 -0.54 0.00 0.00 174.62 175.45 1nrl h PRO 423 N -1.08 0.68 -0.68 3.99 0.11 -1.99 -0.88 132.00 132.15 1nrl h PRO 423 Ca -0.47 -0.04 -0.01 0.00 0.11 0.00 0.00 66.00 65.59 1nrl h PRO 423 Cb 1.28 -0.15 -0.03 0.00 0.11 0.00 0.00 31.00 32.20 1nrl h PRO 423 CO 0.60 0.45 0.40 1.25 -0.21 0.00 0.00 178.00 180.49 1nrl h LEU 424 N 0.70 0.83 -0.94 2.35 5.85 -2.00 -2.07 115.31 120.03 1nrl h LEU 424 Ca 0.31 -0.07 -0.00 0.00 0.84 0.00 0.00 57.88 58.95 1nrl h LEU 424 Cb 0.20 -0.21 -0.05 0.00 0.37 0.00 0.00 40.66 40.98 1nrl h LEU 424 CO -0.19 0.66 0.57 0.24 -0.34 0.00 0.00 178.44 179.38 1nrl h MET 425 N 0.93 1.27 -0.96 1.25 2.86 -1.77 -0.55 114.93 117.95 1nrl h MET 425 Ca 0.24 -0.11 0.02 0.00 -2.06 0.00 0.00 59.70 57.79 1nrl h MET 425 Cb -0.00 -0.27 -0.05 0.00 0.06 0.00 0.00 31.60 31.34 1nrl h MET 425 CO -0.04 0.88 0.63 1.96 1.06 0.00 0.00 176.91 181.40 1nrl h GLN 426 N 1.29 1.24 -0.14 1.72 4.20 -0.55 -0.17 115.11 122.70 1nrl h GLN 426 Ca 0.34 -0.07 -0.09 0.00 0.06 0.00 0.00 58.65 58.88 1nrl h GLN 426 Cb -0.07 -0.28 0.00 0.00 0.30 0.00 0.00 27.48 27.43 1nrl h GLN 426 CO -0.06 0.82 -0.27 0.93 -0.67 0.00 0.00 178.83 179.58 1nrl h GLU 427 N 1.28 0.44 -0.59 1.46 5.08 -0.78 0.10 114.58 121.57 1nrl h GLU 427 Ca 0.36 -0.28 -0.07 0.00 -1.00 0.00 0.00 59.36 58.37 1nrl h GLU 427 Cb -0.12 0.03 -0.03 0.00 0.50 0.00 0.00 28.75 29.14 1nrl h GLU 427 CO -0.08 0.88 0.10 -0.07 -1.00 0.00 0.00 179.01 178.83 1nrl h LEU 428 N 0.05 0.90 -3.01 1.33 3.38 -0.76 -3.23 115.31 113.97 1nrl h LEU 428 Ca 0.01 -0.19 0.00 0.00 0.09 0.00 0.00 57.88 57.78 1nrl h LEU 428 Cb 0.86 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 41.37 1nrl h LEU 428 CO 0.06 0.90 0.00 0.49 0.09 0.00 0.00 178.44 179.98 1nrl n PHE 429 N -4.23 0.90 -2.89 1.13 3.01 -0.11 -4.64 117.46 110.63 1nrl n PHE 429 Ca 0.04 -0.60 -0.12 0.00 1.01 0.00 0.00 57.45 57.78 1nrl n PHE 429 Cb 0.27 -0.14 0.06 0.00 -0.01 0.00 0.00 39.48 39.66 1nrl n PHE 429 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1nrl n GLY 430 N 0.64 -0.57 0.49 1.37 0.00 -0.81 -5.00 105.19 101.30 1nrl n GLY 430 Ca 0.19 0.30 0.06 0.00 0.00 0.00 0.00 46.02 46.57 1nrl n GLY 430 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71