#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1iy1 s VAL 153 N 0.00 5.24 0.50 0.58 1.01 -1.26 -5.00 120.40 121.47 1iy1 s VAL 153 Ca 0.00 0.59 0.01 0.00 0.00 0.00 0.00 61.98 62.58 1iy1 s VAL 153 Cb 0.00 -3.68 -0.00 0.00 0.00 0.00 0.00 36.38 32.70 1iy1 s VAL 153 CO 0.00 0.28 0.04 0.35 0.00 0.00 0.00 175.10 175.77 1iy1 n THR 154 N 4.28 0.00 0.32 3.92 -2.24 -1.26 -3.55 114.28 115.75 1iy1 n THR 154 Ca -0.10 -2.49 0.04 0.00 -2.27 0.00 0.00 64.05 59.23 1iy1 n THR 154 Cb 0.51 0.60 0.18 0.00 -2.10 0.00 0.00 70.33 69.52 1iy1 n THR 154 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 1iy1 n PHE 155 N -1.23 0.00 0.06 4.78 0.99 -1.26 -1.23 117.46 119.57 1iy1 n PHE 155 Ca -0.18 0.00 -0.09 0.00 -0.00 0.00 0.00 57.45 57.18 1iy1 n PHE 155 Cb 0.66 -0.34 -0.13 0.00 -1.00 0.00 0.00 39.48 38.68 1iy1 n PHE 155 CO 0.00 0.00 0.00 0.87 -0.00 0.00 0.00 176.76 177.63 1iy1 h LYS 156 N 0.00 0.06 -0.12 -1.08 1.79 -1.96 -3.18 116.57 112.09 1iy1 h LYS 156 Ca 0.00 -0.11 0.00 0.00 -2.18 0.00 0.00 60.65 58.36 1iy1 h LYS 156 Cb 0.08 0.04 0.00 0.00 -1.58 0.00 0.00 32.23 30.77 1iy1 h LYS 156 CO 0.00 0.97 0.00 -0.25 -1.08 0.00 0.00 179.45 179.09 1iy1 n ASP 157 N -3.35 0.94 -4.26 0.86 10.43 -0.36 -4.70 116.55 116.11 1iy1 n ASP 157 Ca -0.05 -1.68 -0.36 0.00 2.57 0.00 0.00 54.79 55.27 1iy1 n ASP 157 Cb 0.98 -0.07 -0.13 0.00 1.84 0.00 0.00 41.12 43.73 1iy1 n ASP 157 CO 0.00 0.00 0.00 -0.69 -1.07 0.00 0.00 177.20 175.44 1iy1 s VAL 158 N -1.85 3.41 -0.58 2.53 1.01 -1.20 -4.95 120.40 118.77 1iy1 s VAL 158 Ca 0.26 -0.93 -0.28 0.00 0.00 0.00 0.00 61.98 61.03 1iy1 s VAL 158 Cb 0.13 -2.78 0.03 0.00 0.00 0.00 0.00 36.38 33.76 1iy1 s VAL 158 CO 0.20 0.09 1.21 0.00 0.00 0.00 0.00 175.10 176.61 1iy1 s ALA 159 N 1.40 2.98 0.00 5.51 0.00 -1.26 -4.83 121.76 125.55 1iy1 s ALA 159 Ca 0.00 -0.81 0.00 0.00 0.00 0.00 0.00 51.96 51.16 1iy1 s ALA 159 Cb -0.17 -4.05 0.00 0.00 0.00 0.00 0.00 23.12 18.90 1iy1 s ALA 159 CO -0.01 -2.69 0.00 0.41 0.00 0.00 0.00 175.76 173.48 1iy1 n GLY 160 N 5.08 0.17 3.09 0.00 0.00 -1.26 -4.47 105.19 107.80 1iy1 n GLY 160 Ca 0.09 -1.45 -0.15 0.00 0.00 0.00 0.00 46.02 44.51 1iy1 n GLY 160 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1iy1 n ALA 161 N 2.83 -1.67 0.05 4.61 0.00 -1.26 -4.90 120.51 120.18 1iy1 n ALA 161 Ca 0.00 -0.02 -0.05 0.00 0.00 0.00 0.00 53.44 53.37 1iy1 n ALA 161 Cb 0.00 -2.37 -0.03 0.00 0.00 0.00 0.00 19.45 17.04 1iy1 n ALA 161 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1iy1 h GLU 162 N -1.68 -0.25 -0.50 0.00 4.39 -1.98 -1.53 114.58 113.04 1iy1 h GLU 162 Ca -0.50 0.02 0.03 0.00 0.34 0.00 0.00 59.36 59.24 1iy1 h GLU 162 Cb 1.29 0.06 -0.03 0.00 -0.10 0.00 0.00 28.75 29.96 1iy1 h GLU 162 CO 0.43 -0.17 0.29 0.93 -1.16 0.00 0.00 179.01 179.33 1iy1 h GLU 163 N -0.26 0.56 -0.34 2.33 3.07 -1.98 -1.27 114.58 116.69 1iy1 h GLU 163 Ca -0.01 -0.03 0.07 0.00 -0.50 0.00 0.00 59.36 58.89 1iy1 h GLU 163 Cb 0.25 -0.13 -0.08 0.00 -0.84 0.00 0.00 28.75 27.95 1iy1 h GLU 163 CO -0.07 0.37 -0.27 0.00 -1.40 0.00 0.00 179.01 177.64 1iy1 h ALA 164 N 1.23 -0.11 -0.38 3.43 0.00 -1.88 0.65 119.26 122.19 1iy1 h ALA 164 Ca 0.20 0.10 -0.05 0.00 0.00 0.00 0.00 54.91 55.16 1iy1 h ALA 164 Cb 0.04 0.59 -0.02 0.00 0.00 0.00 0.00 17.79 18.40 1iy1 h ALA 164 CO -0.10 -0.68 0.02 0.87 0.00 0.00 0.00 179.25 179.36 1iy1 h LYS 165 N -0.23 0.60 0.49 0.00 1.57 -1.01 0.87 116.57 118.85 1iy1 h LYS 165 Ca 0.16 -0.13 -0.02 0.00 -1.87 0.00 0.00 60.65 58.79 1iy1 h LYS 165 Cb 0.50 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 32.73 1iy1 h LYS 165 CO -0.47 0.61 -0.23 0.93 -0.57 0.00 0.00 179.45 179.71 1iy1 h GLU 166 N 0.57 -0.63 0.00 3.15 4.39 0.30 -2.24 114.58 120.12 1iy1 h GLU 166 Ca 0.12 0.04 0.00 0.00 0.34 0.00 0.00 59.36 59.87 1iy1 h GLU 166 Cb 0.33 0.14 0.00 0.00 -0.10 0.00 0.00 28.75 29.13 1iy1 h GLU 166 CO 0.01 -0.39 0.00 0.93 -1.16 0.00 0.00 179.01 178.39 1iy1 h GLU 167 N -0.71 0.00 -0.64 2.33 5.08 0.47 -1.81 114.58 119.30 1iy1 h GLU 167 Ca -0.07 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.29 1iy1 h GLU 167 Cb 0.53 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.78 1iy1 h GLU 167 CO 0.11 0.00 0.00 1.28 -1.00 0.00 0.00 179.01 179.40 1iy1 n LEU 168 N -2.86 3.51 -0.03 1.33 4.77 0.27 -4.30 117.00 119.70 1iy1 n LEU 168 Ca -0.01 -1.74 -0.15 0.00 -0.03 0.00 0.00 56.01 54.09 1iy1 n LEU 168 Cb 0.17 -0.42 -0.11 0.00 -2.33 0.00 0.00 43.42 40.73 1iy1 n LEU 168 CO 0.21 0.87 0.43 0.11 -1.33 0.00 0.00 177.39 177.68 1iy1 h LYS 169 N 3.90 0.14 -0.93 3.23 1.79 -0.76 -1.95 116.57 122.00 1iy1 h LYS 169 Ca 0.00 -0.14 0.20 0.00 -2.18 0.00 0.00 60.65 58.53 1iy1 h LYS 169 Cb 0.89 0.04 -0.11 0.00 -1.58 0.00 0.00 32.23 31.46 1iy1 h LYS 169 CO 0.00 0.86 0.49 1.49 -1.08 0.00 0.00 179.45 181.22 1iy1 h GLU 170 N -0.52 0.55 -0.15 3.15 4.81 -1.76 0.20 114.58 120.86 1iy1 h GLU 170 Ca -0.02 -0.03 -0.02 0.00 -0.13 0.00 0.00 59.36 59.15 1iy1 h GLU 170 Cb 0.92 -0.13 -0.01 0.00 0.63 0.00 0.00 28.75 30.17 1iy1 h GLU 170 CO 0.04 0.37 0.00 0.82 -0.73 0.00 0.00 179.01 179.51 1iy1 h ILE 171 N 0.57 1.25 0.28 2.32 1.08 -1.79 -1.74 117.51 119.48 1iy1 h ILE 171 Ca 0.56 -0.82 0.00 0.00 -0.39 0.00 0.00 64.86 64.21 1iy1 h ILE 171 Cb 0.96 1.50 -0.02 0.00 -3.07 0.00 0.00 36.82 36.18 1iy1 h ILE 171 CO -0.44 0.24 -0.30 0.58 -0.69 0.00 0.00 178.15 177.53 1iy1 h VAL 172 N 0.01 0.36 -0.27 1.67 2.07 -0.12 -1.48 116.25 118.49 1iy1 h VAL 172 Ca 0.04 0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.63 1iy1 h VAL 172 Cb 0.36 0.36 -0.07 0.00 -1.52 0.00 0.00 31.29 30.43 1iy1 h VAL 172 CO 0.01 0.00 -0.18 -0.33 0.02 0.00 0.00 177.57 177.08 1iy1 h GLU 173 N -0.63 -0.16 -0.66 1.57 3.07 -0.74 -2.07 114.58 114.97 1iy1 h GLU 173 Ca -0.01 0.01 0.11 0.00 -0.50 0.00 0.00 59.36 58.97 1iy1 h GLU 173 Cb 0.58 0.04 -0.08 0.00 -0.84 0.00 0.00 28.75 28.45 1iy1 h GLU 173 CO -0.07 -0.11 0.25 0.35 -1.40 0.00 0.00 179.01 178.04 1iy1 h PHE 174 N -0.16 0.44 -0.11 4.33 3.57 -1.05 -2.13 116.94 121.82 1iy1 h PHE 174 Ca 0.15 0.03 -0.07 0.00 3.53 0.00 0.00 57.97 61.61 1iy1 h PHE 174 Cb 0.39 -0.10 -0.01 0.00 2.79 0.00 0.00 35.95 39.02 1iy1 h PHE 174 CO -0.36 0.10 -0.26 -0.07 -2.23 0.00 0.00 178.31 175.49 1iy1 h LEU 175 N 0.43 0.19 -0.23 0.59 -0.00 -0.60 -0.21 115.31 115.49 1iy1 h LEU 175 Ca 0.34 -0.06 -0.10 0.00 -0.00 0.00 0.00 57.88 58.06 1iy1 h LEU 175 Cb 0.44 -0.05 -0.00 0.00 -0.00 0.00 0.00 40.66 41.05 1iy1 h LEU 175 CO -0.33 0.46 -0.25 0.11 -0.00 0.00 0.00 178.44 178.43 1iy1 h LYS 176 N 0.18 0.57 -2.04 1.13 1.57 -0.86 -3.38 116.57 113.74 1iy1 h LYS 176 Ca 0.03 -0.31 -0.55 0.00 -1.87 0.00 0.00 60.65 57.95 1iy1 h LYS 176 Cb 0.56 0.02 -0.40 0.00 0.08 0.00 0.00 32.23 32.49 1iy1 h LYS 176 CO 0.04 0.90 -1.04 0.09 -0.57 0.00 0.00 179.45 178.87 1iy1 n ASN 177 N -4.36 0.98 0.13 0.86 4.13 -0.98 -4.94 115.26 111.07 1iy1 n ASN 177 Ca -0.05 -2.91 0.14 0.00 1.68 0.00 0.00 54.58 53.45 1iy1 n ASN 177 Cb 0.44 -0.64 0.66 0.00 -1.54 0.00 0.00 39.78 38.71 1iy1 n ASN 177 CO 0.00 0.00 0.00 1.55 0.28 0.00 0.00 177.26 179.09 1iy1 h PRO 178 N 3.74 0.00 -0.31 3.52 0.13 -1.22 -0.33 132.00 137.53 1iy1 h PRO 178 Ca 0.10 -0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 65.18 1iy1 h PRO 178 Cb 0.85 -0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.97 1iy1 h PRO 178 CO 0.53 0.00 0.01 0.66 -0.23 0.00 0.00 178.00 178.97 1iy1 h SER 179 N 0.00 0.45 -0.16 1.44 4.64 -1.92 -0.93 113.55 117.06 1iy1 h SER 179 Ca 0.13 -0.08 -0.01 0.00 -0.47 0.00 0.00 61.79 61.36 1iy1 h SER 179 Cb 0.51 -0.12 -0.01 0.00 -0.31 0.00 0.00 62.40 62.48 1iy1 h SER 179 CO -0.00 0.51 0.08 0.03 -0.87 0.00 0.00 176.83 176.57 1iy1 h ARG 180 N 0.46 0.23 0.00 4.77 -0.00 -1.43 -0.97 114.38 117.43 1iy1 h ARG 180 Ca 0.10 -0.03 -0.02 0.00 -0.50 0.00 0.00 59.98 59.53 1iy1 h ARG 180 Cb 0.29 -0.04 -0.00 0.00 0.00 0.00 0.00 29.97 30.22 1iy1 h ARG 180 CO 0.01 0.27 -0.09 0.74 0.00 0.00 0.00 179.97 180.90 1iy1 h PHE 181 N 0.13 0.00 -0.04 3.04 -1.00 -1.39 -2.02 116.94 115.66 1iy1 h PHE 181 Ca 0.05 0.00 -0.10 0.00 2.81 0.00 0.00 57.97 60.73 1iy1 h PHE 181 Cb 0.12 0.00 0.01 0.00 3.61 0.00 0.00 35.95 39.69 1iy1 h PHE 181 CO -0.03 0.09 -0.37 0.45 -1.61 0.00 0.00 178.31 176.84 1iy1 h HIS 182 N 0.00 0.46 0.00 -0.55 -0.00 -0.63 -2.54 115.15 111.89 1iy1 h HIS 182 Ca -0.00 -0.22 -0.05 0.00 -0.00 0.00 0.00 60.37 60.10 1iy1 h HIS 182 Cb 0.48 -0.06 -0.01 0.00 -0.00 0.00 0.00 27.41 27.82 1iy1 h HIS 182 CO 0.00 0.98 -0.23 0.93 -0.00 0.00 0.00 177.93 179.61 1iy1 h GLU 183 N -0.20 0.00 -0.00 2.45 5.08 -0.87 -2.32 114.58 118.71 1iy1 h GLU 183 Ca -0.03 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.33 1iy1 h GLU 183 Cb 1.05 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.30 1iy1 h GLU 183 CO 0.08 0.23 -0.14 -0.12 -1.00 0.00 0.00 179.01 178.06 1iy1 n MET 184 N -4.19 0.34 -1.17 2.33 1.56 -0.79 -4.92 117.12 110.28 1iy1 n MET 184 Ca -0.02 -0.10 -0.06 0.00 -0.27 0.00 0.00 57.70 57.25 1iy1 n MET 184 Cb 0.29 -1.50 -0.02 0.00 2.15 0.00 0.00 33.22 34.14 1iy1 n MET 184 CO 0.00 0.00 0.00 0.41 -0.73 0.00 0.00 175.97 175.65 1iy1 n GLY 185 N 1.38 0.78 3.80 -5.12 0.00 -0.87 -5.00 105.19 100.16 1iy1 n GLY 185 Ca 0.11 -0.37 -0.39 0.00 0.00 0.00 0.00 46.02 45.37 1iy1 n GLY 185 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1iy1 s ALA 186 N -2.04 3.52 -0.16 4.61 0.00 -0.96 -5.06 121.76 121.67 1iy1 s ALA 186 Ca 0.00 0.16 -0.01 0.00 0.00 0.00 0.00 51.96 52.11 1iy1 s ALA 186 Cb 0.00 -2.76 -0.01 0.00 0.00 0.00 0.00 23.12 20.35 1iy1 s ALA 186 CO 0.00 0.36 -0.11 1.03 0.00 0.00 0.00 175.76 177.04 1iy1 s ARG 187 N -1.23 3.33 0.02 0.00 1.81 -1.26 -4.68 118.95 116.94 1iy1 s ARG 187 Ca 0.33 -0.69 -0.04 0.00 -1.72 0.00 0.00 55.73 53.62 1iy1 s ARG 187 Cb -0.20 -2.74 -0.04 0.00 -0.45 0.00 0.00 34.95 31.51 1iy1 s ARG 187 CO 0.22 0.03 0.23 0.42 -0.68 0.00 0.00 175.30 175.52 1iy1 s ILE 188 N 0.82 5.36 0.37 1.52 -1.09 -1.26 -5.02 121.20 121.90 1iy1 s ILE 188 Ca -0.04 -0.07 0.14 0.00 -2.23 0.00 0.00 60.65 58.46 1iy1 s ILE 188 Cb -0.15 -3.57 0.36 0.00 -1.58 0.00 0.00 42.46 37.52 1iy1 s ILE 188 CO 0.01 0.29 1.78 -0.65 -1.23 0.00 0.00 174.94 175.13 1iy1 h PRO 189 N 3.68 0.48 -2.75 2.79 0.11 -1.99 -3.46 132.00 130.88 1iy1 h PRO 189 Ca -0.48 -0.03 -0.19 0.00 0.11 0.00 0.00 66.00 65.41 1iy1 h PRO 189 Cb 1.18 -0.11 -0.04 0.00 0.11 0.00 0.00 31.00 32.14 1iy1 h PRO 189 CO 0.69 0.32 -0.21 1.63 -0.21 0.00 0.00 178.00 180.23 1iy1 n LYS 190 N -4.68 -1.77 -3.18 1.05 5.02 -1.26 -4.82 118.16 108.52 1iy1 n LYS 190 Ca 0.24 0.51 0.02 0.00 -2.02 0.00 0.00 58.31 57.06 1iy1 n LYS 190 Cb 0.77 -4.87 -0.01 0.00 -0.02 0.00 0.00 35.03 30.91 1iy1 n LYS 190 CO 0.00 0.00 0.00 0.20 -0.52 0.00 0.00 177.40 177.08 1iy1 s GLY 191 N -1.90 -1.28 -0.18 0.72 0.00 -1.26 -2.39 107.32 101.03 1iy1 s GLY 191 Ca 0.00 0.47 -0.02 0.00 0.00 0.00 0.00 44.72 45.17 1iy1 s GLY 191 CO 0.00 3.71 -0.09 0.14 0.00 0.00 0.00 173.10 176.85 1iy1 s VAL 192 N 2.08 3.10 -0.26 1.40 1.01 -0.08 -3.42 120.40 124.22 1iy1 s VAL 192 Ca 0.15 -0.61 -0.09 0.00 0.00 0.00 0.00 61.98 61.43 1iy1 s VAL 192 Cb -0.05 -2.36 -0.04 0.00 0.00 0.00 0.00 36.38 33.93 1iy1 s VAL 192 CO -0.12 0.47 0.12 -0.22 0.00 0.00 0.00 175.10 175.36 1iy1 s LEU 193 N 1.06 3.71 -0.25 3.92 2.96 -0.24 -1.55 118.68 128.30 1iy1 s LEU 193 Ca 0.00 -0.10 -0.18 0.00 -0.22 0.00 0.00 54.13 53.63 1iy1 s LEU 193 Cb -0.15 -2.01 -0.03 0.00 0.50 0.00 0.00 46.19 44.51 1iy1 s LEU 193 CO -0.02 -0.02 0.51 -0.76 -1.32 0.00 0.00 176.35 174.74 1iy1 s LEU 194 N 1.57 4.07 -0.14 -0.68 1.43 -0.70 -0.55 118.68 123.68 1iy1 s LEU 194 Ca 0.06 0.55 -0.02 0.00 -1.03 0.00 0.00 54.13 53.69 1iy1 s LEU 194 Cb -0.15 -2.66 -0.02 0.00 0.03 0.00 0.00 46.19 43.38 1iy1 s LEU 194 CO 0.06 -0.26 -0.08 -0.69 0.23 0.00 0.00 176.35 175.62 1iy1 s VAL 195 N 2.15 3.55 0.00 -1.59 1.01 0.43 -1.97 120.40 123.98 1iy1 s VAL 195 Ca 0.22 -0.48 0.00 0.00 0.00 0.00 0.00 61.98 61.71 1iy1 s VAL 195 Cb -0.16 -2.53 0.00 0.00 0.00 0.00 0.00 36.38 33.70 1iy1 s VAL 195 CO 0.09 0.51 0.00 0.61 0.00 0.00 0.00 175.10 176.31 1iy1 n GLY 196 N 3.47 1.67 3.58 4.51 0.00 -0.67 0.62 105.19 118.37 1iy1 n GLY 196 Ca -0.18 -0.90 -0.30 0.00 0.00 0.00 0.00 46.02 44.64 1iy1 n GLY 196 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1iy1 n PRO 197 N -0.59 -1.34 -2.04 1.61 -0.02 -1.26 -3.62 135.00 127.73 1iy1 n PRO 197 Ca 0.00 -0.34 -0.35 0.00 -2.02 0.00 0.00 63.50 60.79 1iy1 n PRO 197 Cb 0.00 -2.29 0.03 0.00 -0.02 0.00 0.00 33.50 31.22 1iy1 n PRO 197 CO 0.00 0.00 0.00 -2.14 1.98 0.00 0.00 175.50 175.34 1iy1 s PRO 198 N -4.53 3.06 -1.19 0.52 0.02 -1.26 -3.76 135.00 127.85 1iy1 s PRO 198 Ca 0.68 1.67 -0.01 0.00 0.02 0.00 0.00 61.00 63.35 1iy1 s PRO 198 Cb -0.24 -1.96 -0.01 0.00 0.02 0.00 0.00 34.50 32.31 1iy1 s PRO 198 CO 0.61 -1.10 0.95 0.41 -0.33 0.00 0.00 177.00 177.54 1iy1 n GLY 199 N 0.20 -0.46 0.00 0.52 0.00 -1.26 -4.38 105.19 99.82 1iy1 n GLY 199 Ca 0.12 0.17 0.00 0.00 0.00 0.00 0.00 46.02 46.31 1iy1 n GLY 199 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1iy1 n VAL 200 N -4.04 0.00 0.00 1.61 0.31 -1.25 0.41 118.33 115.37 1iy1 n VAL 200 Ca -0.26 -0.19 0.00 0.00 -0.01 0.00 0.00 64.34 63.88 1iy1 n VAL 200 Cb 0.66 0.68 0.00 0.00 -0.91 0.00 0.00 33.84 34.27 1iy1 n VAL 200 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1iy1 n GLY 201 N 1.61 1.37 0.20 2.92 0.00 -1.26 -4.45 105.19 105.57 1iy1 n GLY 201 Ca 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.93 1iy1 n GLY 201 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1iy1 h LYS 202 N 1.04 0.61 -0.30 1.61 1.57 -1.96 0.35 116.57 119.48 1iy1 h LYS 202 Ca 0.00 -0.11 -0.13 0.00 -1.87 0.00 0.00 60.65 58.54 1iy1 h LYS 202 Cb 0.00 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.20 1iy1 h LYS 202 CO 0.00 0.57 -0.36 1.15 -0.57 0.00 0.00 179.45 180.24 1iy1 h THR 203 N 0.51 1.29 -0.46 -0.16 2.02 -1.99 -1.47 112.91 112.66 1iy1 h THR 203 Ca 0.14 -1.51 -0.05 0.00 0.77 0.00 0.00 66.41 65.75 1iy1 h THR 203 Cb 0.18 1.45 -0.02 0.00 -1.74 0.00 0.00 68.15 68.02 1iy1 h THR 203 CO -0.01 0.49 0.08 -0.74 0.37 0.00 0.00 175.52 175.71 1iy1 h HIS 204 N 0.56 0.81 -0.27 3.16 -0.00 -1.90 0.36 115.15 117.87 1iy1 h HIS 204 Ca 0.06 -0.11 -0.05 0.00 -0.00 0.00 0.00 60.37 60.27 1iy1 h HIS 204 Cb 0.88 -0.22 -0.01 0.00 -0.00 0.00 0.00 27.41 28.06 1iy1 h HIS 204 CO 0.04 0.75 -0.01 1.25 -0.00 0.00 0.00 177.93 179.96 1iy1 h LEU 205 N 0.63 0.48 -0.07 0.26 5.85 -0.22 -1.19 115.31 121.05 1iy1 h LEU 205 Ca 0.14 -0.32 0.01 0.00 0.84 0.00 0.00 57.88 58.56 1iy1 h LEU 205 Cb 0.37 -0.13 -0.01 0.00 0.37 0.00 0.00 40.66 41.26 1iy1 h LEU 205 CO 0.01 0.68 -0.02 0.00 -0.34 0.00 0.00 178.44 178.77 1iy1 h ALA 206 N 0.81 0.04 -0.77 1.25 0.00 -1.14 0.55 119.26 120.01 1iy1 h ALA 206 Ca 0.07 0.03 0.07 0.00 0.00 0.00 0.00 54.91 55.08 1iy1 h ALA 206 Cb 0.44 0.06 -0.06 0.00 0.00 0.00 0.00 17.79 18.23 1iy1 h ALA 206 CO 0.02 -0.49 0.45 -0.09 0.00 0.00 0.00 179.25 179.13 1iy1 h ARG 207 N -0.01 0.79 -0.17 0.00 2.43 -0.84 0.35 114.38 116.93 1iy1 h ARG 207 Ca 0.03 -0.05 -0.03 0.00 -0.81 0.00 0.00 59.98 59.13 1iy1 h ARG 207 Cb 0.06 -0.18 -0.01 0.00 -0.42 0.00 0.00 29.97 29.42 1iy1 h ARG 207 CO -0.08 0.52 -0.03 0.00 -1.51 0.00 0.00 179.97 178.87 1iy1 h ALA 208 N 1.40 1.63 -0.16 2.80 0.00 -0.48 -0.31 119.26 124.13 1iy1 h ALA 208 Ca 0.35 -0.14 -0.10 0.00 0.00 0.00 0.00 54.91 55.03 1iy1 h ALA 208 Cb 0.23 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 1iy1 h ALA 208 CO -0.20 0.28 -0.33 0.28 0.00 0.00 0.00 179.25 179.28 1iy1 h VAL 209 N 0.25 1.28 0.00 0.00 2.07 0.12 0.55 116.25 120.52 1iy1 h VAL 209 Ca 0.06 -1.35 -0.17 0.00 0.82 0.00 0.00 66.70 66.06 1iy1 h VAL 209 Cb 0.23 1.52 -0.02 0.00 -1.52 0.00 0.00 31.29 31.50 1iy1 h VAL 209 CO 0.01 0.41 -0.82 0.00 0.02 0.00 0.00 177.57 177.19 1iy1 h ALA 210 N 1.39 0.60 0.17 1.67 0.00 -0.55 -3.14 119.26 119.39 1iy1 h ALA 210 Ca 0.03 -0.75 -0.31 0.00 0.00 0.00 0.00 54.91 53.89 1iy1 h ALA 210 Cb 0.72 -0.13 0.03 0.00 0.00 0.00 0.00 17.79 18.41 1iy1 h ALA 210 CO 0.05 1.02 -1.31 0.78 0.00 0.00 0.00 179.25 179.80 1iy1 h GLY 211 N 2.62 0.66 1.83 0.00 0.00 -0.65 0.15 103.07 107.68 1iy1 h GLY 211 Ca -0.01 -1.49 0.01 0.00 0.00 0.00 0.00 47.33 45.84 1iy1 h GLY 211 CO 0.11 1.31 0.08 -2.09 0.00 0.00 0.00 176.54 175.94 1iy1 h GLU 212 N 0.19 0.00 -0.29 4.80 4.57 0.07 0.36 114.58 124.28 1iy1 h GLU 212 Ca -0.21 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 57.97 1iy1 h GLU 212 Cb 1.99 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 30.58 1iy1 h GLU 212 CO 0.25 0.00 0.00 0.00 -1.18 0.00 0.00 179.01 178.08 1iy1 n ALA 213 N -2.16 2.26 -3.99 2.92 0.00 -1.19 -4.99 120.51 113.36 1iy1 n ALA 213 Ca -0.02 -1.02 -0.40 0.00 0.00 0.00 0.00 53.44 52.00 1iy1 n ALA 213 Cb 0.16 -0.45 0.01 0.00 0.00 0.00 0.00 19.45 19.17 1iy1 n ALA 213 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1iy1 n ARG 214 N 0.60 -0.80 -4.20 0.00 1.74 0.13 -4.54 116.66 109.59 1iy1 n ARG 214 Ca 0.11 0.20 -0.12 0.00 -0.77 0.00 0.00 57.85 57.27 1iy1 n ARG 214 Cb 0.40 -3.20 -0.10 0.00 -1.02 0.00 0.00 32.46 28.54 1iy1 n ARG 214 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 1iy1 s VAL 215 N -3.64 0.66 0.77 1.55 0.11 0.50 -5.02 120.40 115.33 1iy1 s VAL 215 Ca 0.40 -1.96 -0.14 0.00 -2.93 0.00 0.00 61.98 57.36 1iy1 s VAL 215 Cb -0.20 -1.90 0.06 0.00 -1.53 0.00 0.00 36.38 32.82 1iy1 s VAL 215 CO 0.94 -0.67 1.18 -2.84 -3.33 0.00 0.00 175.10 170.37 1iy1 s PRO 216 N -3.88 1.95 -0.33 1.54 0.02 -1.26 -4.42 135.00 128.62 1iy1 s PRO 216 Ca 0.18 1.64 0.00 0.00 0.02 0.00 0.00 61.00 62.84 1iy1 s PRO 216 Cb 0.06 -1.82 0.10 0.00 0.02 0.00 0.00 34.50 32.85 1iy1 s PRO 216 CO -0.00 -1.95 0.10 0.12 -0.33 0.00 0.00 177.00 174.94 1iy1 s PHE 217 N -2.24 2.09 -0.24 6.54 5.36 -1.26 -1.16 117.98 127.08 1iy1 s PHE 217 Ca 0.71 -2.01 -0.12 0.00 -0.96 0.00 0.00 56.93 54.55 1iy1 s PHE 217 Cb -0.26 -1.94 -0.05 0.00 -0.34 0.00 0.00 43.02 40.43 1iy1 s PHE 217 CO 0.49 -0.88 0.21 0.42 -1.46 0.00 0.00 175.22 173.99 1iy1 s ILE 218 N 1.40 5.32 0.41 3.12 1.01 0.60 -4.99 121.20 128.07 1iy1 s ILE 218 Ca 0.11 0.29 0.07 0.00 0.00 0.00 0.00 60.65 61.11 1iy1 s ILE 218 Cb -0.18 -3.55 -0.06 0.00 0.01 0.00 0.00 42.46 38.68 1iy1 s ILE 218 CO -0.20 0.31 0.13 0.42 0.00 0.00 0.00 174.94 175.60 1iy1 s THR 219 N 1.21 2.24 0.12 2.92 -4.23 -1.26 0.51 115.64 117.14 1iy1 s THR 219 Ca 0.10 -1.78 -0.22 0.00 -1.18 0.00 0.00 61.69 58.61 1iy1 s THR 219 Cb -0.14 -2.99 0.08 0.00 1.34 0.00 0.00 72.50 70.78 1iy1 s THR 219 CO 0.06 -0.01 1.03 0.00 -0.54 0.00 0.00 174.62 175.16 1iy1 n ALA 220 N -1.16 -2.75 -3.66 3.99 0.00 -0.42 -4.89 120.51 111.62 1iy1 n ALA 220 Ca -0.02 -0.89 -0.18 0.00 0.00 0.00 0.00 53.44 52.34 1iy1 n ALA 220 Cb 0.65 0.42 -0.16 0.00 0.00 0.00 0.00 19.45 20.36 1iy1 n ALA 220 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1iy1 s SER 221 N -3.38 0.96 0.63 0.00 0.15 -1.26 -1.76 113.70 109.04 1iy1 s SER 221 Ca 0.23 0.20 0.29 0.00 0.70 0.00 0.00 55.95 57.37 1iy1 s SER 221 Cb -0.02 0.15 1.55 0.00 -1.71 0.00 0.00 66.02 65.99 1iy1 s SER 221 CO 0.03 -0.25 1.91 1.23 1.20 0.00 0.00 173.24 177.36 1iy1 h GLY 222 N 8.39 0.00 0.72 9.45 0.00 -0.44 0.13 103.07 121.31 1iy1 h GLY 222 Ca -0.13 0.00 -0.08 0.00 0.00 0.00 0.00 47.33 47.12 1iy1 h GLY 222 CO 0.16 0.00 -0.25 0.23 0.00 0.00 0.00 176.54 176.68 1iy1 h SER 223 N 0.00 0.40 -0.27 0.19 0.87 -1.69 -2.82 113.55 110.24 1iy1 h SER 223 Ca 0.09 -0.58 -0.01 0.00 -1.23 0.00 0.00 61.79 60.06 1iy1 h SER 223 Cb 0.87 -0.12 -0.01 0.00 -0.44 0.00 0.00 62.40 62.70 1iy1 h SER 223 CO -0.00 0.91 0.13 0.44 -0.53 0.00 0.00 176.83 177.78 1iy1 h ASP 224 N -0.08 0.34 -0.74 6.23 3.32 -1.13 -2.01 116.42 122.35 1iy1 h ASP 224 Ca -0.00 -0.12 0.16 0.00 0.02 0.00 0.00 57.03 57.09 1iy1 h ASP 224 Cb 0.85 -0.09 -0.11 0.00 0.22 0.00 0.00 39.33 40.20 1iy1 h ASP 224 CO 0.05 0.37 0.21 -0.26 -1.72 0.00 0.00 179.24 177.89 1iy1 h PHE 225 N 0.30 0.33 0.00 4.55 0.05 -1.45 0.31 116.94 121.03 1iy1 h PHE 225 Ca 0.09 0.04 -0.08 0.00 3.82 0.00 0.00 57.97 61.84 1iy1 h PHE 225 Cb 0.11 -0.03 -0.01 0.00 2.00 0.00 0.00 35.95 38.02 1iy1 h PHE 225 CO -0.02 -0.06 -0.38 0.28 -0.18 0.00 0.00 178.31 177.95 1iy1 h VAL 226 N 0.30 1.07 0.00 -0.55 2.07 -1.22 -2.72 116.25 115.20 1iy1 h VAL 226 Ca 0.42 -1.38 -0.06 0.00 0.82 0.00 0.00 66.70 66.50 1iy1 h VAL 226 Cb 0.71 1.79 -0.01 0.00 -1.52 0.00 0.00 31.29 32.26 1iy1 h VAL 226 CO -0.49 0.37 -0.28 -0.08 0.02 0.00 0.00 177.57 177.10 1iy1 h GLU 227 N 0.00 0.00 -7.29 1.57 4.57 0.33 -3.44 114.58 110.31 1iy1 h GLU 227 Ca -0.00 0.00 -0.50 0.00 -1.18 0.00 0.00 59.36 57.67 1iy1 h GLU 227 Cb 0.76 0.00 0.08 0.00 -0.16 0.00 0.00 28.75 29.43 1iy1 h GLU 227 CO 0.05 0.28 0.37 -1.64 -1.18 0.00 0.00 179.01 176.89 1iy1 s MET 228 N -3.69 3.11 0.77 1.92 -1.94 -0.66 -5.01 119.30 113.81 1iy1 s MET 228 Ca -0.00 1.02 -0.15 0.00 -1.71 0.00 0.00 55.69 54.85 1iy1 s MET 228 Cb 0.11 -2.01 0.04 0.00 2.01 0.00 0.00 34.83 34.98 1iy1 s MET 228 CO 0.65 -0.96 1.04 1.19 -0.01 0.00 0.00 175.02 176.93 1iy1 n PHE 229 N -2.73 0.81 -1.75 -0.03 0.99 -1.26 -4.64 117.46 108.85 1iy1 n PHE 229 Ca 0.08 0.39 -0.42 0.00 -0.00 0.00 0.00 57.45 57.50 1iy1 n PHE 229 Cb 0.53 -2.08 -0.01 0.00 -1.00 0.00 0.00 39.48 36.93 1iy1 n PHE 229 CO 0.00 0.00 0.00 0.28 -0.00 0.00 0.00 176.76 177.04 1iy1 n VAL 230 N -2.91 1.62 0.00 -4.37 0.31 -1.26 -1.50 118.33 110.22 1iy1 n VAL 230 Ca 0.13 -0.41 0.00 0.00 -0.01 0.00 0.00 64.34 64.05 1iy1 n VAL 230 Cb 0.50 -1.90 0.00 0.00 -0.91 0.00 0.00 33.84 31.53 1iy1 n VAL 230 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1iy1 n GLY 231 N 1.14 2.32 0.06 2.92 0.00 -1.26 -4.75 105.19 105.62 1iy1 n GLY 231 Ca 0.05 -0.34 -0.13 0.00 0.00 0.00 0.00 46.02 45.60 1iy1 n GLY 231 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1iy1 h VAL 232 N 0.00 1.34 -0.53 1.61 2.07 -1.60 -1.44 116.25 117.70 1iy1 h VAL 232 Ca 0.00 -1.04 0.10 0.00 0.82 0.00 0.00 66.70 66.58 1iy1 h VAL 232 Cb 0.00 2.00 -0.08 0.00 -1.52 0.00 0.00 31.29 31.69 1iy1 h VAL 232 CO 0.00 0.28 0.07 1.23 0.02 0.00 0.00 177.57 179.16 1iy1 h GLY 233 N -0.37 0.62 2.00 2.17 0.00 -1.70 0.14 103.07 105.93 1iy1 h GLY 233 Ca 0.00 0.01 -0.07 0.00 0.00 0.00 0.00 47.33 47.28 1iy1 h GLY 233 CO 0.00 -0.11 -0.32 0.00 0.00 0.00 0.00 176.54 176.11 1iy1 h ALA 234 N 1.44 1.33 -0.46 3.60 0.00 -1.79 -0.90 119.26 122.48 1iy1 h ALA 234 Ca 0.27 -0.29 -0.09 0.00 0.00 0.00 0.00 54.91 54.80 1iy1 h ALA 234 Cb 0.40 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 1iy1 h ALA 234 CO -0.39 0.40 -0.08 0.00 0.00 0.00 0.00 179.25 179.18 1iy1 h ALA 235 N 1.68 0.98 0.07 0.00 0.00 0.34 -2.12 119.26 120.21 1iy1 h ALA 235 Ca -0.00 -0.31 -0.25 0.00 0.00 0.00 0.00 54.91 54.35 1iy1 h ALA 235 Cb 0.62 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.23 1iy1 h ALA 235 CO 0.04 0.61 -1.08 0.00 0.00 0.00 0.00 179.25 178.82 1iy1 h ARG 236 N 0.75 0.31 -0.95 0.00 2.47 -0.61 -1.81 114.38 114.54 1iy1 h ARG 236 Ca 0.13 -0.42 0.05 0.00 -1.26 0.00 0.00 59.98 58.48 1iy1 h ARG 236 Cb 0.57 0.14 -0.06 0.00 -1.65 0.00 0.00 29.97 28.97 1iy1 h ARG 236 CO 0.04 1.14 0.61 0.28 0.56 0.00 0.00 179.97 182.60 1iy1 h VAL 237 N 0.14 1.11 -0.08 2.04 2.07 -1.01 0.38 116.25 120.89 1iy1 h VAL 237 Ca -0.10 -0.39 0.01 0.00 0.82 0.00 0.00 66.70 67.04 1iy1 h VAL 237 Cb 1.77 -0.13 -0.01 0.00 -1.52 0.00 0.00 31.29 31.39 1iy1 h VAL 237 CO 0.18 0.21 0.01 -0.09 0.02 0.00 0.00 177.57 177.89 1iy1 h ARG 238 N 1.14 0.04 -0.32 1.57 2.43 -1.19 -2.26 114.38 115.78 1iy1 h ARG 238 Ca 0.40 -0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.55 1iy1 h ARG 238 Cb 0.10 -0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 29.63 1iy1 h ARG 238 CO -0.15 0.02 0.14 -0.44 -1.51 0.00 0.00 179.97 178.03 1iy1 h ASP 239 N 0.04 0.40 0.37 -3.80 3.45 -0.27 -1.64 116.42 114.97 1iy1 h ASP 239 Ca 0.04 -0.03 -0.02 0.00 0.43 0.00 0.00 57.03 57.45 1iy1 h ASP 239 Cb 0.04 -0.10 0.00 0.00 -0.56 0.00 0.00 39.33 38.71 1iy1 h ASP 239 CO -0.06 0.36 -0.18 0.25 -1.57 0.00 0.00 179.24 178.04 1iy1 h LEU 240 N 0.45 -0.42 -0.95 1.55 5.85 0.26 -1.92 115.31 120.12 1iy1 h LEU 240 Ca 0.11 -0.06 -0.11 0.00 0.84 0.00 0.00 57.88 58.67 1iy1 h LEU 240 Cb 0.08 0.11 -0.02 0.00 0.37 0.00 0.00 40.66 41.20 1iy1 h LEU 240 CO -0.01 -0.21 -0.51 -0.26 -0.34 0.00 0.00 178.44 177.11 1iy1 h PHE 241 N -0.63 0.00 0.03 1.25 -1.00 -1.34 -1.40 116.94 113.86 1iy1 h PHE 241 Ca -0.05 0.00 -0.00 0.00 2.81 0.00 0.00 57.97 60.73 1iy1 h PHE 241 Cb 0.46 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.02 1iy1 h PHE 241 CO -0.02 0.51 -0.02 1.49 -1.61 0.00 0.00 178.31 178.66 1iy1 h GLU 242 N 0.00 -0.04 -0.88 1.51 4.81 -1.24 -0.42 114.58 118.31 1iy1 h GLU 242 Ca -0.01 0.00 0.03 0.00 -0.13 0.00 0.00 59.36 59.26 1iy1 h GLU 242 Cb 0.93 0.01 -0.05 0.00 0.63 0.00 0.00 28.75 30.27 1iy1 h GLU 242 CO 0.07 0.14 0.58 1.15 -0.73 0.00 0.00 179.01 180.22 1iy1 h THR 243 N -0.22 1.16 -0.14 0.32 2.02 -1.25 -1.82 112.91 112.97 1iy1 h THR 243 Ca -0.00 -0.38 -0.00 0.00 0.77 0.00 0.00 66.41 66.79 1iy1 h THR 243 Cb 0.20 -0.06 -0.01 0.00 -1.74 0.00 0.00 68.15 66.55 1iy1 h THR 243 CO 0.01 0.20 0.08 0.00 0.37 0.00 0.00 175.52 176.18 1iy1 h ALA 244 N 1.48 0.18 -0.20 6.16 0.00 -0.83 -1.67 119.26 124.39 1iy1 h ALA 244 Ca 0.35 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 55.18 1iy1 h ALA 244 Cb -0.01 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 1iy1 h ALA 244 CO -0.10 -0.30 -0.05 0.87 0.00 0.00 0.00 179.25 179.68 1iy1 h LYS 245 N 0.15 0.30 -0.83 0.00 1.57 -0.73 -1.43 116.57 115.59 1iy1 h LYS 245 Ca 0.05 -0.05 -0.02 0.00 -1.87 0.00 0.00 60.65 58.76 1iy1 h LYS 245 Cb 0.05 -0.05 -0.04 0.00 0.08 0.00 0.00 32.23 32.27 1iy1 h LYS 245 CO -0.01 0.37 0.45 0.00 -0.57 0.00 0.00 179.45 179.69 1iy1 h ARG 246 N 0.29 1.17 -1.31 3.15 3.08 -0.69 -3.09 114.38 116.98 1iy1 h ARG 246 Ca 0.06 -0.14 -0.66 0.00 0.07 0.00 0.00 59.98 59.31 1iy1 h ARG 246 Cb 0.27 -0.23 -0.34 0.00 0.08 0.00 0.00 29.97 29.76 1iy1 h ARG 246 CO 0.01 0.87 0.28 0.72 -1.07 0.00 0.00 179.97 180.77 1iy1 n HIS 247 N -4.38 3.09 -3.23 3.04 8.25 -0.58 -5.03 115.22 116.39 1iy1 n HIS 247 Ca 0.08 -2.68 -0.33 0.00 -0.26 0.00 0.00 57.72 54.53 1iy1 n HIS 247 Cb 0.10 -0.90 -0.06 0.00 1.12 0.00 0.00 29.99 30.25 1iy1 n HIS 247 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1iy1 s ALA 248 N -3.80 3.43 0.90 -1.41 0.00 -0.98 -4.15 121.76 115.76 1iy1 s ALA 248 Ca 0.55 -0.04 -0.12 0.00 0.00 0.00 0.00 51.96 52.35 1iy1 s ALA 248 Cb 0.45 -2.66 0.13 0.00 0.00 0.00 0.00 23.12 21.04 1iy1 s ALA 248 CO -0.14 0.39 1.12 -1.25 0.00 0.00 0.00 175.76 175.88 1iy1 s PRO 249 N -2.68 1.21 0.00 0.00 0.04 -1.26 -5.06 135.00 127.25 1iy1 s PRO 249 Ca 0.49 0.45 0.00 0.00 0.04 0.00 0.00 61.00 61.98 1iy1 s PRO 249 Cb -0.12 -1.83 0.00 0.00 0.04 0.00 0.00 34.50 32.59 1iy1 s PRO 249 CO 0.19 -2.18 0.00 0.00 0.04 0.00 0.00 177.00 175.05 1iy1 s ILE 251 N -2.00 2.34 -0.17 0.00 1.01 -0.31 -2.66 121.20 119.41 1iy1 s ILE 251 Ca 0.00 -0.99 -0.03 0.00 0.00 0.00 0.00 60.65 59.63 1iy1 s ILE 251 Cb 0.00 -1.85 -0.02 0.00 0.01 0.00 0.00 42.46 40.60 1iy1 s ILE 251 CO 0.00 0.58 -0.07 -0.69 0.00 0.00 0.00 174.94 174.77 1iy1 s VAL 252 N -0.57 3.50 -0.26 2.92 1.01 -0.84 -0.29 120.40 125.86 1iy1 s VAL 252 Ca 0.08 -0.48 0.01 0.00 0.00 0.00 0.00 61.98 61.59 1iy1 s VAL 252 Cb -0.11 -2.53 0.05 0.00 0.00 0.00 0.00 36.38 33.79 1iy1 s VAL 252 CO 0.00 0.48 -0.07 0.12 0.00 0.00 0.00 175.10 175.63 1iy1 s PHE 253 N 0.68 3.20 -0.25 5.22 5.36 0.18 -0.05 117.98 132.32 1iy1 s PHE 253 Ca -0.03 -2.01 -0.11 0.00 -0.96 0.00 0.00 56.93 53.82 1iy1 s PHE 253 Cb -0.15 -2.01 -0.05 0.00 -0.34 0.00 0.00 43.02 40.48 1iy1 s PHE 253 CO 0.02 -0.83 0.20 0.42 -1.46 0.00 0.00 175.22 173.57 1iy1 s ILE 254 N 1.20 5.32 0.11 3.12 -1.09 -0.43 -1.30 121.20 128.14 1iy1 s ILE 254 Ca -0.05 0.24 0.02 0.00 -2.23 0.00 0.00 60.65 58.62 1iy1 s ILE 254 Cb -0.19 -3.54 -0.04 0.00 -1.58 0.00 0.00 42.46 37.12 1iy1 s ILE 254 CO -0.04 0.30 0.24 -0.62 -1.23 0.00 0.00 174.94 173.58 1iy1 s ASP 255 N 1.29 6.25 -1.25 3.58 2.15 -0.72 -1.56 116.67 126.41 1iy1 s ASP 255 Ca 0.09 0.18 -0.10 0.00 0.43 0.00 0.00 52.55 53.14 1iy1 s ASP 255 Cb -0.14 -1.87 -0.01 0.00 -0.30 0.00 0.00 42.92 40.60 1iy1 s ASP 255 CO 0.07 0.10 0.67 -0.62 -0.17 0.00 0.00 175.17 175.22 1iy1 n GLU 256 N -0.17 -2.58 0.29 4.34 1.02 -1.07 0.11 120.64 122.59 1iy1 n GLU 256 Ca -0.06 0.49 0.17 0.00 -0.02 0.00 0.00 57.16 57.73 1iy1 n GLU 256 Cb 0.53 -4.50 0.87 0.00 -0.02 0.00 0.00 31.44 28.32 1iy1 n GLU 256 CO 0.00 0.00 0.00 0.97 1.18 0.00 0.00 177.13 179.28 1iy1 h ILE 257 N -1.85 0.23 0.00 -3.67 6.09 -1.54 -1.08 117.51 115.69 1iy1 h ILE 257 Ca -0.64 -0.36 0.00 0.00 -1.37 0.00 0.00 64.86 62.49 1iy1 h ILE 257 Cb 1.36 1.28 0.00 0.00 0.47 0.00 0.00 36.82 39.93 1iy1 h ILE 257 CO 0.54 0.05 0.00 -0.90 -3.07 0.00 0.00 178.15 174.76 1iy1 n ASP 258 N -3.32 0.00 -0.03 2.19 5.68 -1.26 -1.29 116.55 118.52 1iy1 n ASP 258 Ca -0.02 -0.06 -0.04 0.00 -0.50 0.00 0.00 54.79 54.18 1iy1 n ASP 258 Cb 0.20 -0.25 0.18 0.00 -1.14 0.00 0.00 41.12 40.11 1iy1 n ASP 258 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1iy1 h ALA 259 N 2.94 1.08 0.00 2.12 0.00 -1.48 0.28 119.26 124.20 1iy1 h ALA 259 Ca 0.00 -0.32 -0.21 0.00 0.00 0.00 0.00 54.91 54.38 1iy1 h ALA 259 Cb 0.16 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.78 1iy1 h ALA 259 CO 0.00 0.56 -1.16 0.28 0.00 0.00 0.00 179.25 178.94 1iy1 h VAL 260 N 0.54 0.86 0.66 0.00 2.07 -1.54 -3.40 116.25 115.44 1iy1 h VAL 260 Ca 0.09 -2.08 -0.03 0.00 0.82 0.00 0.00 66.70 65.50 1iy1 h VAL 260 Cb 0.61 2.06 -0.01 0.00 -1.52 0.00 0.00 31.29 32.43 1iy1 h VAL 260 CO 0.04 0.29 -0.47 1.23 0.02 0.00 0.00 177.57 178.68 1iy1 h GLY 261 N -1.00 -1.23 -7.52 2.17 0.00 -1.22 -3.44 103.07 90.82 1iy1 h GLY 261 Ca -0.31 0.53 -0.41 0.00 0.00 0.00 0.00 47.33 47.14 1iy1 h GLY 261 CO -0.19 -0.41 1.30 1.09 0.00 0.00 0.00 176.54 178.33 1iy1 s ARG 262 N -5.94 2.83 0.00 4.80 1.70 0.98 -3.24 118.95 120.08 1iy1 s ARG 262 Ca -0.18 -1.30 0.00 0.00 -0.47 0.00 0.00 55.73 53.77 1iy1 s ARG 262 Cb 0.04 -5.30 0.00 0.00 -0.57 0.00 0.00 34.95 29.12 1iy1 s ARG 262 CO 0.61 -3.57 0.00 -1.71 -1.08 0.00 0.00 175.30 169.55 1iy1 n ASN 272 N 13.03 -0.68 0.17 -2.89 5.15 -1.26 -4.99 115.26 123.79 1iy1 n ASN 272 Ca 0.45 0.00 -0.13 0.00 -0.60 0.00 0.00 54.58 54.30 1iy1 n ASN 272 Cb 0.47 0.46 -0.07 0.00 -0.53 0.00 0.00 39.78 40.10 1iy1 n ASN 272 CO 0.00 0.00 0.00 0.44 1.40 0.00 0.00 177.26 179.10 1iy1 h ASP 273 N 0.00 -1.06 -0.60 1.20 5.19 -2.01 -1.57 116.42 117.57 1iy1 h ASP 273 Ca 0.00 0.09 0.09 0.00 -0.62 0.00 0.00 57.03 56.59 1iy1 h ASP 273 Cb 0.00 0.37 -0.11 0.00 0.18 0.00 0.00 39.33 39.77 1iy1 h ASP 273 CO 0.00 -0.46 -0.44 -0.33 -3.12 0.00 0.00 179.24 174.89 1iy1 h GLU 274 N -0.68 -0.21 -0.97 3.56 3.07 -1.91 -0.16 114.58 117.29 1iy1 h GLU 274 Ca -0.03 0.01 0.10 0.00 -0.50 0.00 0.00 59.36 58.94 1iy1 h GLU 274 Cb 0.61 0.05 -0.07 0.00 -0.84 0.00 0.00 28.75 28.49 1iy1 h GLU 274 CO -0.10 -0.14 0.62 -0.09 -1.40 0.00 0.00 179.01 177.91 1iy1 h ARG 275 N -0.21 0.98 0.02 2.33 2.43 -1.82 -1.50 114.38 116.60 1iy1 h ARG 275 Ca 0.18 -0.06 -0.00 0.00 -0.81 0.00 0.00 59.98 59.29 1iy1 h ARG 275 Cb 0.56 -0.22 0.00 0.00 -0.42 0.00 0.00 29.97 29.89 1iy1 h ARG 275 CO -0.71 0.65 -0.01 0.93 -1.51 0.00 0.00 179.97 179.33 1iy1 h GLU 276 N 1.01 -0.02 -0.19 0.20 4.39 -0.22 -2.03 114.58 117.73 1iy1 h GLU 276 Ca 0.46 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 60.15 1iy1 h GLU 276 Cb 0.39 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.03 1iy1 h GLU 276 CO -0.22 0.52 0.08 1.96 -1.16 0.00 0.00 179.01 180.19 1iy1 h GLN 277 N -0.57 0.25 -0.01 2.33 4.20 -0.87 -0.54 115.11 119.91 1iy1 h GLN 277 Ca -0.00 -0.02 -0.24 0.00 0.06 0.00 0.00 58.65 58.45 1iy1 h GLN 277 Cb 0.55 -0.05 0.02 0.00 0.30 0.00 0.00 27.48 28.29 1iy1 h GLN 277 CO 0.00 0.21 -0.91 1.15 -0.67 0.00 0.00 178.83 178.61 1iy1 h THR 278 N 0.26 1.32 0.22 -0.54 2.02 -1.32 -2.64 112.91 112.23 1iy1 h THR 278 Ca 0.07 -2.18 -0.01 0.00 0.77 0.00 0.00 66.41 65.05 1iy1 h THR 278 Cb 0.05 2.42 0.00 0.00 -1.74 0.00 0.00 68.15 68.88 1iy1 h THR 278 CO -0.01 0.67 -0.11 0.25 0.37 0.00 0.00 175.52 176.69 1iy1 h LEU 279 N 0.27 -0.25 -0.67 2.58 5.85 -0.68 -1.56 115.31 120.84 1iy1 h LEU 279 Ca -0.11 -0.06 0.06 0.00 0.84 0.00 0.00 57.88 58.61 1iy1 h LEU 279 Cb 1.58 0.07 -0.06 0.00 0.37 0.00 0.00 40.66 42.62 1iy1 h LEU 279 CO 0.18 -0.10 0.37 0.78 -0.34 0.00 0.00 178.44 179.33 1iy1 h ASN 280 N -0.39 0.55 -0.19 1.25 2.35 -1.21 -0.56 115.58 117.38 1iy1 h ASN 280 Ca -0.03 0.03 0.02 0.00 -0.55 0.00 0.00 56.30 55.77 1iy1 h ASN 280 Cb 0.30 -0.08 -0.02 0.00 0.05 0.00 0.00 38.32 38.57 1iy1 h ASN 280 CO 0.05 0.35 0.06 -0.61 -1.65 0.00 0.00 177.43 175.63 1iy1 h GLN 281 N 0.68 0.14 -0.31 0.81 5.75 -1.35 0.57 115.11 121.39 1iy1 h GLN 281 Ca 0.30 -0.01 0.03 0.00 -0.15 0.00 0.00 58.65 58.82 1iy1 h GLN 281 Cb 0.19 -0.03 -0.03 0.00 1.07 0.00 0.00 27.48 28.68 1iy1 h GLN 281 CO -0.19 0.09 0.11 1.25 -2.65 0.00 0.00 178.83 177.45 1iy1 h LEU 282 N 0.14 0.13 -0.41 -2.39 5.85 -0.73 -0.24 115.31 117.66 1iy1 h LEU 282 Ca 0.08 0.03 0.02 0.00 0.84 0.00 0.00 57.88 58.85 1iy1 h LEU 282 Cb 0.06 0.01 -0.03 0.00 0.37 0.00 0.00 40.66 41.08 1iy1 h LEU 282 CO -0.09 0.11 0.25 -0.07 -0.34 0.00 0.00 178.44 178.29 1iy1 h LEU 283 N 0.25 0.41 -0.76 2.25 4.07 -0.70 0.82 115.31 121.65 1iy1 h LEU 283 Ca 0.14 0.00 -0.04 0.00 0.08 0.00 0.00 57.88 58.05 1iy1 h LEU 283 Cb 0.10 -0.09 -0.03 0.00 1.08 0.00 0.00 40.66 41.72 1iy1 h LEU 283 CO -0.14 0.29 0.30 0.58 -1.08 0.00 0.00 178.44 178.40 1iy1 h VAL 284 N 0.50 1.26 -0.53 1.22 2.07 -0.61 0.21 116.25 120.37 1iy1 h VAL 284 Ca 0.16 -0.81 -0.02 0.00 0.82 0.00 0.00 66.70 66.85 1iy1 h VAL 284 Cb -0.01 0.36 -0.02 0.00 -1.52 0.00 0.00 31.29 30.10 1iy1 h VAL 284 CO -0.07 0.33 0.25 -0.33 0.02 0.00 0.00 177.57 177.77 1iy1 h GLU 285 N 1.11 0.78 0.00 1.57 4.39 -0.38 -1.27 114.58 120.77 1iy1 h GLU 285 Ca 0.25 -0.12 -0.10 0.00 0.34 0.00 0.00 59.36 59.74 1iy1 h GLU 285 Cb 0.22 -0.14 -0.01 0.00 -0.10 0.00 0.00 28.75 28.72 1iy1 h GLU 285 CO -0.02 0.65 -0.47 0.52 -1.16 0.00 0.00 179.01 178.53 1iy1 h MET 286 N 0.72 0.00 0.00 2.33 2.86 -0.56 -2.47 114.93 117.81 1iy1 h MET 286 Ca 0.18 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.82 1iy1 h MET 286 Cb 0.13 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.79 1iy1 h MET 286 CO -0.02 0.47 0.00 -0.44 1.06 0.00 0.00 176.91 177.98 1iy1 h ASP 287 N 0.00 0.00 -0.04 1.22 3.32 -0.68 -3.09 116.42 117.16 1iy1 h ASP 287 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1iy1 h ASP 287 Cb 1.05 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.60 1iy1 h ASP 287 CO 0.06 0.00 0.00 0.61 -1.72 0.00 0.00 179.24 178.19 1iy1 n GLY 288 N 0.76 0.16 3.65 2.75 0.00 -0.51 -4.83 105.19 107.18 1iy1 n GLY 288 Ca 0.03 -0.05 -0.42 0.00 0.00 0.00 0.00 46.02 45.58 1iy1 n GLY 288 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1iy1 s PHE 289 N -1.61 3.34 0.46 1.61 0.40 -1.17 -5.04 117.98 115.96 1iy1 s PHE 289 Ca 0.03 1.17 -0.01 0.00 -0.60 0.00 0.00 56.93 57.52 1iy1 s PHE 289 Cb 0.02 -3.04 -0.01 0.00 0.51 0.00 0.00 43.02 40.50 1iy1 s PHE 289 CO 0.02 -0.36 0.69 -1.83 0.70 0.00 0.00 175.22 174.44 1iy1 s GLU 290 N 2.65 3.13 0.20 0.44 -1.05 -1.26 -4.98 118.70 117.83 1iy1 s GLU 290 Ca 0.36 -0.37 -0.12 0.00 -0.15 0.00 0.00 54.97 54.69 1iy1 s GLU 290 Cb -0.16 -2.53 0.23 0.00 -0.44 0.00 0.00 34.13 31.24 1iy1 s GLU 290 CO 0.09 -0.26 1.71 0.87 0.95 0.00 0.00 175.26 178.61 1iy1 h LYS 291 N 0.36 0.23 0.00 -4.83 6.56 -2.02 -0.68 116.57 116.21 1iy1 h LYS 291 Ca -0.46 -0.01 0.00 0.00 -1.06 0.00 0.00 60.65 59.11 1iy1 h LYS 291 Cb 1.25 -0.05 0.00 0.00 -0.57 0.00 0.00 32.23 32.85 1iy1 h LYS 291 CO 0.58 0.16 0.00 -0.40 -2.06 0.00 0.00 179.45 177.73 1iy1 n ASP 292 N -5.12 0.00 -4.59 0.86 5.75 -1.26 -4.68 116.55 107.50 1iy1 n ASP 292 Ca 0.07 -0.30 -0.43 0.00 -0.01 0.00 0.00 54.79 54.12 1iy1 n ASP 292 Cb 0.27 0.00 -0.03 0.00 -1.03 0.00 0.00 41.12 40.34 1iy1 n ASP 292 CO 0.00 0.00 0.00 -0.89 -0.11 0.00 0.00 177.20 176.20 1iy1 s THR 293 N -2.00 4.32 -0.67 2.12 2.01 -0.26 -4.94 115.64 116.22 1iy1 s THR 293 Ca 0.09 1.14 -0.04 0.00 0.31 0.00 0.00 61.69 63.19 1iy1 s THR 293 Cb 0.04 -4.53 0.12 0.00 0.01 0.00 0.00 72.50 68.14 1iy1 s THR 293 CO 0.07 -0.90 2.57 0.00 -0.69 0.00 0.00 174.62 175.67 1iy1 n ALA 294 N 7.53 6.51 -3.01 7.40 0.00 -1.26 -4.89 120.51 132.79 1iy1 n ALA 294 Ca 0.10 -3.43 -0.25 0.00 0.00 0.00 0.00 53.44 49.86 1iy1 n ALA 294 Cb 0.49 -2.23 -0.16 0.00 0.00 0.00 0.00 19.45 17.55 1iy1 n ALA 294 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1iy1 s ILE 295 N -2.57 1.29 -0.19 0.00 1.01 -1.26 -2.94 121.20 116.53 1iy1 s ILE 295 Ca 0.56 -0.63 -0.03 0.00 0.00 0.00 0.00 60.65 60.56 1iy1 s ILE 295 Cb 0.35 -1.12 -0.01 0.00 0.01 0.00 0.00 42.46 41.69 1iy1 s ILE 295 CO -0.23 0.38 -0.07 -0.69 0.00 0.00 0.00 174.94 174.33 1iy1 s VAL 296 N 0.15 3.29 -0.38 2.92 1.01 -1.09 -4.82 120.40 121.48 1iy1 s VAL 296 Ca -0.05 -0.54 -0.17 0.00 0.00 0.00 0.00 61.98 61.22 1iy1 s VAL 296 Cb -0.12 -2.46 0.00 0.00 0.00 0.00 0.00 36.38 33.80 1iy1 s VAL 296 CO 0.02 0.46 0.43 -0.69 0.00 0.00 0.00 175.10 175.32 1iy1 s VAL 297 N 1.13 5.10 -0.15 2.92 1.01 -1.01 -1.98 120.40 127.42 1iy1 s VAL 297 Ca 0.01 -0.06 -0.05 0.00 0.00 0.00 0.00 61.98 61.88 1iy1 s VAL 297 Cb -0.15 -3.95 -0.03 0.00 0.00 0.00 0.00 36.38 32.25 1iy1 s VAL 297 CO -0.01 -0.27 0.01 -0.04 0.00 0.00 0.00 175.10 174.79 1iy1 s MET 298 N 2.16 3.63 0.26 2.72 -1.94 0.92 -0.90 119.30 126.15 1iy1 s MET 298 Ca 0.13 -0.41 0.09 0.00 -1.71 0.00 0.00 55.69 53.79 1iy1 s MET 298 Cb -0.16 -3.01 -0.05 0.00 2.01 0.00 0.00 34.83 33.61 1iy1 s MET 298 CO 0.13 0.38 -0.13 0.00 -0.01 0.00 0.00 175.02 175.38 1iy1 s ALA 299 N 0.03 2.40 0.02 3.03 0.00 -0.59 -1.32 121.76 125.34 1iy1 s ALA 299 Ca 0.03 -1.83 0.05 0.00 0.00 0.00 0.00 51.96 50.21 1iy1 s ALA 299 Cb -0.13 -0.06 -0.02 0.00 0.00 0.00 0.00 23.12 22.91 1iy1 s ALA 299 CO 0.02 0.09 -0.14 0.00 0.00 0.00 0.00 175.76 175.73 1iy1 s ALA 300 N -2.81 1.16 -0.09 0.00 0.00 -0.60 -1.72 121.76 117.70 1iy1 s ALA 300 Ca 0.27 -0.74 -0.20 0.00 0.00 0.00 0.00 51.96 51.29 1iy1 s ALA 300 Cb -0.00 -0.22 0.04 0.00 0.00 0.00 0.00 23.12 22.94 1iy1 s ALA 300 CO 0.11 0.24 0.47 0.99 0.00 0.00 0.00 175.76 177.58 1iy1 s THR 301 N -0.66 0.02 0.00 0.00 2.01 -0.83 -1.73 115.64 114.45 1iy1 s THR 301 Ca 0.03 -0.18 0.00 0.00 0.31 0.00 0.00 61.69 61.85 1iy1 s THR 301 Cb -0.07 -0.74 0.00 0.00 0.01 0.00 0.00 72.50 71.70 1iy1 s THR 301 CO 0.01 -0.10 0.00 -0.46 -0.69 0.00 0.00 174.62 173.38 1iy1 n ASN 302 N 1.76 1.20 -3.67 3.53 0.23 -1.24 -1.67 115.26 115.41 1iy1 n ASN 302 Ca -0.18 -0.33 -0.31 0.00 -0.53 0.00 0.00 54.58 53.24 1iy1 n ASN 302 Cb 0.56 0.90 -0.07 0.00 -2.08 0.00 0.00 39.78 39.09 1iy1 n ASN 302 CO 0.00 0.00 0.00 0.54 -0.93 0.00 0.00 177.26 176.87 1iy1 n ARG 303 N -1.02 2.72 0.10 -3.83 1.74 -1.26 -4.71 116.66 110.40 1iy1 n ARG 303 Ca 0.00 -4.61 0.10 0.00 -0.77 0.00 0.00 57.85 52.58 1iy1 n ARG 303 Cb 0.00 -2.32 0.45 0.00 -1.02 0.00 0.00 32.46 29.57 1iy1 n ARG 303 CO 0.00 0.00 0.00 -2.30 -1.52 0.00 0.00 177.63 173.81 1iy1 n PRO 304 N 1.26 0.14 0.01 5.56 -0.02 -1.26 -2.69 135.00 138.00 1iy1 n PRO 304 Ca 0.27 0.40 -0.07 0.00 -2.02 0.00 0.00 63.50 62.08 1iy1 n PRO 304 Cb 0.38 -1.79 0.11 0.00 -0.02 0.00 0.00 33.50 32.19 1iy1 n PRO 304 CO 0.00 0.00 0.00 0.38 1.98 0.00 0.00 175.50 177.86 1iy1 h ASP 305 N 0.00 0.55 0.21 2.55 3.04 -2.02 -3.25 116.42 117.51 1iy1 h ASP 305 Ca 0.00 -0.25 0.00 0.00 -3.24 0.00 0.00 57.03 53.54 1iy1 h ASP 305 Cb 0.30 -0.15 0.00 0.00 -1.04 0.00 0.00 39.33 38.44 1iy1 h ASP 305 CO 0.00 0.91 -0.78 2.30 -2.04 0.00 0.00 179.24 179.63 1iy1 n ILE 306 N -4.01 0.00 -1.69 4.15 -5.35 -1.10 -4.96 119.36 106.40 1iy1 n ILE 306 Ca -0.02 -0.00 -0.44 0.00 -0.27 0.00 0.00 62.75 62.02 1iy1 n ILE 306 Cb 0.53 0.68 -0.04 0.00 -1.74 0.00 0.00 39.64 39.07 1iy1 n ILE 306 CO 0.00 0.00 0.00 -0.11 -1.76 0.00 0.00 176.55 174.68 1iy1 n LEU 307 N -1.49 3.66 -4.68 7.28 7.94 -1.21 -2.37 117.00 126.13 1iy1 n LEU 307 Ca 0.05 1.03 -0.42 0.00 -1.11 0.00 0.00 56.01 55.56 1iy1 n LEU 307 Cb 0.33 -1.49 -0.03 0.00 0.53 0.00 0.00 43.42 42.76 1iy1 n LEU 307 CO 0.39 0.00 1.39 -0.62 -1.11 0.00 0.00 177.39 177.45 1iy1 s ASP 308 N 2.02 6.57 0.46 1.96 -1.08 -1.20 -4.82 116.67 120.58 1iy1 s ASP 308 Ca 0.81 2.50 0.33 0.00 -0.52 0.00 0.00 52.55 55.67 1iy1 s ASP 308 Cb -0.58 -2.55 1.47 0.00 -1.46 0.00 0.00 42.92 39.80 1iy1 s ASP 308 CO 0.38 -0.93 1.63 -0.65 0.52 0.00 0.00 175.17 176.12 1iy1 h PRO 309 N 8.87 0.07 0.00 4.34 0.11 -1.90 -0.96 132.00 142.53 1iy1 h PRO 309 Ca -0.43 -0.00 -0.06 0.00 0.11 0.00 0.00 66.00 65.61 1iy1 h PRO 309 Cb 1.20 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 32.29 1iy1 h PRO 309 CO 0.94 0.05 -0.29 0.00 -0.21 0.00 0.00 178.00 178.48 1iy1 h ALA 310 N 1.52 1.48 -0.06 -0.75 0.00 -1.99 -2.71 119.26 116.75 1iy1 h ALA 310 Ca 0.82 -0.27 -0.05 0.00 0.00 0.00 0.00 54.91 55.41 1iy1 h ALA 310 Cb 2.70 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 20.44 1iy1 h ALA 310 CO -0.35 0.37 -0.22 -0.07 0.00 0.00 0.00 179.25 178.98 1iy1 h LEU 311 N 0.00 0.10 -0.83 0.00 3.38 -1.55 -2.93 115.31 113.48 1iy1 h LEU 311 Ca -0.00 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.94 1iy1 h LEU 311 Cb 0.53 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.26 1iy1 h LEU 311 CO 0.04 0.32 0.00 0.18 0.09 0.00 0.00 178.44 179.07 1iy1 n LEU 312 N -4.24 1.25 -4.79 1.67 4.77 -1.02 -0.17 117.00 114.46 1iy1 n LEU 312 Ca -0.02 -0.52 -0.35 0.00 -0.03 0.00 0.00 56.01 55.10 1iy1 n LEU 312 Cb 0.30 -0.07 -0.05 0.00 -2.33 0.00 0.00 43.42 41.27 1iy1 n LEU 312 CO 0.38 0.26 0.70 -0.13 -1.33 0.00 0.00 177.39 177.27 1iy1 s ARG 313 N -1.85 4.11 0.14 3.23 0.52 -1.11 -4.29 118.95 119.71 1iy1 s ARG 313 Ca 0.32 1.38 -0.34 0.00 -0.52 0.00 0.00 55.73 56.56 1iy1 s ARG 313 Cb 0.16 -2.37 -0.16 0.00 0.52 0.00 0.00 34.95 33.11 1iy1 s ARG 313 CO 0.25 -0.16 1.25 -0.35 0.02 0.00 0.00 175.30 176.31 1iy1 n PRO 314 N -0.38 1.23 0.00 3.54 -0.04 -1.26 -0.84 135.00 137.25 1iy1 n PRO 314 Ca 0.06 0.44 0.00 0.00 -0.04 0.00 0.00 63.50 63.96 1iy1 n PRO 314 Cb 0.51 -2.00 0.00 0.00 -0.04 0.00 0.00 33.50 31.97 1iy1 n PRO 314 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1iy1 n GLY 315 N 2.25 3.11 0.00 0.55 0.00 -1.26 -4.98 105.19 104.86 1iy1 n GLY 315 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.18 1iy1 n GLY 315 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1iy1 n ARG 316 N -1.39 0.00 -2.46 1.61 1.74 -0.02 -4.80 116.66 111.34 1iy1 n ARG 316 Ca 0.00 0.00 -0.42 0.00 -0.77 0.00 0.00 57.85 56.66 1iy1 n ARG 316 Cb 0.00 0.00 0.01 0.00 -1.02 0.00 0.00 32.46 31.45 1iy1 n ARG 316 CO 0.00 0.00 0.00 1.19 -1.52 0.00 0.00 177.63 177.30 1iy1 n PHE 317 N 0.00 2.71 -2.62 -1.55 3.01 0.76 -4.05 117.46 115.72 1iy1 n PHE 317 Ca 0.00 -2.73 -0.39 0.00 1.01 0.00 0.00 57.45 55.34 1iy1 n PHE 317 Cb 0.00 -1.74 0.01 0.00 -0.01 0.00 0.00 39.48 37.74 1iy1 n PHE 317 CO 0.00 0.00 0.00 -0.40 1.01 0.00 0.00 176.76 177.37 1iy1 n ASP 318 N 2.88 7.01 0.00 4.37 5.75 -1.22 -4.32 116.55 131.01 1iy1 n ASP 318 Ca 0.39 -3.70 0.00 0.00 -0.01 0.00 0.00 54.79 51.47 1iy1 n ASP 318 Cb 0.34 -1.08 0.00 0.00 -1.03 0.00 0.00 41.12 39.35 1iy1 n ASP 318 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 1iy1 n ARG 319 N -0.12 0.00 -4.01 0.11 1.74 -1.25 -4.93 116.66 108.20 1iy1 n ARG 319 Ca 0.45 0.00 -0.11 0.00 -0.77 0.00 0.00 57.85 57.42 1iy1 n ARG 319 Cb 0.28 0.00 -0.12 0.00 -1.02 0.00 0.00 32.46 31.60 1iy1 n ARG 319 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 1iy1 s GLN 320 N 0.00 0.33 -0.16 5.56 -0.21 -1.26 -1.08 119.66 122.84 1iy1 s GLN 320 Ca 0.00 -0.50 -0.01 0.00 0.02 0.00 0.00 55.36 54.88 1iy1 s GLN 320 Cb 0.00 -0.09 0.04 0.00 1.00 0.00 0.00 33.01 33.96 1iy1 s GLN 320 CO 0.00 0.01 -0.04 0.42 -2.12 0.00 0.00 175.29 173.55 1iy1 s ILE 321 N -1.03 1.02 0.40 1.08 1.01 0.28 -4.95 121.20 119.02 1iy1 s ILE 321 Ca -0.09 -0.56 -0.25 0.00 0.00 0.00 0.00 60.65 59.75 1iy1 s ILE 321 Cb -0.07 -1.21 -0.08 0.00 0.01 0.00 0.00 42.46 41.10 1iy1 s ILE 321 CO -0.00 0.13 1.12 0.00 0.00 0.00 0.00 174.94 176.19 1iy1 s ALA 322 N 1.67 3.12 -0.06 9.38 0.00 -1.26 -0.42 121.76 134.18 1iy1 s ALA 322 Ca 0.01 0.87 -0.00 0.00 0.00 0.00 0.00 51.96 52.83 1iy1 s ALA 322 Cb -0.15 -3.34 0.03 0.00 0.00 0.00 0.00 23.12 19.65 1iy1 s ALA 322 CO -0.08 -0.42 -0.01 0.42 0.00 0.00 0.00 175.76 175.67 1iy1 s ILE 323 N -1.50 0.42 0.52 0.00 1.01 0.20 -4.84 121.20 117.01 1iy1 s ILE 323 Ca 0.58 0.04 0.06 0.00 0.00 0.00 0.00 60.65 61.32 1iy1 s ILE 323 Cb -0.27 -0.53 0.05 0.00 0.01 0.00 0.00 42.46 41.71 1iy1 s ILE 323 CO 0.34 0.24 0.72 1.51 0.00 0.00 0.00 174.94 177.76 1iy1 s ASP 324 N 1.59 5.29 0.42 3.58 1.47 -1.26 -4.26 116.67 123.50 1iy1 s ASP 324 Ca -0.01 -0.39 -0.24 0.00 1.18 0.00 0.00 52.55 53.09 1iy1 s ASP 324 Cb -0.13 -0.44 -0.11 0.00 -0.34 0.00 0.00 42.92 41.90 1iy1 s ASP 324 CO -0.04 -1.11 0.94 0.00 0.68 0.00 0.00 175.17 175.65 1iy1 n ALA 325 N -2.18 -0.08 -1.51 2.11 0.00 -1.26 -4.89 120.51 112.70 1iy1 n ALA 325 Ca 0.10 0.22 -0.36 0.00 0.00 0.00 0.00 53.44 53.40 1iy1 n ALA 325 Cb 0.60 -2.04 0.08 0.00 0.00 0.00 0.00 19.45 18.09 1iy1 n ALA 325 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1iy1 n PRO 326 N 0.20 0.74 -1.31 0.00 -0.04 -1.26 -4.97 135.00 128.36 1iy1 n PRO 326 Ca 0.10 0.31 -0.23 0.00 -0.04 0.00 0.00 63.50 63.63 1iy1 n PRO 326 Cb 0.39 -2.30 0.17 0.00 -0.04 0.00 0.00 33.50 31.72 1iy1 n PRO 326 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 1iy1 n ASP 327 N -1.61 -0.46 -0.27 3.54 3.85 -1.26 -4.62 116.55 115.71 1iy1 n ASP 327 Ca 0.14 -1.28 0.04 0.00 -0.71 0.00 0.00 54.79 52.98 1iy1 n ASP 327 Cb 0.49 -0.80 0.17 0.00 -1.35 0.00 0.00 41.12 39.63 1iy1 n ASP 327 CO 0.00 0.00 0.00 1.62 -1.01 0.00 0.00 177.20 177.81 1iy1 h VAL 328 N -1.85 0.82 -0.35 2.12 3.04 -1.96 0.81 116.25 118.88 1iy1 h VAL 328 Ca -0.34 -0.22 -0.08 0.00 -1.01 0.00 0.00 66.70 65.05 1iy1 h VAL 328 Cb 0.95 0.11 -0.01 0.00 -2.01 0.00 0.00 31.29 30.33 1iy1 h VAL 328 CO 0.23 0.12 -0.11 0.50 -1.01 0.00 0.00 177.57 177.30 1iy1 h LYS 329 N 0.65 0.70 -0.28 4.17 1.63 -1.93 -1.62 116.57 119.89 1iy1 h LYS 329 Ca 0.40 -0.28 -0.03 0.00 -0.85 0.00 0.00 60.65 59.89 1iy1 h LYS 329 Cb 0.46 -0.03 -0.01 0.00 -0.60 0.00 0.00 32.23 32.05 1iy1 h LYS 329 CO -0.30 0.87 0.06 0.78 -3.45 0.00 0.00 179.45 177.41 1iy1 h GLY 330 N 0.49 0.42 0.83 5.01 0.00 -1.59 -0.77 103.07 107.47 1iy1 h GLY 330 Ca 0.09 -0.21 -0.11 0.00 0.00 0.00 0.00 47.33 47.10 1iy1 h GLY 330 CO 0.04 0.20 -0.33 3.21 0.00 0.00 0.00 176.54 179.66 1iy1 h ARG 331 N 0.39 0.49 -0.83 4.80 3.08 -0.66 -2.95 114.38 118.71 1iy1 h ARG 331 Ca 0.09 -0.32 0.05 0.00 0.07 0.00 0.00 59.98 59.87 1iy1 h ARG 331 Cb 0.17 0.04 -0.06 0.00 0.08 0.00 0.00 29.97 30.20 1iy1 h ARG 331 CO -0.00 0.93 0.51 1.49 -1.07 0.00 0.00 179.97 181.83 1iy1 h GLU 332 N 0.12 0.92 -0.66 0.04 4.81 -0.78 -1.33 114.58 117.71 1iy1 h GLU 332 Ca 0.00 -0.06 -0.05 0.00 -0.13 0.00 0.00 59.36 59.13 1iy1 h GLU 332 Cb 0.92 -0.21 -0.03 0.00 0.63 0.00 0.00 28.75 30.07 1iy1 h GLU 332 CO 0.07 0.61 0.22 1.96 -0.73 0.00 0.00 179.01 181.14 1iy1 h GLN 333 N 0.95 0.99 -0.17 1.92 4.20 -1.13 0.50 115.11 122.37 1iy1 h GLN 333 Ca 0.36 -0.19 -0.10 0.00 0.06 0.00 0.00 58.65 58.78 1iy1 h GLN 333 Cb 0.13 -0.16 -0.00 0.00 0.30 0.00 0.00 27.48 27.76 1iy1 h GLN 333 CO -0.16 0.84 -0.27 0.82 -0.67 0.00 0.00 178.83 179.39 1iy1 h ILE 334 N 0.96 1.35 -0.62 2.54 2.04 -1.26 -2.18 117.51 120.34 1iy1 h ILE 334 Ca 0.22 -1.50 0.05 0.00 1.00 0.00 0.00 64.86 64.63 1iy1 h ILE 334 Cb 0.25 1.90 -0.05 0.00 -0.74 0.00 0.00 36.82 38.19 1iy1 h ILE 334 CO -0.01 0.45 0.35 -0.07 0.00 0.00 0.00 178.15 178.87 1iy1 h LEU 335 N 0.13 0.54 -0.91 1.44 3.38 -1.02 -1.06 115.31 117.81 1iy1 h LEU 335 Ca 0.01 0.02 -0.02 0.00 0.09 0.00 0.00 57.88 57.99 1iy1 h LEU 335 Cb 0.85 -0.09 -0.04 0.00 0.09 0.00 0.00 40.66 41.47 1iy1 h LEU 335 CO 0.06 0.36 0.51 0.03 0.09 0.00 0.00 178.44 179.49 1iy1 h ARG 336 N 0.67 1.26 0.55 1.13 2.47 -0.83 0.33 114.38 119.95 1iy1 h ARG 336 Ca 0.27 -0.14 -0.03 0.00 -1.26 0.00 0.00 59.98 58.82 1iy1 h ARG 336 Cb 0.12 -0.25 0.01 0.00 -1.65 0.00 0.00 29.97 28.20 1iy1 h ARG 336 CO -0.15 0.91 -0.26 0.82 0.56 0.00 0.00 179.97 181.84 1iy1 h ILE 337 N 1.26 0.30 0.00 2.04 2.04 -0.73 -3.09 117.51 119.33 1iy1 h ILE 337 Ca 0.32 -0.38 -0.00 0.00 1.00 0.00 0.00 64.86 65.79 1iy1 h ILE 337 Cb 0.01 0.41 -0.00 0.00 -0.74 0.00 0.00 36.82 36.50 1iy1 h ILE 337 CO -0.05 0.04 -0.02 0.45 0.00 0.00 0.00 178.15 178.57 1iy1 h HIS 338 N -1.03 0.00 0.00 1.37 3.86 -1.14 -0.60 115.15 117.62 1iy1 h HIS 338 Ca -0.08 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.13 1iy1 h HIS 338 Cb 0.64 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.11 1iy1 h HIS 338 CO 0.01 0.02 0.00 0.00 0.86 0.00 0.00 177.93 178.82 1iy1 h ALA 339 N 1.98 1.00 -2.25 2.45 0.00 -0.28 -3.44 119.26 118.72 1iy1 h ALA 339 Ca -0.00 0.00 -0.55 0.00 0.00 0.00 0.00 54.91 54.36 1iy1 h ALA 339 Cb 0.23 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.02 1iy1 h ALA 339 CO 0.00 0.00 1.13 -0.98 0.00 0.00 0.00 179.25 179.40 1iy1 s ARG 340 N -3.42 4.10 0.00 0.00 1.70 -0.23 -1.61 118.95 119.49 1iy1 s ARG 340 Ca 0.04 2.21 0.00 0.00 -0.47 0.00 0.00 55.73 57.51 1iy1 s ARG 340 Cb 0.09 -4.03 0.00 0.00 -0.57 0.00 0.00 34.95 30.43 1iy1 s ARG 340 CO 0.54 -0.95 0.00 0.41 -1.08 0.00 0.00 175.30 174.22 1iy1 n GLY 341 N 4.31 0.77 3.57 3.88 0.00 -1.26 -5.06 105.19 111.38 1iy1 n GLY 341 Ca 0.18 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.87 1iy1 n GLY 341 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1iy1 s LYS 342 N -0.49 2.69 -1.11 1.61 1.02 -0.63 -5.06 119.74 117.78 1iy1 s LYS 342 Ca 0.00 -0.59 -0.21 0.00 0.02 0.00 0.00 55.97 55.19 1iy1 s LYS 342 Cb 0.00 -2.55 0.07 0.00 -0.52 0.00 0.00 37.83 34.83 1iy1 s LYS 342 CO 0.00 0.65 1.52 -2.14 -0.92 0.00 0.00 175.35 174.46 1iy1 s PRO 343 N -0.85 3.73 0.49 -1.68 0.02 -1.26 -5.00 135.00 130.45 1iy1 s PRO 343 Ca 0.13 -1.49 -0.19 0.00 0.02 0.00 0.00 61.00 59.47 1iy1 s PRO 343 Cb -0.11 -5.38 -0.08 0.00 0.02 0.00 0.00 34.50 28.95 1iy1 s PRO 343 CO 0.02 -2.18 1.01 -0.51 -0.33 0.00 0.00 177.00 175.00 1iy1 s LEU 344 N 4.48 3.77 0.71 -5.54 1.43 -1.26 -0.85 118.68 121.43 1iy1 s LEU 344 Ca 0.48 1.78 -0.02 0.00 -1.03 0.00 0.00 54.13 55.33 1iy1 s LEU 344 Cb 0.01 -4.54 0.11 0.00 0.03 0.00 0.00 46.19 41.80 1iy1 s LEU 344 CO -0.04 -0.69 0.98 0.00 0.23 0.00 0.00 176.35 176.84 1iy1 s ALA 345 N -2.23 3.56 0.28 4.21 0.00 0.04 -4.76 121.76 122.85 1iy1 s ALA 345 Ca 0.64 -1.53 0.04 0.00 0.00 0.00 0.00 51.96 51.10 1iy1 s ALA 345 Cb -0.13 -2.14 0.39 0.00 0.00 0.00 0.00 23.12 21.24 1iy1 s ALA 345 CO 0.23 -1.39 1.68 0.93 0.00 0.00 0.00 175.76 177.21 1iy1 h GLU 346 N -0.52 0.38 0.00 0.00 4.39 -1.97 -2.99 114.58 113.88 1iy1 h GLU 346 Ca -0.39 -0.17 0.00 0.00 0.34 0.00 0.00 59.36 59.14 1iy1 h GLU 346 Cb 1.28 -0.01 0.00 0.00 -0.10 0.00 0.00 28.75 29.92 1iy1 h GLU 346 CO 0.44 0.69 0.00 -0.40 -1.16 0.00 0.00 179.01 178.59 1iy1 n ASP 347 N -4.06 0.17 -4.68 1.42 5.68 -1.26 -4.79 116.55 109.04 1iy1 n ASP 347 Ca -0.01 0.54 -0.42 0.00 -0.50 0.00 0.00 54.79 54.39 1iy1 n ASP 347 Cb 0.46 -0.57 -0.03 0.00 -1.14 0.00 0.00 41.12 39.84 1iy1 n ASP 347 CO 0.00 0.00 0.00 -0.69 -1.33 0.00 0.00 177.20 175.18 1iy1 s VAL 348 N -3.07 3.38 -0.52 2.12 1.01 -1.13 -4.63 120.40 117.56 1iy1 s VAL 348 Ca 0.07 0.67 0.03 0.00 0.00 0.00 0.00 61.98 62.75 1iy1 s VAL 348 Cb 0.11 -3.43 0.13 0.00 0.00 0.00 0.00 36.38 33.19 1iy1 s VAL 348 CO 0.33 -0.03 0.27 -0.62 0.00 0.00 0.00 175.10 175.06 1iy1 s ASP 349 N 2.78 4.44 0.55 3.32 3.68 -1.26 -4.96 116.67 125.22 1iy1 s ASP 349 Ca 0.72 -2.96 0.27 0.00 2.13 0.00 0.00 52.55 52.72 1iy1 s ASP 349 Cb -0.36 -1.66 1.61 0.00 -1.45 0.00 0.00 42.92 41.06 1iy1 s ASP 349 CO 0.30 -0.25 2.17 -0.07 0.13 0.00 0.00 175.17 177.45 1iy1 h LEU 350 N 6.60 0.00 -0.42 -1.34 4.07 -1.99 -1.09 115.31 121.15 1iy1 h LEU 350 Ca -0.07 0.00 -0.15 0.00 0.08 0.00 0.00 57.88 57.74 1iy1 h LEU 350 Cb 0.90 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 42.64 1iy1 h LEU 350 CO 0.69 0.06 -0.35 0.00 -1.08 0.00 0.00 178.44 177.75 1iy1 h ALA 351 N 1.94 0.60 -0.43 1.53 0.00 -1.95 -1.78 119.26 119.17 1iy1 h ALA 351 Ca -0.00 -0.44 -0.13 0.00 0.00 0.00 0.00 54.91 54.33 1iy1 h ALA 351 Cb 0.15 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 1iy1 h ALA 351 CO 0.01 0.68 -0.25 1.25 0.00 0.00 0.00 179.25 180.93 1iy1 h LEU 352 N 0.78 0.94 -1.29 0.00 5.85 -1.67 -1.05 115.31 118.87 1iy1 h LEU 352 Ca 0.07 -0.36 -0.01 0.00 0.84 0.00 0.00 57.88 58.41 1iy1 h LEU 352 Cb 0.94 -0.26 -0.03 0.00 0.37 0.00 0.00 40.66 41.69 1iy1 h LEU 352 CO 0.09 1.13 0.30 0.25 -0.34 0.00 0.00 178.44 179.87 1iy1 h LEU 353 N 0.78 0.70 -0.71 2.25 6.46 -1.14 -0.85 115.31 122.80 1iy1 h LEU 353 Ca 0.10 -0.05 -0.07 0.00 -0.12 0.00 0.00 57.88 57.73 1iy1 h LEU 353 Cb 0.81 -0.18 -0.03 0.00 -0.73 0.00 0.00 40.66 40.54 1iy1 h LEU 353 CO 0.07 0.58 0.15 0.00 -0.62 0.00 0.00 178.44 178.61 1iy1 h ALA 354 N 1.54 0.93 -0.16 1.25 0.00 -0.74 -3.05 119.26 119.03 1iy1 h ALA 354 Ca 0.20 -0.26 -0.13 0.00 0.00 0.00 0.00 54.91 54.73 1iy1 h ALA 354 Cb 0.04 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.55 1iy1 h ALA 354 CO -0.03 0.67 -0.44 0.87 0.00 0.00 0.00 179.25 180.32 1iy1 h LYS 355 N 1.07 0.40 -0.71 0.00 1.57 0.09 -3.28 116.57 115.71 1iy1 h LYS 355 Ca 0.22 -0.21 -0.21 0.00 -1.87 0.00 0.00 60.65 58.58 1iy1 h LYS 355 Cb 0.41 0.01 -0.13 0.00 0.08 0.00 0.00 32.23 32.59 1iy1 h LYS 355 CO 0.01 0.76 0.26 0.54 -0.57 0.00 0.00 179.45 180.45 1iy1 n ARG 356 N -4.00 3.57 -2.50 3.15 1.74 -0.53 -4.32 116.66 113.76 1iy1 n ARG 356 Ca -0.02 -3.09 -0.14 0.00 -0.77 0.00 0.00 57.85 53.84 1iy1 n ARG 356 Cb 0.52 -2.18 0.03 0.00 -1.02 0.00 0.00 32.46 29.80 1iy1 n ARG 356 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 1iy1 n THR 357 N -0.25 1.77 -1.88 0.55 -2.24 -1.16 -5.04 114.28 106.03 1iy1 n THR 357 Ca 0.40 -3.69 -0.41 0.00 -2.27 0.00 0.00 64.05 58.08 1iy1 n THR 357 Cb 1.36 -0.00 -0.01 0.00 -2.10 0.00 0.00 70.33 69.58 1iy1 n THR 357 CO 0.00 0.00 0.00 -2.16 -0.57 0.00 0.00 175.07 172.34 1iy1 s PRO 358 N -3.55 4.18 0.00 -0.78 0.04 -1.26 -1.99 135.00 131.64 1iy1 s PRO 358 Ca 0.38 2.47 0.00 0.00 0.04 0.00 0.00 61.00 63.88 1iy1 s PRO 358 Cb 0.39 -3.04 0.00 0.00 0.04 0.00 0.00 34.50 31.89 1iy1 s PRO 358 CO -0.03 -0.51 0.00 0.41 0.04 0.00 0.00 177.00 176.92 1iy1 n GLY 359 N 1.62 3.16 3.69 0.56 0.00 -1.26 -5.05 105.19 107.91 1iy1 n GLY 359 Ca 0.05 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.70 1iy1 n GLY 359 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1iy1 n PHE 360 N -0.71 1.48 -4.45 1.61 3.01 -0.84 -4.88 117.46 112.68 1iy1 n PHE 360 Ca 0.00 0.42 -0.22 0.00 1.01 0.00 0.00 57.45 58.66 1iy1 n PHE 360 Cb 0.00 -2.20 -0.10 0.00 -0.01 0.00 0.00 39.48 37.16 1iy1 n PHE 360 CO 0.00 0.00 0.00 0.14 1.01 0.00 0.00 176.76 177.91 1iy1 s VAL 361 N -1.52 1.69 0.18 -4.37 -7.23 -1.26 -4.39 120.40 103.50 1iy1 s VAL 361 Ca 0.80 -2.12 -0.02 0.00 -1.81 0.00 0.00 61.98 58.83 1iy1 s VAL 361 Cb -0.38 -2.52 0.27 0.00 0.56 0.00 0.00 36.38 34.31 1iy1 s VAL 361 CO 0.43 -0.25 0.95 0.61 -0.31 0.00 0.00 175.10 176.54 1iy1 n GLY 362 N -0.63 -0.93 0.13 2.32 0.00 0.17 -0.20 105.19 106.04 1iy1 n GLY 362 Ca -0.05 0.63 -0.12 0.00 0.00 0.00 0.00 46.02 46.48 1iy1 n GLY 362 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1iy1 h ALA 363 N 1.22 0.26 -0.83 4.61 0.00 -1.84 0.28 119.26 122.95 1iy1 h ALA 363 Ca 0.33 -0.21 0.11 0.00 0.00 0.00 0.00 54.91 55.14 1iy1 h ALA 363 Cb 0.60 -0.07 -0.08 0.00 0.00 0.00 0.00 17.79 18.24 1iy1 h ALA 363 CO -0.60 -0.01 0.46 -0.44 0.00 0.00 0.00 179.25 178.66 1iy1 h ASP 364 N 0.09 0.63 0.02 0.00 3.32 -0.98 0.15 116.42 119.65 1iy1 h ASP 364 Ca 0.05 0.06 -0.09 0.00 0.02 0.00 0.00 57.03 57.07 1iy1 h ASP 364 Cb 0.41 -0.05 0.01 0.00 0.22 0.00 0.00 39.33 39.92 1iy1 h ASP 364 CO 0.01 0.33 -0.37 -0.07 -1.72 0.00 0.00 179.24 177.43 1iy1 h LEU 365 N 0.74 0.29 -1.07 1.55 3.38 -1.34 -1.55 115.31 117.31 1iy1 h LEU 365 Ca 0.42 -0.82 0.08 0.00 0.09 0.00 0.00 57.88 57.65 1iy1 h LEU 365 Cb 0.45 -0.09 -0.07 0.00 0.09 0.00 0.00 40.66 41.05 1iy1 h LEU 365 CO -0.28 1.08 0.62 -0.33 0.09 0.00 0.00 178.44 179.62 1iy1 h GLU 366 N -0.46 1.03 0.11 1.13 5.08 -0.73 -1.90 114.58 118.84 1iy1 h GLU 366 Ca -0.05 -0.06 -0.01 0.00 -1.00 0.00 0.00 59.36 58.24 1iy1 h GLU 366 Cb 1.15 -0.23 0.00 0.00 0.50 0.00 0.00 28.75 30.17 1iy1 h GLU 366 CO 0.07 0.68 -0.05 -0.91 -1.00 0.00 0.00 179.01 177.80 1iy1 h ASN 367 N 1.06 -0.12 -0.70 1.42 4.21 -1.00 -2.81 115.58 117.63 1iy1 h ASN 367 Ca 0.44 -0.39 0.14 0.00 1.21 0.00 0.00 56.30 57.70 1iy1 h ASN 367 Cb 0.29 0.03 -0.13 0.00 -1.12 0.00 0.00 38.32 37.39 1iy1 h ASN 367 CO -0.19 0.36 -0.17 0.25 -1.29 0.00 0.00 177.43 176.39 1iy1 h LEU 368 N -0.64 -0.65 -0.72 1.61 6.46 -1.05 0.36 115.31 120.67 1iy1 h LEU 368 Ca -0.01 0.21 0.04 0.00 -0.12 0.00 0.00 57.88 58.00 1iy1 h LEU 368 Cb 0.50 0.44 -0.05 0.00 -0.73 0.00 0.00 40.66 40.82 1iy1 h LEU 368 CO 0.02 -0.23 0.44 -0.07 -0.62 0.00 0.00 178.44 177.98 1iy1 h LEU 369 N 0.00 0.70 0.10 2.25 3.38 -1.38 0.18 115.31 120.54 1iy1 h LEU 369 Ca 0.34 0.01 -0.01 0.00 0.09 0.00 0.00 57.88 58.31 1iy1 h LEU 369 Cb 0.52 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.13 1iy1 h LEU 369 CO -0.73 0.47 -0.05 -1.13 0.09 0.00 0.00 178.44 177.10 1iy1 h ASN 370 N 0.84 -0.12 -0.94 -0.43 -1.24 -0.22 -1.58 115.58 111.90 1iy1 h ASN 370 Ca 0.30 -0.23 0.06 0.00 0.71 0.00 0.00 56.30 57.14 1iy1 h ASN 370 Cb 0.08 0.03 -0.06 0.00 0.73 0.00 0.00 38.32 39.10 1iy1 h ASN 370 CO -0.13 0.17 0.61 -0.33 -1.29 0.00 0.00 177.43 176.46 1iy1 h GLU 371 N -0.42 1.06 0.00 6.67 4.39 -0.24 0.38 114.58 126.43 1iy1 h GLU 371 Ca -0.01 -0.06 -0.02 0.00 0.34 0.00 0.00 59.36 59.60 1iy1 h GLU 371 Cb 0.34 -0.24 -0.00 0.00 -0.10 0.00 0.00 28.75 28.75 1iy1 h GLU 371 CO 0.02 0.70 -0.11 0.00 -1.16 0.00 0.00 179.01 178.46 1iy1 h ALA 372 N 1.49 1.69 -0.04 3.43 0.00 -0.45 -1.80 119.26 123.57 1iy1 h ALA 372 Ca 0.40 -0.10 -0.18 0.00 0.00 0.00 0.00 54.91 55.03 1iy1 h ALA 372 Cb 0.16 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 1iy1 h ALA 372 CO -0.15 0.14 -0.74 0.00 0.00 0.00 0.00 179.25 178.50 1iy1 h ALA 373 N 1.89 0.66 -0.08 0.00 0.00 0.71 -3.09 119.26 119.34 1iy1 h ALA 373 Ca -0.00 -0.63 -0.15 0.00 0.00 0.00 0.00 54.91 54.13 1iy1 h ALA 373 Cb 0.22 -0.07 0.01 0.00 0.00 0.00 0.00 17.79 17.94 1iy1 h ALA 373 CO 0.01 0.80 -0.53 -0.07 0.00 0.00 0.00 179.25 179.47 1iy1 h LEU 374 N 0.18 0.61 -1.59 0.00 3.38 -0.35 -2.32 115.31 115.22 1iy1 h LEU 374 Ca -0.03 -0.66 0.04 0.00 0.09 0.00 0.00 57.88 57.32 1iy1 h LEU 374 Cb 1.31 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 41.85 1iy1 h LEU 374 CO 0.12 1.17 0.33 -0.07 0.09 0.00 0.00 178.44 180.08 1iy1 h LEU 375 N 0.08 0.46 0.61 1.67 3.38 -1.46 1.00 115.31 121.05 1iy1 h LEU 375 Ca -0.04 -0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.89 1iy1 h LEU 375 Cb 1.18 -0.10 0.01 0.00 0.09 0.00 0.00 40.66 41.83 1iy1 h LEU 375 CO 0.11 0.31 -0.29 0.00 0.09 0.00 0.00 178.44 178.66 1iy1 h ALA 376 N 1.72 -0.82 -0.57 1.53 0.00 -1.48 -2.08 119.26 117.56 1iy1 h ALA 376 Ca 0.20 -0.20 -0.09 0.00 0.00 0.00 0.00 54.91 54.82 1iy1 h ALA 376 Cb 0.15 0.32 -0.02 0.00 0.00 0.00 0.00 17.79 18.24 1iy1 h ALA 376 CO -0.05 -0.80 -0.01 0.00 0.00 0.00 0.00 179.25 178.38 1iy1 h ALA 377 N -0.99 0.91 0.00 0.00 0.00 -1.04 0.12 119.26 118.24 1iy1 h ALA 377 Ca -0.08 -0.31 -0.00 0.00 0.00 0.00 0.00 54.91 54.52 1iy1 h ALA 377 Cb 0.67 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 18.24 1iy1 h ALA 377 CO 0.14 0.65 -0.01 -0.09 0.00 0.00 0.00 179.25 179.93 1iy1 h ARG 378 N 0.91 0.00 -0.51 0.00 2.43 0.99 0.38 114.38 118.57 1iy1 h ARG 378 Ca 0.16 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.33 1iy1 h ARG 378 Cb 0.55 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.10 1iy1 h ARG 378 CO 0.03 0.01 0.00 0.39 -1.51 0.00 0.00 179.97 178.89 1iy1 n GLU 379 N -3.17 2.74 -0.26 0.20 1.02 -0.78 -4.95 120.64 115.43 1iy1 n GLU 379 Ca -0.02 -2.30 0.00 0.00 -0.02 0.00 0.00 57.16 54.82 1iy1 n GLU 379 Cb 0.15 -1.41 0.00 0.00 -0.02 0.00 0.00 31.44 30.17 1iy1 n GLU 379 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1iy1 n GLY 380 N 1.05 1.26 3.68 0.62 0.00 0.13 -4.97 105.19 106.95 1iy1 n GLY 380 Ca 0.17 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.81 1iy1 n GLY 380 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1iy1 n ARG 381 N -2.00 1.25 -0.30 1.61 1.74 0.31 -4.88 116.66 114.39 1iy1 n ARG 381 Ca 0.00 0.47 0.11 0.00 -0.77 0.00 0.00 57.85 57.65 1iy1 n ARG 381 Cb 0.00 -2.35 0.28 0.00 -1.02 0.00 0.00 32.46 29.37 1iy1 n ARG 381 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 1iy1 n ARG 382 N -1.03 2.46 -3.65 5.56 3.00 -1.26 -4.12 116.66 117.62 1iy1 n ARG 382 Ca 0.12 -2.26 -0.11 0.00 -0.01 0.00 0.00 57.85 55.60 1iy1 n ARG 382 Cb 0.46 -1.50 -0.08 0.00 0.00 0.00 0.00 32.46 31.34 1iy1 n ARG 382 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.63 177.78 1iy1 s LYS 383 N -1.21 0.72 -0.10 5.56 1.02 -1.26 -4.87 119.74 119.59 1iy1 s LYS 383 Ca 0.42 1.03 -0.30 0.00 0.02 0.00 0.00 55.97 57.14 1iy1 s LYS 383 Cb 0.22 0.26 -0.02 0.00 -0.52 0.00 0.00 37.83 37.76 1iy1 s LYS 383 CO 0.29 -0.12 1.20 0.42 -0.92 0.00 0.00 175.35 176.23 1iy1 s ILE 384 N 0.92 4.31 0.55 2.17 1.01 -0.03 -4.81 121.20 125.32 1iy1 s ILE 384 Ca -0.05 1.61 0.02 0.00 0.00 0.00 0.00 60.65 62.24 1iy1 s ILE 384 Cb -0.05 -4.04 0.04 0.00 0.01 0.00 0.00 42.46 38.42 1iy1 s ILE 384 CO -0.08 -0.05 0.76 0.42 0.00 0.00 0.00 174.94 175.99 1iy1 s THR 385 N 2.68 2.66 0.43 2.92 -4.23 -1.26 -0.78 115.64 118.06 1iy1 s THR 385 Ca 0.55 -0.71 0.12 0.00 -1.18 0.00 0.00 61.69 60.47 1iy1 s THR 385 Cb -0.23 -2.95 0.18 0.00 1.34 0.00 0.00 72.50 70.84 1iy1 s THR 385 CO 0.19 0.00 1.97 -0.03 -0.54 0.00 0.00 174.62 176.21 1iy1 h MET 386 N 0.11 0.10 0.66 3.99 4.05 -1.93 -2.83 114.93 119.08 1iy1 h MET 386 Ca -0.41 -0.02 -0.03 0.00 -0.28 0.00 0.00 59.70 58.96 1iy1 h MET 386 Cb 1.29 -0.02 -0.01 0.00 -0.80 0.00 0.00 31.60 32.07 1iy1 h MET 386 CO 0.50 0.25 -0.43 0.87 0.23 0.00 0.00 176.91 178.33 1iy1 h LYS 387 N 0.10 -1.00 -0.62 0.39 1.79 -1.95 0.21 116.57 115.49 1iy1 h LYS 387 Ca 0.02 0.07 0.12 0.00 -2.18 0.00 0.00 60.65 58.68 1iy1 h LYS 387 Cb 0.31 0.23 -0.12 0.00 -1.58 0.00 0.00 32.23 31.07 1iy1 h LYS 387 CO 0.02 -0.67 -0.25 -0.44 -1.08 0.00 0.00 179.45 177.03 1iy1 h ASP 388 N -1.04 -0.88 -0.30 0.86 3.32 -1.86 0.41 116.42 116.93 1iy1 h ASP 388 Ca -0.08 0.21 0.07 0.00 0.02 0.00 0.00 57.03 57.24 1iy1 h ASP 388 Cb 0.85 0.49 -0.07 0.00 0.22 0.00 0.00 39.33 40.82 1iy1 h ASP 388 CO 0.06 -0.26 -0.13 -0.07 -1.72 0.00 0.00 179.24 177.12 1iy1 h LEU 389 N -0.09 -0.44 -0.66 1.55 3.38 -1.26 0.60 115.31 118.40 1iy1 h LEU 389 Ca 0.27 0.11 -0.01 0.00 0.09 0.00 0.00 57.88 58.34 1iy1 h LEU 389 Cb 0.52 0.25 -0.03 0.00 0.09 0.00 0.00 40.66 41.49 1iy1 h LEU 389 CO -0.67 -0.16 0.36 -0.33 0.09 0.00 0.00 178.44 177.72 1iy1 h GLU 390 N -0.08 0.93 0.24 1.13 5.08 0.11 -2.96 114.58 119.04 1iy1 h GLU 390 Ca 0.16 -0.11 -0.01 0.00 -1.00 0.00 0.00 59.36 58.39 1iy1 h GLU 390 Cb 0.31 -0.18 0.00 0.00 0.50 0.00 0.00 28.75 29.39 1iy1 h GLU 390 CO -0.36 0.70 -0.12 0.93 -1.00 0.00 0.00 179.01 179.17 1iy1 h GLU 391 N 0.90 -0.31 -1.27 2.33 5.08 0.50 -3.12 114.58 118.70 1iy1 h GLU 391 Ca 0.23 0.02 0.41 0.00 -1.00 0.00 0.00 59.36 59.02 1iy1 h GLU 391 Cb 0.05 0.07 -0.13 0.00 0.50 0.00 0.00 28.75 29.25 1iy1 h GLU 391 CO -0.04 0.00 0.81 0.00 -1.00 0.00 0.00 179.01 178.79 1iy1 h ALA 392 N 0.01 2.63 -0.72 3.43 0.00 0.26 0.08 119.26 124.95 1iy1 h ALA 392 Ca -0.03 0.11 -0.05 0.00 0.00 0.00 0.00 54.91 54.94 1iy1 h ALA 392 Cb 0.46 0.18 -0.03 0.00 0.00 0.00 0.00 17.79 18.40 1iy1 h ALA 392 CO 0.05 -1.24 0.24 0.00 0.00 0.00 0.00 179.25 178.30 1iy1 h ALA 393 N 1.62 1.06 -0.02 0.00 0.00 -1.45 -3.47 119.26 117.00 1iy1 h ALA 393 Ca 0.79 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 55.49 1iy1 h ALA 393 Cb 2.40 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 19.91 1iy1 h ALA 393 CO -0.42 0.64 0.00 -1.13 0.00 0.00 0.00 179.25 178.35