#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2pmu h VAL 149 N 0.00 0.00 -3.07 3.44 3.04 -2.02 -3.28 116.25 114.37 2pmu h VAL 149 Ca 0.00 0.00 -0.61 0.00 -1.01 0.00 0.00 66.70 65.08 2pmu h VAL 149 Cb 0.00 0.00 -0.07 0.00 -2.01 0.00 0.00 31.29 29.21 2pmu h VAL 149 CO 0.00 0.00 -0.28 0.00 -1.01 0.00 0.00 177.57 176.28 2pmu s ARG 150 N -3.65 3.98 -0.06 4.17 1.70 -1.26 -3.03 118.95 120.80 2pmu s ARG 150 Ca -0.03 0.22 0.06 0.00 -0.47 0.00 0.00 55.73 55.51 2pmu s ARG 150 Cb 0.02 -3.30 -0.01 0.00 -0.57 0.00 0.00 34.95 31.09 2pmu s ARG 150 CO 0.15 0.52 -0.25 -1.17 -1.08 0.00 0.00 175.30 173.47 2pmu s LEU 151 N -0.43 2.08 0.02 -1.89 2.96 -0.24 -5.00 118.68 116.18 2pmu s LEU 151 Ca 0.20 -0.51 -0.06 0.00 -0.22 0.00 0.00 54.13 53.54 2pmu s LEU 151 Cb -0.15 -1.38 -0.00 0.00 0.50 0.00 0.00 46.19 45.16 2pmu s LEU 151 CO 0.08 0.25 0.11 -0.89 -1.32 0.00 0.00 176.35 174.58 2pmu s THR 152 N -0.17 0.10 -0.10 3.68 2.01 -1.26 -0.77 115.64 119.13 2pmu s THR 152 Ca -0.03 -0.83 -0.04 0.00 0.31 0.00 0.00 61.69 61.09 2pmu s THR 152 Cb -0.14 -0.56 0.05 0.00 0.01 0.00 0.00 72.50 71.86 2pmu s THR 152 CO 0.04 -0.46 0.22 0.12 -0.69 0.00 0.00 174.62 173.84 2pmu s PHE 153 N -1.77 -0.29 0.00 4.92 5.36 -0.85 -5.02 117.98 120.33 2pmu s PHE 153 Ca -0.12 0.72 0.00 0.00 -0.96 0.00 0.00 56.93 56.57 2pmu s PHE 153 Cb -0.06 -0.02 0.00 0.00 -0.34 0.00 0.00 43.02 42.60 2pmu s PHE 153 CO -0.01 -0.24 0.00 0.00 -1.46 0.00 0.00 175.22 173.52 2pmu n ALA 154 N 4.47 0.00 -1.17 11.12 0.00 -1.26 -0.35 120.51 133.31 2pmu n ALA 154 Ca -0.21 0.00 -0.05 0.00 0.00 0.00 0.00 53.44 53.18 2pmu n ALA 154 Cb 0.52 0.00 0.25 0.00 0.00 0.00 0.00 19.45 20.22 2pmu n ALA 154 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 2pmu n ASP 155 N 4.93 3.88 -4.80 0.00 5.75 -1.26 -4.91 116.55 120.13 2pmu n ASP 155 Ca 0.00 -3.38 -0.36 0.00 -0.01 0.00 0.00 54.79 51.04 2pmu n ASP 155 Cb 0.00 -0.69 -0.07 0.00 -1.03 0.00 0.00 41.12 39.33 2pmu n ASP 155 CO 0.00 0.00 0.00 -0.63 -0.11 0.00 0.00 177.20 176.46 2pmu s ILE 156 N -3.07 5.45 -0.03 2.12 1.01 0.52 -0.96 121.20 126.23 2pmu s ILE 156 Ca 0.50 0.22 0.02 0.00 0.00 0.00 0.00 60.65 61.39 2pmu s ILE 156 Cb 0.42 -3.45 0.01 0.00 0.01 0.00 0.00 42.46 39.45 2pmu s ILE 156 CO 0.09 0.52 -0.08 -1.61 0.00 0.00 0.00 174.94 173.86 2pmu s GLU 157 N -0.30 0.97 0.03 2.79 2.02 0.12 -2.01 118.70 122.33 2pmu s GLU 157 Ca 0.12 -0.25 0.06 0.00 0.02 0.00 0.00 54.97 54.92 2pmu s GLU 157 Cb -0.12 -0.91 -0.02 0.00 0.10 0.00 0.00 34.13 33.19 2pmu s GLU 157 CO 0.01 0.04 -0.17 -0.51 0.02 0.00 0.00 175.26 174.66 2pmu s LEU 158 N 0.46 2.13 -0.30 1.80 1.02 0.05 -0.28 118.68 123.58 2pmu s LEU 158 Ca -0.07 -0.43 0.02 0.00 0.02 0.00 0.00 54.13 53.66 2pmu s LEU 158 Cb -0.11 -0.77 0.07 0.00 0.02 0.00 0.00 46.19 45.39 2pmu s LEU 158 CO 0.01 0.11 -0.03 -0.62 0.02 0.00 0.00 176.35 175.84 2pmu s ASP 159 N -0.96 4.67 0.52 2.29 3.68 0.24 -1.08 116.67 126.03 2pmu s ASP 159 Ca 0.05 -1.58 0.25 0.00 2.13 0.00 0.00 52.55 53.40 2pmu s ASP 159 Cb -0.08 -1.62 1.45 0.00 -1.45 0.00 0.00 42.92 41.23 2pmu s ASP 159 CO 0.01 -0.27 2.10 -0.33 0.13 0.00 0.00 175.17 176.81 2pmu h GLU 160 N 7.80 0.00 0.24 4.34 5.08 -1.78 0.55 114.58 130.81 2pmu h GLU 160 Ca -0.16 0.00 -0.33 0.00 -1.00 0.00 0.00 59.36 57.87 2pmu h GLU 160 Cb 1.04 0.00 0.04 0.00 0.50 0.00 0.00 28.75 30.33 2pmu h GLU 160 CO 0.50 0.10 -1.46 1.49 -1.00 0.00 0.00 179.01 178.65 2pmu h GLU 161 N 0.00 0.55 -0.00 2.33 4.57 -1.94 -3.33 114.58 116.75 2pmu h GLU 161 Ca -0.00 -0.91 0.00 0.00 -1.18 0.00 0.00 59.36 57.27 2pmu h GLU 161 Cb 0.25 0.34 0.00 0.00 -0.16 0.00 0.00 28.75 29.18 2pmu h GLU 161 CO 0.01 1.43 -0.77 2.41 -1.18 0.00 0.00 179.01 180.92 2pmu n THR 162 N -3.72 0.00 -2.38 0.32 -1.04 -1.19 -4.95 114.28 101.32 2pmu n THR 162 Ca -0.16 -0.07 -0.16 0.00 -2.04 0.00 0.00 64.05 61.62 2pmu n THR 162 Cb 1.09 0.92 -0.01 0.00 -1.82 0.00 0.00 70.33 70.51 2pmu n THR 162 CO 0.00 0.00 0.00 1.41 -0.64 0.00 0.00 175.07 175.84 2pmu n HIS 163 N -1.11 -1.18 -2.82 -1.42 8.25 0.19 -4.98 115.22 112.15 2pmu n HIS 163 Ca 0.06 0.00 -0.36 0.00 -0.26 0.00 0.00 57.72 57.16 2pmu n HIS 163 Cb 0.36 -3.29 -0.07 0.00 1.12 0.00 0.00 29.99 28.11 2pmu n HIS 163 CO 0.00 0.00 0.00 -1.21 0.64 0.00 0.00 176.34 175.77 2pmu s GLU 164 N -4.96 4.44 0.01 -0.41 2.02 -1.02 -4.84 118.70 113.95 2pmu s GLU 164 Ca 0.00 1.22 0.02 0.00 0.02 0.00 0.00 54.97 56.22 2pmu s GLU 164 Cb 0.00 -2.60 -0.01 0.00 0.10 0.00 0.00 34.13 31.62 2pmu s GLU 164 CO 0.00 0.19 -0.06 0.08 0.02 0.00 0.00 175.26 175.49 2pmu s VAL 165 N -1.80 0.41 0.05 2.63 1.01 -1.26 0.79 120.40 122.23 2pmu s VAL 165 Ca 0.54 -0.47 0.04 0.00 0.00 0.00 0.00 61.98 62.08 2pmu s VAL 165 Cb -0.15 -0.40 -0.02 0.00 0.00 0.00 0.00 36.38 35.81 2pmu s VAL 165 CO 0.20 -0.05 -0.11 0.26 0.00 0.00 0.00 175.10 175.40 2pmu s TRP 166 N -0.51 0.92 -0.09 5.22 0.51 0.62 -0.95 118.94 124.66 2pmu s TRP 166 Ca -0.02 -0.42 -0.01 0.00 -2.12 0.00 0.00 56.10 53.53 2pmu s TRP 166 Cb -0.04 -0.54 0.03 0.00 -0.81 0.00 0.00 33.47 32.10 2pmu s TRP 166 CO -0.00 -0.01 -0.04 0.21 -0.51 0.00 0.00 176.95 176.60 2pmu s LYS 167 N -1.40 1.10 -1.47 4.98 2.47 -0.10 -0.70 119.74 124.62 2pmu s LYS 167 Ca -0.04 -0.10 -0.08 0.00 -1.56 0.00 0.00 55.97 54.19 2pmu s LYS 167 Cb -0.09 -1.28 0.02 0.00 -1.46 0.00 0.00 37.83 35.03 2pmu s LYS 167 CO 0.01 -0.26 0.86 0.00 0.16 0.00 0.00 175.35 176.12 2pmu n ALA 168 N 4.93 -1.14 -0.50 3.13 0.00 -0.13 -1.57 120.51 125.23 2pmu n ALA 168 Ca -0.11 0.31 0.00 0.00 0.00 0.00 0.00 53.44 53.64 2pmu n ALA 168 Cb 0.50 -4.53 0.00 0.00 0.00 0.00 0.00 19.45 15.42 2pmu n ALA 168 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2pmu n GLY 169 N -1.71 1.62 3.68 0.00 0.00 -1.26 -5.02 105.19 102.49 2pmu n GLY 169 Ca -0.04 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.63 2pmu n GLY 169 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2pmu s GLN 170 N -0.14 3.11 0.51 1.61 -1.52 -0.61 -5.03 119.66 117.59 2pmu s GLN 170 Ca 0.00 -0.40 -0.21 0.00 -1.95 0.00 0.00 55.36 52.80 2pmu s GLN 170 Cb 0.00 -2.85 -0.06 0.00 -0.22 0.00 0.00 33.01 29.88 2pmu s GLN 170 CO 0.00 0.65 1.18 -1.25 -0.25 0.00 0.00 175.29 175.62 2pmu s PRO 171 N -0.73 3.48 -0.03 2.91 0.04 -1.26 -0.93 135.00 138.48 2pmu s PRO 171 Ca 0.11 1.79 0.01 0.00 0.04 0.00 0.00 61.00 62.96 2pmu s PRO 171 Cb -0.12 -2.22 0.02 0.00 0.04 0.00 0.00 34.50 32.22 2pmu s PRO 171 CO 0.02 -0.79 -0.04 0.08 0.04 0.00 0.00 177.00 176.31 2pmu s VAL 172 N -1.58 0.48 -0.28 -0.36 1.01 -0.13 -4.87 120.40 114.68 2pmu s VAL 172 Ca 0.69 -0.13 -0.12 0.00 0.00 0.00 0.00 61.98 62.41 2pmu s VAL 172 Cb -0.29 -0.49 -0.05 0.00 0.00 0.00 0.00 36.38 35.55 2pmu s VAL 172 CO 0.34 0.20 0.25 -0.44 0.00 0.00 0.00 175.10 175.44 2pmu s SER 173 N 0.68 6.10 0.03 3.32 0.01 -1.26 -3.98 113.70 118.59 2pmu s SER 173 Ca -0.09 0.09 0.07 0.00 1.31 0.00 0.00 55.95 57.34 2pmu s SER 173 Cb -0.12 -2.15 -0.03 0.00 0.21 0.00 0.00 66.02 63.93 2pmu s SER 173 CO -0.00 -0.09 -0.20 -0.76 0.41 0.00 0.00 173.24 172.59 2pmu s LEU 174 N 1.86 2.48 0.92 2.44 1.43 -1.26 -5.08 118.68 121.47 2pmu s LEU 174 Ca 0.10 -0.44 -0.12 0.00 -1.03 0.00 0.00 54.13 52.64 2pmu s LEU 174 Cb -0.16 -1.46 0.14 0.00 0.03 0.00 0.00 46.19 44.75 2pmu s LEU 174 CO 0.11 0.27 1.09 -0.94 0.23 0.00 0.00 176.35 177.11 2pmu s SER 175 N -1.26 3.24 0.28 2.29 1.04 -1.26 -4.77 113.70 113.26 2pmu s SER 175 Ca 0.13 1.52 0.02 0.00 0.48 0.00 0.00 55.95 58.10 2pmu s SER 175 Cb -0.10 -2.19 0.60 0.00 0.10 0.00 0.00 66.02 64.43 2pmu s SER 175 CO 0.04 -2.79 1.80 -0.65 0.98 0.00 0.00 173.24 172.62 2pmu h PRO 176 N -1.65 0.81 -0.36 4.02 0.11 -1.99 0.47 132.00 133.40 2pmu h PRO 176 Ca -0.50 -0.05 -0.11 0.00 0.11 0.00 0.00 66.00 65.45 2pmu h PRO 176 Cb 1.29 -0.18 -0.01 0.00 0.11 0.00 0.00 31.00 32.21 2pmu h PRO 176 CO 0.54 0.54 -0.20 1.15 -0.21 0.00 0.00 178.00 179.82 2pmu h THR 177 N 0.84 1.29 -0.91 -1.15 2.02 -1.95 -0.58 112.91 112.46 2pmu h THR 177 Ca 0.51 -1.33 -0.01 0.00 0.77 0.00 0.00 66.41 66.35 2pmu h THR 177 Cb 0.65 1.37 -0.04 0.00 -1.74 0.00 0.00 68.15 68.38 2pmu h THR 177 CO -0.32 0.44 0.52 -0.33 0.37 0.00 0.00 175.52 176.20 2pmu h GLU 178 N 0.56 1.26 -0.15 6.66 5.08 -1.78 -0.05 114.58 126.17 2pmu h GLU 178 Ca 0.08 -0.13 -0.01 0.00 -1.00 0.00 0.00 59.36 58.29 2pmu h GLU 178 Cb 0.75 -0.25 -0.01 0.00 0.50 0.00 0.00 28.75 29.74 2pmu h GLU 178 CO 0.06 0.90 0.05 0.35 -1.00 0.00 0.00 179.01 179.37 2pmu h PHE 179 N 1.27 0.25 -0.58 4.33 3.04 -0.54 -0.51 116.94 124.20 2pmu h PHE 179 Ca 0.32 -0.03 0.05 0.00 3.98 0.00 0.00 57.97 62.30 2pmu h PHE 179 Cb -0.01 -0.07 -0.05 0.00 2.56 0.00 0.00 35.95 38.38 2pmu h PHE 179 CO 0.01 0.36 0.30 1.15 -2.02 0.00 0.00 178.31 178.11 2pmu h THR 180 N 0.07 0.95 -0.12 4.41 2.02 -0.84 0.55 112.91 119.94 2pmu h THR 180 Ca 0.05 -0.20 -0.00 0.00 0.77 0.00 0.00 66.41 67.03 2pmu h THR 180 Cb 0.23 0.33 -0.01 0.00 -1.74 0.00 0.00 68.15 66.96 2pmu h THR 180 CO -0.00 0.10 0.06 0.25 0.37 0.00 0.00 175.52 176.30 2pmu h LEU 181 N 0.57 0.16 -0.68 2.58 5.85 -0.85 -0.91 115.31 122.04 2pmu h LEU 181 Ca 0.26 -0.12 -0.01 0.00 0.84 0.00 0.00 57.88 58.85 2pmu h LEU 181 Cb 0.17 -0.04 -0.03 0.00 0.37 0.00 0.00 40.66 41.13 2pmu h LEU 181 CO -0.18 0.24 0.38 0.25 -0.34 0.00 0.00 178.44 178.78 2pmu h LEU 182 N 0.07 0.85 -0.43 2.25 5.85 -0.74 -1.60 115.31 121.56 2pmu h LEU 182 Ca 0.04 -0.09 0.03 0.00 0.84 0.00 0.00 57.88 58.70 2pmu h LEU 182 Cb 0.12 -0.22 -0.03 0.00 0.37 0.00 0.00 40.66 40.90 2pmu h LEU 182 CO -0.01 0.70 0.23 -0.09 -0.34 0.00 0.00 178.44 178.93 2pmu h ARG 183 N 0.93 0.45 -0.42 1.25 2.43 -0.72 0.95 114.38 119.25 2pmu h ARG 183 Ca 0.24 -0.03 0.04 0.00 -0.81 0.00 0.00 59.98 59.42 2pmu h ARG 183 Cb 0.03 -0.10 -0.04 0.00 -0.42 0.00 0.00 29.97 29.44 2pmu h ARG 183 CO -0.04 0.30 0.19 -0.92 -1.51 0.00 0.00 179.97 177.99 2pmu h TYR 184 N 0.47 0.34 -0.35 2.20 3.20 -0.79 0.09 116.97 122.14 2pmu h TYR 184 Ca 0.18 0.02 0.00 0.00 3.14 0.00 0.00 58.73 62.07 2pmu h TYR 184 Cb 0.06 -0.09 -0.02 0.00 1.54 0.00 0.00 36.73 38.22 2pmu h TYR 184 CO -0.09 0.16 0.23 0.74 -1.64 0.00 0.00 178.16 177.56 2pmu h PHE 185 N 0.38 0.43 -0.58 -3.82 0.04 -0.72 -2.71 116.94 109.96 2pmu h PHE 185 Ca 0.19 0.01 -0.07 0.00 2.80 0.00 0.00 57.97 60.89 2pmu h PHE 185 Cb 0.13 -0.15 -0.02 0.00 2.20 0.00 0.00 35.95 38.11 2pmu h PHE 185 CO -0.12 0.27 0.07 0.28 -0.60 0.00 0.00 178.31 178.22 2pmu h VAL 186 N 0.47 1.26 0.00 -0.55 2.07 -0.29 -0.78 116.25 118.43 2pmu h VAL 186 Ca 0.13 -1.02 -0.05 0.00 0.82 0.00 0.00 66.70 66.58 2pmu h VAL 186 Cb -0.05 0.78 -0.01 0.00 -1.52 0.00 0.00 31.29 30.49 2pmu h VAL 186 CO -0.03 0.37 -0.23 0.40 0.02 0.00 0.00 177.57 178.10 2pmu h ILE 187 N 0.87 0.69 -0.58 4.57 2.04 -1.02 -2.58 117.51 121.49 2pmu h ILE 187 Ca 0.17 -1.01 -0.30 0.00 1.00 0.00 0.00 64.86 64.73 2pmu h ILE 187 Cb 0.45 1.64 -0.18 0.00 -0.74 0.00 0.00 36.82 37.99 2pmu h ILE 187 CO 0.02 0.23 0.18 0.59 0.00 0.00 0.00 178.15 179.16 2pmu n ASN 188 N -3.57 2.97 -4.67 1.72 3.02 -0.85 -5.04 115.26 108.85 2pmu n ASN 188 Ca -0.01 -3.71 -0.46 0.00 -0.03 0.00 0.00 54.58 50.38 2pmu n ASN 188 Cb 0.37 -0.71 -0.04 0.00 -0.61 0.00 0.00 39.78 38.80 2pmu n ASN 188 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2pmu n ALA 189 N -1.10 1.22 -0.03 5.41 0.00 -0.36 -1.54 120.51 124.11 2pmu n ALA 189 Ca 0.43 0.44 0.00 0.00 0.00 0.00 0.00 53.44 54.30 2pmu n ALA 189 Cb 1.26 -2.32 0.00 0.00 0.00 0.00 0.00 19.45 18.39 2pmu n ALA 189 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2pmu n GLY 190 N 3.02 1.38 3.76 0.00 0.00 0.46 -5.02 105.19 108.78 2pmu n GLY 190 Ca 0.15 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.82 2pmu n GLY 190 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2pmu s THR 191 N -2.51 5.38 -0.14 2.61 2.01 -0.59 -4.97 115.64 117.44 2pmu s THR 191 Ca 0.00 0.32 -0.29 0.00 0.31 0.00 0.00 61.69 62.03 2pmu s THR 191 Cb 0.00 -3.52 -0.01 0.00 0.01 0.00 0.00 72.50 68.99 2pmu s THR 191 CO 0.00 0.46 1.08 -0.69 -0.69 0.00 0.00 174.62 174.78 2pmu s VAL 192 N 0.12 4.60 -0.22 3.82 1.01 -1.26 -4.53 120.40 123.94 2pmu s VAL 192 Ca 0.12 1.90 -0.01 0.00 0.00 0.00 0.00 61.98 63.98 2pmu s VAL 192 Cb -0.12 -4.22 0.01 0.00 0.00 0.00 0.00 36.38 32.05 2pmu s VAL 192 CO 0.01 -0.06 -0.10 -0.76 0.00 0.00 0.00 175.10 174.19 2pmu s LEU 193 N 2.55 2.75 0.83 3.92 1.43 0.90 -4.90 118.68 126.15 2pmu s LEU 193 Ca 0.49 -0.65 -0.11 0.00 -1.03 0.00 0.00 54.13 52.83 2pmu s LEU 193 Cb -0.19 -1.63 0.09 0.00 0.03 0.00 0.00 46.19 44.49 2pmu s LEU 193 CO 0.15 -0.05 1.09 -0.94 0.23 0.00 0.00 176.35 176.83 2pmu s SER 194 N 1.36 4.14 0.06 2.29 1.04 -1.22 -0.44 113.70 120.93 2pmu s SER 194 Ca 0.03 1.51 -0.22 0.00 0.48 0.00 0.00 55.95 57.75 2pmu s SER 194 Cb -0.15 -2.23 -0.13 0.00 0.10 0.00 0.00 66.02 63.61 2pmu s SER 194 CO -0.07 -2.22 1.54 0.11 0.98 0.00 0.00 173.24 173.58 2pmu h LYS 195 N -1.26 0.17 -0.65 4.02 1.57 -1.96 -1.81 116.57 116.65 2pmu h LYS 195 Ca -0.47 -0.04 0.07 0.00 -1.87 0.00 0.00 60.65 58.34 2pmu h LYS 195 Cb 1.26 -0.02 -0.04 0.00 0.08 0.00 0.00 32.23 33.51 2pmu h LYS 195 CO 0.56 0.35 0.43 -1.35 -0.57 0.00 0.00 179.45 178.86 2pmu h PRO 196 N -0.04 0.60 -0.48 3.15 0.11 -1.97 0.25 132.00 133.62 2pmu h PRO 196 Ca 0.03 -0.04 -0.08 0.00 0.11 0.00 0.00 66.00 66.03 2pmu h PRO 196 Cb 0.26 -0.14 -0.02 0.00 0.11 0.00 0.00 31.00 31.21 2pmu h PRO 196 CO 0.00 0.40 -0.00 -0.22 -0.21 0.00 0.00 178.00 177.97 2pmu h LYS 197 N 0.62 0.84 -0.19 1.05 3.64 -1.88 -1.03 116.57 119.63 2pmu h LYS 197 Ca 0.28 -0.27 -0.05 0.00 -1.27 0.00 0.00 60.65 59.34 2pmu h LYS 197 Cb 0.31 -0.08 -0.00 0.00 -0.41 0.00 0.00 32.23 32.05 2pmu h LYS 197 CO -0.09 0.89 -0.10 0.82 -2.27 0.00 0.00 179.45 178.70 2pmu h ILE 198 N 0.70 1.31 -0.71 2.00 2.04 -0.51 -2.87 117.51 119.47 2pmu h ILE 198 Ca 0.13 -1.16 0.13 0.00 1.00 0.00 0.00 64.86 64.97 2pmu h ILE 198 Cb 0.51 1.67 -0.09 0.00 -0.74 0.00 0.00 36.82 38.17 2pmu h ILE 198 CO 0.02 0.35 0.25 0.25 0.00 0.00 0.00 178.15 179.02 2pmu h LEU 199 N 0.08 0.19 -1.14 1.44 5.85 -0.48 -1.35 115.31 119.91 2pmu h LEU 199 Ca 0.04 0.11 -0.01 0.00 0.84 0.00 0.00 57.88 58.86 2pmu h LEU 199 Cb 0.59 0.11 -0.03 0.00 0.37 0.00 0.00 40.66 41.69 2pmu h LEU 199 CO 0.03 0.07 0.38 0.44 -0.34 0.00 0.00 178.44 179.02 2pmu h ASP 200 N 0.39 0.87 0.26 1.25 3.32 -1.03 -2.66 116.42 118.81 2pmu h ASP 200 Ca 0.39 -0.07 -0.21 0.00 0.02 0.00 0.00 57.03 57.15 2pmu h ASP 200 Cb 0.58 -0.22 -0.04 0.00 0.22 0.00 0.00 39.33 39.87 2pmu h ASP 200 CO -0.41 0.71 -1.94 1.41 -1.72 0.00 0.00 179.24 177.29 2pmu n HIS 201 N -4.36 0.37 -0.09 4.55 8.25 -0.98 -4.44 115.22 118.52 2pmu n HIS 201 Ca 0.07 0.13 -0.09 0.00 -0.26 0.00 0.00 57.72 57.57 2pmu n HIS 201 Cb 0.10 -0.92 -0.16 0.00 1.12 0.00 0.00 29.99 30.13 2pmu n HIS 201 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 2pmu n VAL 202 N -2.69 1.29 0.00 1.59 0.31 -0.55 -5.06 118.33 113.22 2pmu n VAL 202 Ca -0.18 -0.83 0.00 0.00 -0.01 0.00 0.00 64.34 63.33 2pmu n VAL 202 Cb 0.91 -0.44 0.00 0.00 -0.91 0.00 0.00 33.84 33.40 2pmu n VAL 202 CO 0.00 0.00 0.00 0.79 -1.32 0.00 0.00 176.83 176.30 2pmu n TRP 203 N -2.71 0.00 -0.12 3.52 8.01 -1.00 -4.94 117.44 120.19 2pmu n TRP 203 Ca -0.31 0.00 -0.18 0.00 -1.31 0.00 0.00 57.50 55.70 2pmu n TRP 203 Cb 1.12 0.00 -0.12 0.00 -2.01 0.00 0.00 31.31 30.29 2pmu n TRP 203 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 177.69 176.96 2pmu n VAL 211 N 0.00 1.51 0.05 -0.99 0.31 -1.26 -5.00 118.33 112.94 2pmu n VAL 211 Ca 0.00 -0.59 -0.01 0.00 -0.01 0.00 0.00 64.34 63.73 2pmu n VAL 211 Cb 0.00 -1.39 0.28 0.00 -0.91 0.00 0.00 33.84 31.82 2pmu n VAL 211 CO 0.00 0.00 0.00 0.78 -1.32 0.00 0.00 176.83 176.29 2pmu h ASN 212 N 0.01 0.38 -0.51 4.52 -0.26 -2.00 -1.90 115.58 115.81 2pmu h ASN 212 Ca -0.57 -0.10 -0.04 0.00 -0.56 0.00 0.00 56.30 55.04 2pmu h ASN 212 Cb 1.93 -0.10 -0.03 0.00 -1.06 0.00 0.00 38.32 39.06 2pmu h ASN 212 CO -0.07 0.58 0.20 1.62 -1.06 0.00 0.00 177.43 178.70 2pmu h VAL 213 N 0.36 1.21 -0.23 2.81 3.04 -2.03 -0.72 116.25 120.69 2pmu h VAL 213 Ca 0.06 -0.68 -0.01 0.00 -1.01 0.00 0.00 66.70 65.07 2pmu h VAL 213 Cb 0.52 0.57 -0.01 0.00 -2.01 0.00 0.00 31.29 30.35 2pmu h VAL 213 CO 0.03 0.26 0.11 0.58 -1.01 0.00 0.00 177.57 177.54 2pmu h VAL 214 N 0.80 1.15 -0.84 1.51 2.07 -1.75 -0.72 116.25 118.47 2pmu h VAL 214 Ca 0.19 -0.43 0.00 0.00 0.82 0.00 0.00 66.70 67.28 2pmu h VAL 214 Cb 0.19 1.00 -0.04 0.00 -1.52 0.00 0.00 31.29 30.92 2pmu h VAL 214 CO -0.01 0.15 0.53 -0.33 0.02 0.00 0.00 177.57 177.92 2pmu h GLU 215 N 0.24 1.13 0.01 1.57 5.08 -1.15 0.72 114.58 122.18 2pmu h GLU 215 Ca 0.08 -0.09 -0.00 0.00 -1.00 0.00 0.00 59.36 58.35 2pmu h GLU 215 Cb 0.13 -0.24 0.00 0.00 0.50 0.00 0.00 28.75 29.14 2pmu h GLU 215 CO -0.01 0.77 -0.00 0.77 -1.00 0.00 0.00 179.01 179.54 2pmu h SER 216 N 1.15 -0.01 0.56 1.42 0.02 -0.82 -1.91 113.55 113.96 2pmu h SER 216 Ca 0.31 -0.09 -0.14 0.00 -0.84 0.00 0.00 61.79 61.02 2pmu h SER 216 Cb -0.08 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 62.44 2pmu h SER 216 CO -0.06 0.08 -0.65 1.88 -1.14 0.00 0.00 176.83 176.94 2pmu h TYR 217 N -0.10 0.10 -0.84 3.45 -1.99 -0.89 -0.24 116.97 116.46 2pmu h TYR 217 Ca -0.00 -0.04 -0.00 0.00 2.00 0.00 0.00 58.73 60.68 2pmu h TYR 217 Cb 0.10 -0.02 -0.04 0.00 2.00 0.00 0.00 36.73 38.77 2pmu h TYR 217 CO -0.05 0.70 0.52 0.28 -0.00 0.00 0.00 178.16 179.61 2pmu h VAL 218 N 0.06 1.23 -0.18 -2.88 2.07 -0.79 -0.25 116.25 115.51 2pmu h VAL 218 Ca -0.01 -0.48 -0.01 0.00 0.82 0.00 0.00 66.70 67.01 2pmu h VAL 218 Cb 1.16 0.04 -0.01 0.00 -1.52 0.00 0.00 31.29 30.96 2pmu h VAL 218 CO 0.09 0.24 0.06 -1.28 0.02 0.00 0.00 177.57 176.69 2pmu h SER 219 N 1.15 0.26 -0.51 0.57 0.87 -0.92 0.72 113.55 115.69 2pmu h SER 219 Ca 0.30 -0.20 0.02 0.00 -1.23 0.00 0.00 61.79 60.69 2pmu h SER 219 Cb -0.07 -0.07 -0.03 0.00 -0.44 0.00 0.00 62.40 61.79 2pmu h SER 219 CO -0.06 0.39 0.31 1.88 -0.53 0.00 0.00 176.83 178.81 2pmu h TYR 220 N 0.12 0.57 -0.35 2.24 0.05 -0.78 -1.89 116.97 116.93 2pmu h TYR 220 Ca 0.06 0.02 -0.02 0.00 0.05 0.00 0.00 58.73 58.84 2pmu h TYR 220 Cb 0.22 -0.19 -0.02 0.00 1.01 0.00 0.00 36.73 37.76 2pmu h TYR 220 CO -0.00 0.33 0.14 1.25 -1.05 0.00 0.00 178.16 178.83 2pmu h LEU 221 N 0.61 0.48 -0.82 3.88 5.85 -0.89 -2.71 115.31 121.72 2pmu h LEU 221 Ca 0.20 -0.17 0.09 0.00 0.84 0.00 0.00 57.88 58.85 2pmu h LEU 221 Cb 0.01 -0.12 -0.07 0.00 0.37 0.00 0.00 40.66 40.85 2pmu h LEU 221 CO -0.09 0.52 0.46 0.03 -0.34 0.00 0.00 178.44 179.03 2pmu h ARG 222 N 0.41 0.76 0.00 1.25 3.08 -0.69 -0.40 114.38 118.79 2pmu h ARG 222 Ca 0.12 -0.05 -0.04 0.00 0.07 0.00 0.00 59.98 60.08 2pmu h ARG 222 Cb 0.19 -0.17 -0.01 0.00 0.08 0.00 0.00 29.97 30.06 2pmu h ARG 222 CO -0.01 0.50 -0.18 0.00 -1.07 0.00 0.00 179.97 179.21 2pmu h ARG 223 N 0.78 0.00 0.00 0.04 3.08 -1.06 0.13 114.38 117.35 2pmu h ARG 223 Ca 0.39 0.00 -0.26 0.00 0.07 0.00 0.00 59.98 60.18 2pmu h ARG 223 Cb 0.36 0.00 -0.05 0.00 0.08 0.00 0.00 29.97 30.36 2pmu h ARG 223 CO -0.25 0.18 -1.75 1.63 -1.07 0.00 0.00 179.97 178.72 2pmu n LYS 224 N -4.30 0.64 0.00 0.04 5.02 -0.82 -4.62 118.16 114.11 2pmu n LYS 224 Ca -0.02 0.22 0.00 0.00 -2.02 0.00 0.00 58.31 56.48 2pmu n LYS 224 Cb 0.25 -1.75 0.00 0.00 -0.02 0.00 0.00 35.03 33.51 2pmu n LYS 224 CO 0.00 0.00 0.00 1.51 -0.52 0.00 0.00 177.40 178.39 2pmu n ILE 225 N -2.94 0.00 -3.18 -0.18 3.06 -0.22 -4.93 119.36 110.97 2pmu n ILE 225 Ca -0.17 -0.41 -0.20 0.00 -2.50 0.00 0.00 62.75 59.46 2pmu n ILE 225 Cb 1.00 1.02 -0.04 0.00 0.54 0.00 0.00 39.64 42.15 2pmu n ILE 225 CO 0.00 0.00 0.00 -0.67 -2.50 0.00 0.00 176.55 173.38 2pmu n ASP 226 N -0.75 0.97 0.00 9.51 2.03 0.45 -4.87 116.55 123.88 2pmu n ASP 226 Ca 0.00 -2.98 0.00 0.00 0.52 0.00 0.00 54.79 52.33 2pmu n ASP 226 Cb 0.00 -0.62 0.00 0.00 -0.72 0.00 0.00 41.12 39.78 2pmu n ASP 226 CO 0.00 0.00 0.00 0.35 -1.92 0.00 0.00 177.20 175.63 2pmu n THR 227 N 0.55 0.44 -0.87 5.18 -2.24 -1.26 -4.80 114.28 111.27 2pmu n THR 227 Ca 0.24 -0.59 -0.15 0.00 -2.27 0.00 0.00 64.05 61.29 2pmu n THR 227 Cb 0.60 0.89 0.12 0.00 -2.10 0.00 0.00 70.33 69.84 2pmu n THR 227 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2pmu n GLY 228 N -0.22 -2.42 0.19 3.38 0.00 -1.26 -4.99 105.19 99.87 2pmu n GLY 228 Ca 0.00 -1.50 -0.08 0.00 0.00 0.00 0.00 46.02 44.43 2pmu n GLY 228 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2pmu h GLU 229 N 0.00 0.60 -4.88 1.61 4.81 -2.03 -3.40 114.58 111.29 2pmu h GLU 229 Ca -0.21 -0.08 -0.65 0.00 -0.13 0.00 0.00 59.36 58.30 2pmu h GLU 229 Cb 0.62 -0.11 -0.19 0.00 0.63 0.00 0.00 28.75 29.70 2pmu h GLU 229 CO 0.14 0.50 -0.54 0.15 -0.73 0.00 0.00 179.01 178.53 2pmu s LYS 230 N -5.78 3.79 -0.09 1.92 -0.14 -1.26 -5.08 119.74 113.10 2pmu s LYS 230 Ca -0.13 -0.42 -0.12 0.00 -1.36 0.00 0.00 55.97 53.94 2pmu s LYS 230 Cb 0.11 -3.61 -0.05 0.00 -1.68 0.00 0.00 37.83 32.60 2pmu s LYS 230 CO 0.74 -0.23 0.30 1.03 -0.76 0.00 0.00 175.35 176.43 2pmu s ARG 231 N 1.72 3.93 -0.03 1.68 1.81 -1.26 -4.92 118.95 121.87 2pmu s ARG 231 Ca 0.07 0.15 0.15 0.00 -1.72 0.00 0.00 55.73 54.38 2pmu s ARG 231 Cb -0.16 -3.29 -0.23 0.00 -0.45 0.00 0.00 34.95 30.81 2pmu s ARG 231 CO 0.09 0.53 0.31 1.28 -0.68 0.00 0.00 175.30 176.84 2pmu n LEU 232 N 2.55 0.00 -4.34 2.53 4.77 -1.26 -4.18 117.00 117.07 2pmu n LEU 232 Ca -0.15 0.00 -0.38 0.00 -0.03 0.00 0.00 56.01 55.45 2pmu n LEU 232 Cb 0.53 0.04 -0.12 0.00 -2.33 0.00 0.00 43.42 41.53 2pmu n LEU 232 CO 0.37 0.04 -0.24 -0.22 -1.33 0.00 0.00 177.39 176.01 2pmu s LEU 233 N -4.17 4.20 0.14 2.23 0.20 -1.26 -0.77 118.68 119.24 2pmu s LEU 233 Ca -0.06 -0.88 0.09 0.00 0.69 0.00 0.00 54.13 53.98 2pmu s LEU 233 Cb 0.09 -1.92 -0.04 0.00 -0.43 0.00 0.00 46.19 43.89 2pmu s LEU 233 CO 0.64 -0.27 -0.16 -1.00 -0.29 0.00 0.00 176.35 175.26 2pmu s HIS 234 N 1.49 2.54 -0.12 5.38 3.76 0.22 -4.97 115.29 123.60 2pmu s HIS 234 Ca 0.01 -0.26 -0.03 0.00 -0.15 0.00 0.00 55.06 54.63 2pmu s HIS 234 Cb -0.18 -1.31 -0.03 0.00 1.11 0.00 0.00 32.58 32.16 2pmu s HIS 234 CO 0.04 0.43 0.00 0.99 -0.85 0.00 0.00 174.74 175.35 2pmu s THR 235 N -1.34 4.31 -0.22 1.30 2.01 -1.26 -1.63 115.64 118.81 2pmu s THR 235 Ca 0.20 -0.23 -0.01 0.00 0.31 0.00 0.00 61.69 61.96 2pmu s THR 235 Cb -0.10 -2.86 0.06 0.00 0.01 0.00 0.00 72.50 69.62 2pmu s THR 235 CO 0.11 0.55 -0.00 -1.48 -0.69 0.00 0.00 174.62 173.11 2pmu s LEU 236 N -0.33 1.90 0.41 4.42 0.05 -0.83 -5.02 118.68 119.29 2pmu s LEU 236 Ca 0.07 -1.03 -0.25 0.00 0.05 0.00 0.00 54.13 52.97 2pmu s LEU 236 Cb -0.12 -0.89 -0.10 0.00 -2.05 0.00 0.00 46.19 43.03 2pmu s LEU 236 CO 0.02 -0.28 1.19 0.54 -0.55 0.00 0.00 176.35 177.27 2pmu n ARG 237 N 4.86 1.75 -0.74 1.48 1.74 -1.26 -1.60 116.66 122.88 2pmu n ARG 237 Ca -0.10 0.62 0.00 0.00 -0.77 0.00 0.00 57.85 57.60 2pmu n ARG 237 Cb 0.45 -2.26 0.00 0.00 -1.02 0.00 0.00 32.46 29.63 2pmu n ARG 237 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2pmu n GLY 238 N 0.93 0.64 0.00 -0.13 0.00 -1.26 -4.66 105.19 100.71 2pmu n GLY 238 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.09 2pmu n GLY 238 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2pmu n VAL 239 N -2.00 0.00 0.00 1.61 0.31 -1.04 -5.12 118.33 112.09 2pmu n VAL 239 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 2pmu n VAL 239 Cb 0.00 -0.48 0.00 0.00 -0.91 0.00 0.00 33.84 32.45 2pmu n VAL 239 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2pmu n GLY 240 N 3.18 0.42 3.28 2.92 0.00 -0.63 -3.40 105.19 110.97 2pmu n GLY 240 Ca 0.00 -1.34 -0.20 0.00 0.00 0.00 0.00 46.02 44.49 2pmu n GLY 240 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2pmu s TYR 241 N -2.88 1.58 -0.11 1.61 2.02 0.41 -1.96 117.35 118.02 2pmu s TYR 241 Ca 0.00 -0.52 -0.07 0.00 -0.37 0.00 0.00 57.07 56.11 2pmu s TYR 241 Cb 0.00 -0.81 0.04 0.00 -0.40 0.00 0.00 41.96 40.79 2pmu s TYR 241 CO 0.00 0.22 0.27 0.54 -1.57 0.00 0.00 175.55 175.00 2pmu s VAL 242 N -2.07 -0.02 -0.35 0.71 0.11 -0.65 -0.07 120.40 118.06 2pmu s VAL 242 Ca 0.11 0.07 -0.19 0.00 -2.93 0.00 0.00 61.98 59.05 2pmu s VAL 242 Cb -0.05 -0.39 -0.00 0.00 -1.53 0.00 0.00 36.38 34.40 2pmu s VAL 242 CO 0.04 0.03 0.54 -0.22 -3.33 0.00 0.00 175.10 172.16 2pmu s LEU 243 N 0.74 4.32 0.01 2.54 2.96 -1.26 -0.61 118.68 127.39 2pmu s LEU 243 Ca -0.05 0.02 -0.28 0.00 -0.22 0.00 0.00 54.13 53.60 2pmu s LEU 243 Cb -0.06 -2.62 0.09 0.00 0.50 0.00 0.00 46.19 44.09 2pmu s LEU 243 CO -0.05 -0.50 0.76 0.00 -1.32 0.00 0.00 176.35 175.25 2pmu s ARG 244 N 2.45 0.99 0.40 1.98 1.70 0.05 -0.40 118.95 126.11 2pmu s ARG 244 Ca 0.20 -0.15 -0.23 0.00 -0.47 0.00 0.00 55.73 55.08 2pmu s ARG 244 Cb -0.15 0.46 -0.10 0.00 -0.57 0.00 0.00 34.95 34.59 2pmu s ARG 244 CO 0.13 -0.39 0.97 -2.00 -1.08 0.00 0.00 175.30 172.94 2pmu s GLU 245 N -2.53 4.28 0.00 3.89 2.12 -1.26 -4.35 118.70 120.85 2pmu s GLU 245 Ca -0.01 1.28 0.04 0.00 0.36 0.00 0.00 54.97 56.63 2pmu s GLU 245 Cb -0.01 -2.42 0.24 0.00 0.26 0.00 0.00 34.13 32.21 2pmu s GLU 245 CO -0.04 0.00 0.72 -2.30 -0.54 0.00 0.00 175.26 173.10