#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1a1a h SER 145 N 0.00 -0.25 -1.00 -1.12 4.64 -2.06 -0.71 113.55 113.05 1a1a h SER 145 Ca 0.00 0.18 0.22 0.00 -0.47 0.00 0.00 61.79 61.72 1a1a h SER 145 Cb 0.00 0.31 -0.11 0.00 -0.31 0.00 0.00 62.40 62.29 1a1a h SER 145 CO 0.00 -0.15 0.61 -0.29 -0.87 0.00 0.00 176.83 176.13 1a1a h ILE 146 N 0.14 0.63 -0.73 0.95 2.10 -2.03 -0.09 117.51 118.47 1a1a h ILE 146 Ca 0.42 -0.22 0.16 0.00 1.08 0.00 0.00 64.86 66.30 1a1a h ILE 146 Cb 0.74 -0.08 -0.05 0.00 -1.09 0.00 0.00 36.82 36.35 1a1a h ILE 146 CO -0.63 0.12 0.50 1.56 -1.08 0.00 0.00 178.15 178.62 1a1a h GLN 147 N 0.65 0.32 -0.53 2.19 1.08 -1.52 -2.15 115.11 115.15 1a1a h GLN 147 Ca 0.60 -0.02 0.00 0.00 -1.45 0.00 0.00 58.65 57.78 1a1a h GLN 147 Cb 1.09 -0.07 0.00 0.00 -0.05 0.00 0.00 27.48 28.45 1a1a h GLN 147 CO -0.40 0.21 0.00 0.00 -0.95 0.00 0.00 178.83 177.69 1a1a n ALA 148 N -2.55 2.39 -1.85 3.87 0.00 -0.05 -4.94 120.51 117.38 1a1a n ALA 148 Ca 0.14 -1.13 -0.41 0.00 0.00 0.00 0.00 53.44 52.04 1a1a n ALA 148 Cb 0.57 -0.86 -0.02 0.00 0.00 0.00 0.00 19.45 19.14 1a1a n ALA 148 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 1a1a s GLU 149 N -1.25 4.34 0.55 0.00 0.41 -0.81 -4.90 118.70 117.05 1a1a s GLU 149 Ca 0.42 2.20 0.23 0.00 -0.41 0.00 0.00 54.97 57.41 1a1a s GLU 149 Cb 0.23 -3.11 1.53 0.00 -1.78 0.00 0.00 34.13 31.00 1a1a s GLU 149 CO 0.31 -0.26 2.18 1.05 -0.49 0.00 0.00 175.26 178.05 1a1a h GLU 150 N 4.27 0.00 -0.01 1.61 4.11 -1.92 -0.96 114.58 121.68 1a1a h GLU 150 Ca -0.47 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.96 1a1a h GLU 150 Cb 1.22 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.47 1a1a h GLU 150 CO 0.71 0.00 -0.42 -2.67 0.07 0.00 0.00 179.01 176.71 1a1a n TRP 151 N -4.20 0.00 -3.42 2.06 4.27 -1.26 -4.81 117.44 110.08 1a1a n TRP 151 Ca -0.02 0.00 -0.37 0.00 -3.89 0.00 0.00 57.50 53.22 1a1a n TRP 151 Cb 0.13 -0.08 -0.06 0.00 -1.36 0.00 0.00 31.31 29.94 1a1a n TRP 151 CO 0.00 0.00 0.00 -0.47 -2.29 0.00 0.00 177.69 174.93 1a1a s TYR 152 N -2.58 3.52 -0.18 -2.67 5.04 -0.36 -1.26 117.35 118.86 1a1a s TYR 152 Ca 0.20 0.79 0.14 0.00 -2.44 0.00 0.00 57.07 55.76 1a1a s TYR 152 Cb 0.18 -2.44 0.37 0.00 0.35 0.00 0.00 41.96 40.42 1a1a s TYR 152 CO 0.58 0.25 1.20 1.19 -1.34 0.00 0.00 175.55 177.43 1a1a n PHE 153 N 3.42 0.03 0.00 4.97 3.01 0.62 -4.78 117.46 124.73 1a1a n PHE 153 Ca -0.10 -1.30 0.00 0.00 1.01 0.00 0.00 57.45 57.06 1a1a n PHE 153 Cb 0.52 -0.22 0.00 0.00 -0.01 0.00 0.00 39.48 39.77 1a1a n PHE 153 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1a1a n GLY 154 N -1.24 3.45 1.90 1.37 0.00 -1.26 -2.03 105.19 107.38 1a1a n GLY 154 Ca 0.18 -0.02 -0.17 0.00 0.00 0.00 0.00 46.02 46.01 1a1a n GLY 154 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1a1a n LYS 155 N 14.00 1.93 -2.25 1.61 5.02 -1.26 -0.68 118.16 136.52 1a1a n LYS 155 Ca 0.00 -2.21 -0.36 0.00 -2.02 0.00 0.00 58.31 53.72 1a1a n LYS 155 Cb 0.00 -1.87 -0.00 0.00 -0.02 0.00 0.00 35.03 33.14 1a1a n LYS 155 CO 0.00 0.00 0.00 0.96 -0.52 0.00 0.00 177.40 177.84 1a1a s ILE 156 N -2.42 3.13 0.82 -0.18 -4.36 -0.86 -4.98 121.20 112.34 1a1a s ILE 156 Ca 0.42 0.75 -0.11 0.00 -0.26 0.00 0.00 60.65 61.45 1a1a s ILE 156 Cb 0.35 -3.33 0.08 0.00 1.25 0.00 0.00 42.46 40.82 1a1a s ILE 156 CO 0.08 -0.11 1.09 0.42 0.24 0.00 0.00 174.94 176.66 1a1a s THR 157 N -1.69 3.09 0.38 8.37 -4.23 -1.26 -4.79 115.64 115.50 1a1a s THR 157 Ca 0.70 0.35 0.05 0.00 -1.18 0.00 0.00 61.69 61.62 1a1a s THR 157 Cb -0.26 -2.90 0.23 0.00 1.34 0.00 0.00 72.50 70.91 1a1a s THR 157 CO 0.30 -0.46 1.99 0.08 -0.54 0.00 0.00 174.62 175.99 1a1a h ARG 158 N -1.25 0.59 -0.41 3.99 0.11 -1.94 -0.71 114.38 114.75 1a1a h ARG 158 Ca -0.46 -0.06 -0.09 0.00 0.10 0.00 0.00 59.98 59.46 1a1a h ARG 158 Cb 1.26 -0.12 -0.01 0.00 1.11 0.00 0.00 29.97 32.20 1a1a h ARG 158 CO 0.54 0.46 -0.11 -0.09 0.10 0.00 0.00 179.97 180.87 1a1a h ARG 159 N 0.60 0.81 -0.66 0.08 2.43 -1.99 -1.88 114.38 113.77 1a1a h ARG 159 Ca 0.15 -0.31 -0.05 0.00 -0.81 0.00 0.00 59.98 58.96 1a1a h ARG 159 Cb 0.06 -0.04 -0.03 0.00 -0.42 0.00 0.00 29.97 29.53 1a1a h ARG 159 CO -0.02 0.94 0.21 1.49 -1.51 0.00 0.00 179.97 181.07 1a1a h GLU 160 N 0.63 1.02 -0.42 0.20 4.57 -1.80 -0.48 114.58 118.29 1a1a h GLU 160 Ca 0.10 -0.22 -0.04 0.00 -1.18 0.00 0.00 59.36 58.03 1a1a h GLU 160 Cb 0.64 -0.15 -0.02 0.00 -0.16 0.00 0.00 28.75 29.06 1a1a h GLU 160 CO 0.04 0.89 0.10 0.66 -1.18 0.00 0.00 179.01 179.53 1a1a h SER 161 N 0.95 0.58 -0.08 1.04 4.64 -0.97 -0.43 113.55 119.28 1a1a h SER 161 Ca 0.21 -0.09 -0.15 0.00 -0.47 0.00 0.00 61.79 61.29 1a1a h SER 161 Cb 0.30 -0.15 -0.01 0.00 -0.31 0.00 0.00 62.40 62.23 1a1a h SER 161 CO -0.01 0.58 -0.47 -0.33 -0.87 0.00 0.00 176.83 175.73 1a1a h GLU 162 N 0.61 0.64 -0.30 4.77 5.08 -1.05 0.13 114.58 124.47 1a1a h GLU 162 Ca 0.14 -0.36 0.04 0.00 -1.00 0.00 0.00 59.36 58.18 1a1a h GLU 162 Cb 0.23 0.02 -0.04 0.00 0.50 0.00 0.00 28.75 29.47 1a1a h GLU 162 CO -0.00 0.97 0.06 -0.09 -1.00 0.00 0.00 179.01 178.95 1a1a h ARG 163 N 0.51 0.17 -0.38 2.33 2.43 0.41 0.29 114.38 120.13 1a1a h ARG 163 Ca 0.03 -0.01 -0.15 0.00 -0.81 0.00 0.00 59.98 59.04 1a1a h ARG 163 Cb 1.01 -0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 30.51 1a1a h ARG 163 CO 0.09 0.11 -0.36 -0.07 -1.51 0.00 0.00 179.97 178.24 1a1a h LEU 164 N 0.17 0.95 0.00 3.80 3.38 -0.92 -3.32 115.31 119.37 1a1a h LEU 164 Ca 0.14 -0.42 -0.21 0.00 0.09 0.00 0.00 57.88 57.48 1a1a h LEU 164 Cb 0.14 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.59 1a1a h LEU 164 CO -0.18 1.20 -1.04 -0.07 0.09 0.00 0.00 178.44 178.45 1a1a h LEU 165 N 0.74 0.00 0.00 1.67 3.38 -0.57 -3.20 115.31 117.33 1a1a h LEU 165 Ca 0.07 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.04 1a1a h LEU 165 Cb 0.94 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.69 1a1a h LEU 165 CO 0.09 0.96 0.00 0.18 0.09 0.00 0.00 178.44 179.76 1a1a n LEU 166 N -3.31 0.00 -4.69 1.67 4.77 0.99 -4.78 117.00 111.65 1a1a n LEU 166 Ca -0.02 0.00 -0.42 0.00 -0.03 0.00 0.00 56.01 55.54 1a1a n LEU 166 Cb 0.94 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 42.00 1a1a n LEU 166 CO 0.46 0.00 1.19 0.21 -1.33 0.00 0.00 177.39 177.92 1a1a s ASN 167 N -1.94 6.76 0.65 -1.43 3.84 -1.21 -4.87 114.94 116.74 1a1a s ASN 167 Ca 0.31 2.28 0.32 0.00 0.21 0.00 0.00 52.86 55.97 1a1a s ASN 167 Cb 0.14 -2.57 1.72 0.00 -0.55 0.00 0.00 41.25 40.00 1a1a s ASN 167 CO 0.24 -0.77 1.99 0.00 -2.79 0.00 0.00 177.10 175.77 1a1a h ALA 168 N 7.84 1.43 -0.43 1.71 0.00 -1.93 0.03 119.26 127.92 1a1a h ALA 168 Ca -0.40 -0.00 -0.05 0.00 0.00 0.00 0.00 54.91 54.46 1a1a h ALA 168 Cb 1.19 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.96 1a1a h ALA 168 CO 0.91 -0.33 0.05 1.49 0.00 0.00 0.00 179.25 181.37 1a1a h GLU 169 N 0.00 0.67 -6.64 0.00 4.81 -1.95 -3.44 114.58 108.02 1a1a h GLU 169 Ca 0.03 -0.14 -0.52 0.00 -0.13 0.00 0.00 59.36 58.60 1a1a h GLU 169 Cb 0.62 -0.10 0.05 0.00 0.63 0.00 0.00 28.75 29.95 1a1a h GLU 169 CO -0.00 0.65 0.91 -0.80 -0.73 0.00 0.00 179.01 179.03 1a1a s ASN 170 N -6.67 6.53 0.83 1.04 0.01 -0.00 -5.01 114.94 111.66 1a1a s ASN 170 Ca -0.09 2.70 -0.12 0.00 -0.71 0.00 0.00 52.86 54.65 1a1a s ASN 170 Cb 0.15 -2.60 0.09 0.00 0.41 0.00 0.00 41.25 39.30 1a1a s ASN 170 CO 0.78 -0.86 1.10 -2.16 -1.51 0.00 0.00 177.10 174.46 1a1a s PRO 171 N 0.99 1.85 0.34 -0.60 0.04 -1.26 -4.96 135.00 131.38 1a1a s PRO 171 Ca 0.70 0.60 -0.28 0.00 0.04 0.00 0.00 61.00 62.06 1a1a s PRO 171 Cb -0.45 -1.89 -0.10 0.00 0.04 0.00 0.00 34.50 32.10 1a1a s PRO 171 CO 0.33 -1.78 1.23 -0.98 0.04 0.00 0.00 177.00 175.85 1a1a s ARG 172 N -5.15 4.34 0.00 4.56 1.70 -1.26 -2.26 118.95 120.88 1a1a s ARG 172 Ca 0.61 2.05 0.00 0.00 -0.47 0.00 0.00 55.73 57.93 1a1a s ARG 172 Cb -0.15 -3.00 0.00 0.00 -0.57 0.00 0.00 34.95 31.23 1a1a s ARG 172 CO 0.54 -0.14 0.00 0.41 -1.08 0.00 0.00 175.30 175.03 1a1a n GLY 173 N 0.85 0.53 3.69 3.88 0.00 0.13 -4.70 105.19 109.57 1a1a n GLY 173 Ca 0.01 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.60 1a1a n GLY 173 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1a1a n THR 174 N -2.00 1.78 -4.09 2.61 -1.04 -0.96 -0.46 114.28 110.12 1a1a n THR 174 Ca 0.00 -0.45 -0.12 0.00 -2.04 0.00 0.00 64.05 61.45 1a1a n THR 174 Cb 0.00 -1.54 -0.06 0.00 -1.82 0.00 0.00 70.33 66.90 1a1a n THR 174 CO 0.00 0.00 0.00 0.72 -0.64 0.00 0.00 175.07 175.15 1a1a s PHE 175 N -0.88 0.83 -0.18 -1.42 -0.71 -0.09 -0.55 117.98 114.98 1a1a s PHE 175 Ca 0.58 -1.10 -0.28 0.00 -1.04 0.00 0.00 56.93 55.09 1a1a s PHE 175 Cb -0.59 -0.13 0.10 0.00 -1.21 0.00 0.00 43.02 41.19 1a1a s PHE 175 CO 0.60 -0.92 0.86 -0.48 -1.34 0.00 0.00 175.22 173.93 1a1a s LEU 176 N -3.13 -0.55 0.05 -1.99 0.05 -0.62 -0.64 118.68 111.85 1a1a s LEU 176 Ca 0.30 0.82 0.00 0.00 0.05 0.00 0.00 54.13 55.31 1a1a s LEU 176 Cb 0.02 2.19 -0.04 0.00 -2.05 0.00 0.00 46.19 46.30 1a1a s LEU 176 CO 0.14 -0.35 0.18 -0.69 -0.55 0.00 0.00 176.35 175.08 1a1a s VAL 177 N -0.50 5.26 0.21 1.48 1.01 -0.39 -0.91 120.40 126.56 1a1a s VAL 177 Ca -0.03 -0.41 -0.17 0.00 0.00 0.00 0.00 61.98 61.37 1a1a s VAL 177 Cb -0.02 -3.54 0.02 0.00 0.00 0.00 0.00 36.38 32.84 1a1a s VAL 177 CO 0.02 0.17 0.54 0.00 0.00 0.00 0.00 175.10 175.83 1a1a s ARG 178 N -2.38 1.44 0.47 2.72 1.70 -0.24 -0.27 118.95 122.38 1a1a s ARG 178 Ca 0.33 -0.92 -0.24 0.00 -0.47 0.00 0.00 55.73 54.43 1a1a s ARG 178 Cb -0.13 0.52 -0.07 0.00 -0.57 0.00 0.00 34.95 34.70 1a1a s ARG 178 CO 0.25 -0.61 1.35 -1.21 -1.08 0.00 0.00 175.30 173.99 1a1a s GLU 179 N -3.89 3.59 0.15 3.89 2.02 0.14 -0.11 118.70 124.48 1a1a s GLU 179 Ca 0.11 2.22 -0.31 0.00 0.02 0.00 0.00 54.97 57.02 1a1a s GLU 179 Cb -0.01 -2.52 -0.08 0.00 0.10 0.00 0.00 34.13 31.61 1a1a s GLU 179 CO -0.01 -0.83 1.35 0.45 0.02 0.00 0.00 175.26 176.25 1a1a s SER 180 N -0.80 6.86 0.10 -0.19 0.15 -0.25 -4.40 113.70 115.17 1a1a s SER 180 Ca 0.64 2.35 -0.11 0.00 0.70 0.00 0.00 55.95 59.52 1a1a s SER 180 Cb -0.40 -2.60 -0.15 0.00 -1.71 0.00 0.00 66.02 61.16 1a1a s SER 180 CO 0.49 -0.60 1.28 -0.33 1.20 0.00 0.00 173.24 175.28 1a1a h GLU 181 N 6.25 0.71 -0.01 5.44 5.08 -1.91 -3.35 114.58 126.79 1a1a h GLU 181 Ca -0.43 -0.64 0.00 0.00 -1.00 0.00 0.00 59.36 57.29 1a1a h GLU 181 Cb 1.21 0.15 0.00 0.00 0.50 0.00 0.00 28.75 30.61 1a1a h GLU 181 CO 0.83 1.25 -0.46 0.25 -1.00 0.00 0.00 179.01 179.88 1a1a n THR 182 N -3.89 0.00 -4.04 1.13 -2.24 -1.26 -4.85 114.28 99.13 1a1a n THR 182 Ca -0.08 -0.23 -0.28 0.00 -2.27 0.00 0.00 64.05 61.19 1a1a n THR 182 Cb 0.79 1.09 -0.17 0.00 -2.10 0.00 0.00 70.33 69.95 1a1a n THR 182 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1a1a s THR 183 N -2.50 1.28 0.32 4.28 2.01 -1.26 -5.12 115.64 114.66 1a1a s THR 183 Ca 0.19 -0.46 -0.29 0.00 0.31 0.00 0.00 61.69 61.44 1a1a s THR 183 Cb 0.18 -1.23 -0.10 0.00 0.01 0.00 0.00 72.50 71.36 1a1a s THR 183 CO 0.57 0.41 1.29 -1.59 -0.69 0.00 0.00 174.62 174.61 1a1a s LYS 184 N 1.49 4.38 0.00 4.92 0.00 -1.26 -2.82 119.74 126.45 1a1a s LYS 184 Ca 0.03 2.18 0.00 0.00 0.00 0.00 0.00 55.97 58.18 1a1a s LYS 184 Cb -0.13 -3.09 0.00 0.00 0.00 0.00 0.00 37.83 34.61 1a1a s LYS 184 CO -0.08 -0.16 0.00 0.41 0.00 0.00 0.00 175.35 175.52 1a1a n GLY 185 N 0.92 2.95 3.98 0.59 0.00 -1.26 -5.01 105.19 107.35 1a1a n GLY 185 Ca 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.82 1a1a n GLY 185 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1a1a s ALA 186 N -2.15 3.98 0.44 4.61 0.00 -1.13 -4.57 121.76 122.93 1a1a s ALA 186 Ca 0.00 -1.34 0.03 0.00 0.00 0.00 0.00 51.96 50.66 1a1a s ALA 186 Cb 0.00 -2.01 -0.04 0.00 0.00 0.00 0.00 23.12 21.08 1a1a s ALA 186 CO 0.00 -0.60 0.04 0.71 0.00 0.00 0.00 175.76 175.92 1a1a s TYR 187 N -2.65 1.98 -0.01 0.00 1.51 -0.16 -1.09 117.35 116.93 1a1a s TYR 187 Ca 0.55 -0.99 0.01 0.00 -1.01 0.00 0.00 57.07 55.63 1a1a s TYR 187 Cb -0.10 -1.48 0.01 0.00 -0.11 0.00 0.00 41.96 40.28 1a1a s TYR 187 CO 0.37 0.10 -0.02 -1.12 -1.11 0.00 0.00 175.55 173.78 1a1a s SER 188 N -3.72 0.39 -0.34 2.29 0.01 0.85 0.21 113.70 113.38 1a1a s SER 188 Ca 0.20 -0.05 -0.10 0.00 1.31 0.00 0.00 55.95 57.32 1a1a s SER 188 Cb 0.04 -0.12 0.01 0.00 0.21 0.00 0.00 66.02 66.17 1a1a s SER 188 CO 0.10 -0.02 0.17 -0.22 0.41 0.00 0.00 173.24 173.69 1a1a s LEU 189 N 0.35 4.39 -0.17 2.44 2.96 0.13 -1.08 118.68 127.71 1a1a s LEU 189 Ca -0.03 -0.81 -0.05 0.00 -0.22 0.00 0.00 54.13 53.01 1a1a s LEU 189 Cb -0.06 -1.99 -0.03 0.00 0.50 0.00 0.00 46.19 44.60 1a1a s LEU 189 CO -0.01 -0.30 0.00 -0.44 -1.32 0.00 0.00 176.35 174.29 1a1a s SER 190 N 1.56 5.13 -0.07 3.68 0.01 -0.09 -0.70 113.70 123.22 1a1a s SER 190 Ca 0.03 -0.05 0.02 0.00 1.31 0.00 0.00 55.95 57.26 1a1a s SER 190 Cb -0.18 -1.85 0.01 0.00 0.21 0.00 0.00 66.02 64.21 1a1a s SER 190 CO 0.06 0.17 -0.12 -0.69 0.41 0.00 0.00 173.24 173.07 1a1a s VAL 191 N 0.36 1.13 0.30 3.43 1.01 0.27 -1.59 120.40 125.31 1a1a s VAL 191 Ca -0.01 -0.46 -0.27 0.00 0.00 0.00 0.00 61.98 61.23 1a1a s VAL 191 Cb -0.13 -1.05 -0.10 0.00 0.00 0.00 0.00 36.38 35.10 1a1a s VAL 191 CO 0.02 0.36 0.96 -0.94 0.00 0.00 0.00 175.10 175.50 1a1a s SER 192 N 0.78 7.37 0.21 3.32 1.04 0.29 -0.54 113.70 126.17 1a1a s SER 192 Ca -0.12 1.91 -0.10 0.00 0.48 0.00 0.00 55.95 58.11 1a1a s SER 192 Cb -0.15 -2.59 -0.01 0.00 0.10 0.00 0.00 66.02 63.37 1a1a s SER 192 CO 0.02 -0.04 0.38 -0.62 0.98 0.00 0.00 173.24 173.96 1a1a s ASP 193 N -1.45 -0.03 0.01 7.02 2.15 0.48 0.17 116.67 125.02 1a1a s ASP 193 Ca 0.48 -0.94 0.00 0.00 0.43 0.00 0.00 52.55 52.53 1a1a s ASP 193 Cb -0.22 0.51 -0.01 0.00 -0.30 0.00 0.00 42.92 42.91 1a1a s ASP 193 CO 0.27 -1.02 -0.03 0.12 -0.17 0.00 0.00 175.17 174.35 1a1a s PHE 194 N -4.01 0.22 -0.02 -5.34 5.36 -1.26 -1.45 117.98 111.47 1a1a s PHE 194 Ca 0.22 -0.28 -0.16 0.00 -0.96 0.00 0.00 56.93 55.75 1a1a s PHE 194 Cb 0.02 -0.15 0.03 0.00 -0.34 0.00 0.00 43.02 42.57 1a1a s PHE 194 CO 0.06 -0.09 0.33 0.16 -1.46 0.00 0.00 175.22 174.22 1a1a s ASP 195 N -0.79 -0.23 -1.41 6.13 1.47 -1.15 -5.01 116.67 115.69 1a1a s ASP 195 Ca -0.08 0.16 -0.08 0.00 1.18 0.00 0.00 52.55 53.73 1a1a s ASP 195 Cb -0.05 0.35 -0.04 0.00 -0.34 0.00 0.00 42.92 42.84 1a1a s ASP 195 CO -0.00 -0.43 2.85 -0.46 0.68 0.00 0.00 175.17 177.80 1a1a n ASN 196 N 1.36 8.30 0.00 2.11 2.04 -1.26 -1.28 115.26 126.54 1a1a n ASN 196 Ca -0.21 -2.74 0.00 0.00 -0.44 0.00 0.00 54.58 51.19 1a1a n ASN 196 Cb 0.56 -1.49 0.00 0.00 -2.53 0.00 0.00 39.78 36.32 1a1a n ASN 196 CO 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 177.26 176.82 1a1a n ALA 197 N 2.93 0.00 0.52 -2.53 0.00 -1.26 -4.89 120.51 115.28 1a1a n ALA 197 Ca 0.71 0.00 0.11 0.00 0.00 0.00 0.00 53.44 54.27 1a1a n ALA 197 Cb 0.29 0.00 0.05 0.00 0.00 0.00 0.00 19.45 19.79 1a1a n ALA 197 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86 1a1a n LYS 198 N -1.77 0.32 0.00 0.00 0.00 -1.21 -5.08 118.16 110.42 1a1a n LYS 198 Ca 0.00 0.02 0.00 0.00 -0.00 0.00 0.00 58.31 58.33 1a1a n LYS 198 Cb 0.00 -1.63 0.00 0.00 -0.00 0.00 0.00 35.03 33.40 1a1a n LYS 198 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1a1a n GLY 199 N 1.34 -1.61 3.73 2.58 0.00 -0.40 -4.72 105.19 106.12 1a1a n GLY 199 Ca 0.02 -1.30 -0.42 0.00 0.00 0.00 0.00 46.02 44.32 1a1a n GLY 199 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1a1a s LEU 200 N 0.00 4.36 0.25 0.99 1.43 -1.26 -2.95 118.68 121.50 1a1a s LEU 200 Ca 0.00 2.86 -0.09 0.00 -1.03 0.00 0.00 54.13 55.87 1a1a s LEU 200 Cb 0.00 -3.62 -0.01 0.00 0.03 0.00 0.00 46.19 42.59 1a1a s LEU 200 CO 0.00 -0.91 0.40 0.54 0.23 0.00 0.00 176.35 176.61 1a1a s ASN 201 N 0.82 0.08 -0.05 2.29 2.20 -0.53 -5.01 114.94 114.74 1a1a s ASN 201 Ca 0.68 -1.10 0.07 0.00 -0.94 0.00 0.00 52.86 51.57 1a1a s ASN 201 Cb -0.48 0.55 -0.01 0.00 -2.00 0.00 0.00 41.25 39.31 1a1a s ASN 201 CO 0.40 -1.09 -0.25 -0.69 -2.94 0.00 0.00 177.10 172.52 1a1a s VAL 202 N -3.94 2.05 -0.12 3.54 1.01 -1.26 -0.39 120.40 121.30 1a1a s VAL 202 Ca 0.27 -1.08 -0.03 0.00 0.00 0.00 0.00 61.98 61.14 1a1a s VAL 202 Cb 0.01 -1.73 -0.03 0.00 0.00 0.00 0.00 36.38 34.63 1a1a s VAL 202 CO 0.11 0.57 -0.00 -0.54 0.00 0.00 0.00 175.10 175.24 1a1a s LYS 203 N -0.29 3.31 -0.18 2.72 1.02 0.29 -4.93 119.74 121.69 1a1a s LYS 203 Ca 0.00 -0.43 -0.04 0.00 0.02 0.00 0.00 55.97 55.52 1a1a s LYS 203 Cb -0.13 -2.88 -0.02 0.00 -0.52 0.00 0.00 37.83 34.28 1a1a s LYS 203 CO 0.02 0.51 -0.04 -1.01 -0.92 0.00 0.00 175.35 173.92 1a1a s HIS 204 N -0.35 2.99 -0.18 3.18 3.76 -1.26 -0.57 115.29 122.86 1a1a s HIS 204 Ca 0.07 -0.50 -0.00 0.00 -0.15 0.00 0.00 55.06 54.48 1a1a s HIS 204 Cb -0.12 -2.00 0.01 0.00 1.11 0.00 0.00 32.58 31.57 1a1a s HIS 204 CO 0.02 -0.21 -0.16 0.71 -0.85 0.00 0.00 174.74 174.26 1a1a s TYR 205 N 0.74 2.81 0.53 1.40 2.02 0.12 -4.95 117.35 120.02 1a1a s TYR 205 Ca -0.02 -1.34 -0.22 0.00 -0.37 0.00 0.00 57.07 55.12 1a1a s TYR 205 Cb -0.15 -1.95 -0.05 0.00 -0.40 0.00 0.00 41.96 39.42 1a1a s TYR 205 CO 0.02 -0.67 1.28 0.21 -1.57 0.00 0.00 175.55 174.82 1a1a s LYS 206 N 1.19 3.29 -0.16 -0.62 2.47 -1.26 -0.69 119.74 123.97 1a1a s LYS 206 Ca 0.02 2.04 0.02 0.00 -1.56 0.00 0.00 55.97 56.49 1a1a s LYS 206 Cb -0.14 -2.25 0.02 0.00 -1.46 0.00 0.00 37.83 33.99 1a1a s LYS 206 CO -0.07 -1.01 -0.21 0.42 0.16 0.00 0.00 175.35 174.64 1a1a s ILE 207 N -1.41 2.07 0.08 5.43 1.01 0.13 -4.52 121.20 123.99 1a1a s ILE 207 Ca 0.70 -0.95 0.02 0.00 0.00 0.00 0.00 60.65 60.42 1a1a s ILE 207 Cb -0.35 -1.85 -0.04 0.00 0.01 0.00 0.00 42.46 40.23 1a1a s ILE 207 CO 0.42 0.54 0.14 -0.13 0.00 0.00 0.00 174.94 175.91 1a1a s ARG 208 N 1.08 3.13 -0.15 2.79 1.81 -0.17 -0.99 118.95 126.45 1a1a s ARG 208 Ca -0.00 -0.59 -0.07 0.00 -1.72 0.00 0.00 55.73 53.35 1a1a s ARG 208 Cb -0.14 -2.86 -0.04 0.00 -0.45 0.00 0.00 34.95 31.46 1a1a s ARG 208 CO -0.08 0.58 0.09 0.21 -0.68 0.00 0.00 175.30 175.41 1a1a s LYS 209 N -2.50 3.73 0.41 3.54 2.20 -1.26 -1.29 119.74 124.58 1a1a s LYS 209 Ca 0.32 -0.27 -0.04 0.00 -0.36 0.00 0.00 55.97 55.62 1a1a s LYS 209 Cb -0.12 -3.18 -0.04 0.00 -1.51 0.00 0.00 37.83 32.97 1a1a s LYS 209 CO 0.25 0.47 0.68 -0.51 -0.36 0.00 0.00 175.35 175.89 1a1a s LEU 210 N -0.19 3.81 0.53 5.43 1.43 0.44 -4.98 118.68 125.17 1a1a s LEU 210 Ca 0.09 0.78 0.29 0.00 -1.03 0.00 0.00 54.13 54.25 1a1a s LEU 210 Cb -0.12 -3.68 1.50 0.00 0.03 0.00 0.00 46.19 43.92 1a1a s LEU 210 CO 0.01 -0.43 2.09 0.44 0.23 0.00 0.00 176.35 178.69 1a1a h ASP 211 N 0.65 0.00 0.40 2.29 3.32 -1.99 0.19 116.42 121.28 1a1a h ASP 211 Ca -0.48 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 56.55 1a1a h ASP 211 Cb 1.21 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.75 1a1a h ASP 211 CO 0.62 0.10 -0.11 0.77 -1.72 0.00 0.00 179.24 178.91 1a1a h SER 212 N 0.00 0.00 0.00 6.45 4.64 -2.04 -3.46 113.55 119.15 1a1a h SER 212 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1a1a h SER 212 Cb 0.32 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.41 1a1a h SER 212 CO 0.01 0.11 0.00 0.61 -0.87 0.00 0.00 176.83 176.69 1a1a n GLY 213 N -0.65 1.09 3.30 -0.77 0.00 0.65 -5.11 105.19 103.70 1a1a n GLY 213 Ca -0.02 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.74 1a1a n GLY 213 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1a1a n GLY 214 N -0.48 -1.93 3.08 -0.02 0.00 -1.24 -4.69 105.19 99.90 1a1a n GLY 214 Ca 0.00 -1.63 -0.10 0.00 0.00 0.00 0.00 46.02 44.29 1a1a n GLY 214 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1a1a s PHE 215 N -3.27 0.61 0.14 1.61 0.08 0.74 -0.42 117.98 117.47 1a1a s PHE 215 Ca 0.65 -0.74 -0.22 0.00 0.12 0.00 0.00 56.93 56.75 1a1a s PHE 215 Cb -0.03 -0.39 0.06 0.00 -0.57 0.00 0.00 43.02 42.09 1a1a s PHE 215 CO 0.47 -0.19 0.55 1.52 -0.10 0.00 0.00 175.22 177.48 1a1a s TYR 216 N -2.55 -0.45 -0.04 0.36 -0.85 -0.41 -1.10 117.35 112.31 1a1a s TYR 216 Ca -0.02 0.26 0.01 0.00 -0.52 0.00 0.00 57.07 56.81 1a1a s TYR 216 Cb -0.02 0.46 -0.03 0.00 0.38 0.00 0.00 41.96 42.76 1a1a s TYR 216 CO -0.03 -0.79 -0.02 -0.89 -1.52 0.00 0.00 175.55 172.29 1a1a n ILE 217 N -0.23 0.22 -4.42 -3.49 5.41 -1.26 -1.00 119.36 114.59 1a1a n ILE 217 Ca -0.17 -0.10 -0.21 0.00 1.00 0.00 0.00 62.75 63.28 1a1a n ILE 217 Cb 0.64 -0.72 -0.10 0.00 -0.71 0.00 0.00 39.64 38.75 1a1a n ILE 217 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 176.55 176.97 1a1a s THR 218 N -2.08 0.86 -0.89 1.39 -4.23 -1.26 -5.01 115.64 104.42 1a1a s THR 218 Ca -0.04 -2.00 0.24 0.00 -1.18 0.00 0.00 61.69 58.71 1a1a s THR 218 Cb 0.01 -2.66 0.22 0.00 1.34 0.00 0.00 72.50 71.41 1a1a s THR 218 CO 0.10 0.00 1.75 -1.54 -0.54 0.00 0.00 174.62 174.40 1a1a n SER 219 N -0.74 0.22 -0.07 3.99 3.41 -1.26 -3.74 113.62 115.43 1a1a n SER 219 Ca -0.02 0.53 -0.13 0.00 -0.26 0.00 0.00 58.87 58.99 1a1a n SER 219 Cb 0.66 -0.59 -0.06 0.00 -0.26 0.00 0.00 64.21 63.96 1a1a n SER 219 CO 0.00 0.00 0.00 -0.09 -0.16 0.00 0.00 175.04 174.79 1a1a h ARG 220 N 0.00 0.49 -3.59 4.33 2.43 -1.97 -3.46 114.38 112.61 1a1a h ARG 220 Ca 0.00 -0.26 -0.17 0.00 -0.81 0.00 0.00 59.98 58.74 1a1a h ARG 220 Cb 0.46 0.01 -0.23 0.00 -0.42 0.00 0.00 29.97 29.79 1a1a h ARG 220 CO 0.00 0.83 -0.57 0.99 -1.51 0.00 0.00 179.97 179.72 1a1a s THR 221 N -4.33 0.06 0.28 0.20 2.01 -1.25 -5.17 115.64 107.45 1a1a s THR 221 Ca -0.13 -0.50 0.05 0.00 0.31 0.00 0.00 61.69 61.42 1a1a s THR 221 Cb 0.07 -0.30 -0.06 0.00 0.01 0.00 0.00 72.50 72.22 1a1a s THR 221 CO 0.78 -0.27 -0.01 0.00 -0.69 0.00 0.00 174.62 174.43 1a1a s GLN 222 N -0.90 1.53 0.01 4.92 -2.07 -1.26 -4.44 119.66 117.45 1a1a s GLN 222 Ca -0.10 -1.80 -0.01 0.00 -1.82 0.00 0.00 55.36 51.63 1a1a s GLN 222 Cb -0.06 -0.93 -0.01 0.00 -1.09 0.00 0.00 33.01 30.92 1a1a s GLN 222 CO 0.01 -0.06 0.00 -0.06 -1.32 0.00 0.00 175.29 173.85 1a1a s PHE 223 N -3.20 0.18 -1.25 9.60 0.08 -0.26 -4.94 117.98 118.19 1a1a s PHE 223 Ca 0.31 -0.36 0.27 0.00 0.12 0.00 0.00 56.93 57.27 1a1a s PHE 223 Cb 0.06 -0.13 1.28 0.00 -0.57 0.00 0.00 43.02 43.66 1a1a s PHE 223 CO 0.12 -0.17 1.90 0.09 -0.10 0.00 0.00 175.22 177.07 1a1a n ASN 224 N 1.86 0.00 -3.43 1.36 3.02 -1.26 -0.18 115.26 116.63 1a1a n ASN 224 Ca -0.22 0.15 -0.12 0.00 -0.03 0.00 0.00 54.58 54.36 1a1a n ASN 224 Cb 0.56 -0.38 -0.02 0.00 -0.61 0.00 0.00 39.78 39.33 1a1a n ASN 224 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 1a1a s SER 225 N -2.75 -0.57 0.28 6.41 1.04 -1.26 -4.72 113.70 112.13 1a1a s SER 225 Ca 0.20 0.04 -0.01 0.00 0.48 0.00 0.00 55.95 56.67 1a1a s SER 225 Cb 0.18 0.59 0.40 0.00 0.10 0.00 0.00 66.02 67.30 1a1a s SER 225 CO 0.45 -0.94 1.80 -0.07 0.98 0.00 0.00 173.24 175.46 1a1a h LEU 226 N 2.05 0.72 -0.73 2.42 3.38 -1.96 -1.79 115.31 119.41 1a1a h LEU 226 Ca -0.33 -0.15 0.08 0.00 0.09 0.00 0.00 57.88 57.56 1a1a h LEU 226 Cb 1.30 -0.19 -0.06 0.00 0.09 0.00 0.00 40.66 41.80 1a1a h LEU 226 CO 0.38 0.76 0.40 1.56 0.09 0.00 0.00 178.44 181.63 1a1a h GLN 227 N 0.72 0.68 -0.01 1.13 7.50 -1.99 0.80 115.11 123.94 1a1a h GLN 227 Ca 0.15 -0.04 -0.13 0.00 0.50 0.00 0.00 58.65 59.13 1a1a h GLN 227 Cb 0.37 -0.15 -0.02 0.00 0.05 0.00 0.00 27.48 27.73 1a1a h GLN 227 CO 0.01 0.45 -0.62 1.96 -1.50 0.00 0.00 178.83 179.13 1a1a h GLN 228 N 0.70 0.03 -0.22 1.46 4.20 -1.84 -0.48 115.11 118.96 1a1a h GLN 228 Ca 0.34 -0.02 -0.05 0.00 0.06 0.00 0.00 58.65 58.98 1a1a h GLN 228 Cb 0.29 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.06 1a1a h GLN 228 CO -0.23 0.64 -0.06 1.25 -0.67 0.00 0.00 178.83 179.77 1a1a h LEU 229 N 0.02 0.43 -0.08 1.46 6.46 -0.43 -0.80 115.31 122.37 1a1a h LEU 229 Ca -0.01 -0.37 -0.01 0.00 -0.12 0.00 0.00 57.88 57.38 1a1a h LEU 229 Cb 1.11 -0.12 -0.00 0.00 -0.73 0.00 0.00 40.66 40.92 1a1a h LEU 229 CO 0.08 0.70 0.03 0.58 -0.62 0.00 0.00 178.44 179.21 1a1a h VAL 230 N 0.15 1.16 -0.72 1.05 2.07 -0.75 -0.96 116.25 118.25 1a1a h VAL 230 Ca 0.05 -0.48 0.08 0.00 0.82 0.00 0.00 66.70 67.18 1a1a h VAL 230 Cb 0.51 1.33 -0.07 0.00 -1.52 0.00 0.00 31.29 31.55 1a1a h VAL 230 CO 0.02 0.14 0.38 0.00 0.02 0.00 0.00 177.57 178.13 1a1a h ALA 231 N 0.85 1.00 0.40 1.67 0.00 -1.08 -0.67 119.26 121.43 1a1a h ALA 231 Ca 0.03 0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.96 1a1a h ALA 231 Cb 0.19 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.90 1a1a h ALA 231 CO -0.00 0.01 -0.19 -0.92 0.00 0.00 0.00 179.25 178.15 1a1a h TYR 232 N 0.67 -0.49 0.00 0.00 3.20 -0.83 -2.74 116.97 116.76 1a1a h TYR 232 Ca 0.35 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 62.20 1a1a h TYR 232 Cb 0.32 0.16 0.00 0.00 1.54 0.00 0.00 36.73 38.75 1a1a h TYR 232 CO -0.09 -0.22 0.00 0.66 -1.64 0.00 0.00 178.16 176.87 1a1a n TYR 233 N -5.26 0.00 0.10 -3.82 4.01 -0.39 -0.17 117.16 111.64 1a1a n TYR 233 Ca -0.11 0.00 -0.04 0.00 -0.16 0.00 0.00 57.90 57.59 1a1a n TYR 233 Cb 0.27 -0.28 0.05 0.00 -0.31 0.00 0.00 39.34 39.07 1a1a n TYR 233 CO 0.00 0.00 0.00 0.77 -0.46 0.00 0.00 176.86 177.17 1a1a h SER 234 N 0.00 0.02 0.69 7.72 0.02 -0.82 0.13 113.55 121.30 1a1a h SER 234 Ca 0.00 -0.02 0.00 0.00 -0.84 0.00 0.00 61.79 60.93 1a1a h SER 234 Cb 0.17 -0.01 0.00 0.00 0.14 0.00 0.00 62.40 62.71 1a1a h SER 234 CO 0.00 0.79 -1.30 0.29 -1.14 0.00 0.00 176.83 175.47 1a1a n LYS 235 N -3.63 0.62 -3.67 3.45 5.02 0.77 -4.36 118.16 116.35 1a1a n LYS 235 Ca -0.01 0.02 -0.09 0.00 -2.02 0.00 0.00 58.31 56.22 1a1a n LYS 235 Cb 0.75 -1.73 -0.09 0.00 -0.02 0.00 0.00 35.03 33.93 1a1a n LYS 235 CO 0.00 0.00 0.00 -1.01 -0.52 0.00 0.00 177.40 175.87 1a1a s HIS 236 N -3.41 -0.78 0.07 2.13 3.76 -0.65 -5.03 115.29 111.37 1a1a s HIS 236 Ca -0.03 1.54 -0.21 0.00 -0.15 0.00 0.00 55.06 56.22 1a1a s HIS 236 Cb 0.11 0.36 -0.11 0.00 1.11 0.00 0.00 32.58 34.04 1a1a s HIS 236 CO 0.83 -0.44 1.52 0.00 -0.85 0.00 0.00 174.74 175.79 1a1a h ALA 237 N 7.62 0.22 -6.96 -1.40 0.00 -1.84 -3.37 119.26 113.53 1a1a h ALA 237 Ca -0.26 -0.18 -0.60 0.00 0.00 0.00 0.00 54.91 53.87 1a1a h ALA 237 Cb 1.15 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.84 1a1a h ALA 237 CO 0.19 -0.10 -1.01 -0.25 0.00 0.00 0.00 179.25 178.09 1a1a n ASP 238 N -4.76 -3.59 0.00 0.00 9.92 -1.26 -1.45 116.55 115.41 1a1a n ASP 238 Ca -0.05 -1.30 0.00 0.00 -0.53 0.00 0.00 54.79 52.91 1a1a n ASP 238 Cb 0.20 -1.66 0.00 0.00 -0.64 0.00 0.00 41.12 39.02 1a1a n ASP 238 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1a1a n GLY 239 N -2.15 2.59 3.75 0.44 0.00 -1.26 -5.02 105.19 103.54 1a1a n GLY 239 Ca -0.13 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.57 1a1a n GLY 239 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1a1a s LEU 240 N 0.00 3.07 0.57 0.99 1.43 -0.53 -4.91 118.68 119.30 1a1a s LEU 240 Ca 0.00 1.95 0.26 0.00 -1.03 0.00 0.00 54.13 55.31 1a1a s LEU 240 Cb 0.00 -4.54 1.69 0.00 0.03 0.00 0.00 46.19 43.37 1a1a s LEU 240 CO 0.00 -2.18 2.23 0.00 0.23 0.00 0.00 176.35 176.63 1a1a s HIS 242 N -4.74 -0.53 0.43 0.00 5.65 -1.26 -5.08 115.29 109.75 1a1a s HIS 242 Ca -0.05 0.72 -0.26 0.00 0.25 0.00 0.00 55.06 55.72 1a1a s HIS 242 Cb 0.16 0.47 -0.09 0.00 -1.18 0.00 0.00 32.58 31.93 1a1a s HIS 242 CO 0.58 -0.61 1.42 -2.13 -0.65 0.00 0.00 174.74 173.36 1a1a n ARG 243 N 0.41 2.31 -2.29 2.88 0.63 -1.26 -4.70 116.66 114.64 1a1a n ARG 243 Ca -0.15 0.82 -0.42 0.00 -0.92 0.00 0.00 57.85 57.17 1a1a n ARG 243 Cb 0.60 -2.61 -0.03 0.00 0.45 0.00 0.00 32.46 30.88 1a1a n ARG 243 CO 0.00 0.00 0.00 -0.51 -2.51 0.00 0.00 177.63 174.61 1a1a s LEU 244 N -2.40 4.27 0.00 6.15 1.43 0.45 -4.57 118.68 124.01 1a1a s LEU 244 Ca 0.59 1.95 0.00 0.00 -1.03 0.00 0.00 54.13 55.64 1a1a s LEU 244 Cb -0.46 -3.55 0.00 0.00 0.03 0.00 0.00 46.19 42.21 1a1a s LEU 244 CO 0.59 -0.74 0.00 0.35 0.23 0.00 0.00 176.35 176.78 1a1a n THR 245 N 5.01 0.00 -3.03 5.49 -2.24 0.39 -4.43 114.28 115.47 1a1a n THR 245 Ca 0.14 0.00 -0.39 0.00 -2.27 0.00 0.00 64.05 61.52 1a1a n THR 245 Cb 0.44 -0.63 -0.05 0.00 -2.10 0.00 0.00 70.33 67.99 1a1a n THR 245 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1a1a s THR 246 N 0.00 4.63 -0.00 4.28 2.01 -1.24 -4.91 115.64 120.40 1a1a s THR 246 Ca 0.00 1.58 -0.30 0.00 0.31 0.00 0.00 61.69 63.27 1a1a s THR 246 Cb 0.00 -4.08 -0.05 0.00 0.01 0.00 0.00 72.50 68.38 1a1a s THR 246 CO 0.00 0.44 1.30 -0.69 -0.69 0.00 0.00 174.62 174.98 1a1a s VAL 247 N -0.52 3.92 -0.01 3.82 1.01 -1.26 -0.91 120.40 126.45 1a1a s VAL 247 Ca 0.36 1.30 -0.37 0.00 0.00 0.00 0.00 61.98 63.27 1a1a s VAL 247 Cb -0.21 -3.84 -0.16 0.00 0.00 0.00 0.00 36.38 32.17 1a1a s VAL 247 CO 0.23 0.02 1.49 0.00 0.00 0.00 0.00 175.10 176.84