#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1q8y s HIS 145 N 0.00 2.97 -0.11 2.98 3.76 -1.26 -4.99 115.29 118.64 1q8y s HIS 145 Ca 0.00 -2.40 0.27 0.00 -0.15 0.00 0.00 55.06 52.77 1q8y s HIS 145 Cb 0.00 -2.29 0.81 0.00 1.11 0.00 0.00 32.58 32.21 1q8y s HIS 145 CO 0.00 -0.89 1.78 -1.00 -0.85 0.00 0.00 174.74 173.77 1q8y h PRO 146 N 7.80 0.00 -6.73 8.40 0.13 -2.04 -3.46 132.00 136.11 1q8y h PRO 146 Ca -0.10 0.00 -0.57 0.00 -0.87 0.00 0.00 66.00 64.46 1q8y h PRO 146 Cb 1.03 0.00 0.11 0.00 0.13 0.00 0.00 31.00 32.27 1q8y h PRO 146 CO 0.48 0.08 0.49 0.00 -0.23 0.00 0.00 178.00 178.83 1q8y n ALA 147 N -2.13 1.22 -3.13 -0.56 0.00 -1.26 -5.01 120.51 109.63 1q8y n ALA 147 Ca 0.02 0.36 -0.12 0.00 0.00 0.00 0.00 53.44 53.70 1q8y n ALA 147 Cb 0.44 -2.24 -0.09 0.00 0.00 0.00 0.00 19.45 17.56 1q8y n ALA 147 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.50 176.91 1q8y s PHE 148 N -1.06 -0.06 0.09 0.00 -0.12 -1.26 -5.10 117.98 110.48 1q8y s PHE 148 Ca 0.56 0.03 -0.34 0.00 -0.05 0.00 0.00 56.93 57.12 1q8y s PHE 148 Cb -0.58 0.02 -0.14 0.00 -0.63 0.00 0.00 43.02 41.70 1q8y s PHE 148 CO 0.62 -0.36 1.61 1.17 -0.05 0.00 0.00 175.22 178.21 1q8y n LYS 149 N 1.25 2.01 0.00 1.99 4.81 -1.26 -1.34 118.16 125.62 1q8y n LYS 149 Ca -0.22 0.73 0.00 0.00 -0.87 0.00 0.00 58.31 57.95 1q8y n LYS 149 Cb 0.56 -2.50 0.00 0.00 0.02 0.00 0.00 35.03 33.12 1q8y n LYS 149 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1q8y n GLY 150 N 3.52 2.07 3.74 3.14 0.00 -0.40 -4.98 105.19 112.28 1q8y n GLY 150 Ca 0.18 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.79 1q8y n GLY 150 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1q8y s GLU 151 N -0.88 4.18 0.10 1.61 2.12 -0.45 -4.62 118.70 120.76 1q8y s GLU 151 Ca 0.00 2.47 -0.22 0.00 0.36 0.00 0.00 54.97 57.58 1q8y s GLU 151 Cb 0.00 -3.07 -0.07 0.00 0.26 0.00 0.00 34.13 31.26 1q8y s GLU 151 CO 0.00 -0.57 0.66 -1.25 -0.54 0.00 0.00 175.26 173.56 1q8y s PRO 152 N -0.19 4.37 0.10 4.30 0.04 -1.26 -1.95 135.00 140.40 1q8y s PRO 152 Ca 0.63 0.91 0.07 0.00 0.04 0.00 0.00 61.00 62.66 1q8y s PRO 152 Cb -0.46 -3.27 -0.03 0.00 0.04 0.00 0.00 34.50 30.78 1q8y s PRO 152 CO 0.44 0.56 -0.19 0.71 0.04 0.00 0.00 177.00 178.56 1q8y s TYR 153 N -0.94 1.62 -0.72 0.56 1.51 0.13 -4.70 117.35 114.81 1q8y s TYR 153 Ca 0.32 -0.44 -0.07 0.00 -1.01 0.00 0.00 57.07 55.88 1q8y s TYR 153 Cb -0.21 -0.89 0.01 0.00 -0.11 0.00 0.00 41.96 40.76 1q8y s TYR 153 CO 0.22 0.17 0.64 1.17 -1.11 0.00 0.00 175.55 176.63 1q8y n LYS 154 N 1.10 -1.60 -3.90 -0.62 4.81 -1.26 -0.80 118.16 115.88 1q8y n LYS 154 Ca -0.20 1.18 -0.29 0.00 -0.87 0.00 0.00 58.31 58.13 1q8y n LYS 154 Cb 0.54 -3.57 0.03 0.00 0.02 0.00 0.00 35.03 32.04 1q8y n LYS 154 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 1q8y n ASP 155 N -1.86 -4.30 -0.83 3.14 10.43 -1.26 -1.63 116.55 120.24 1q8y n ASP 155 Ca -0.16 -0.79 -0.11 0.00 2.57 0.00 0.00 54.79 56.30 1q8y n ASP 155 Cb 0.62 -3.87 -0.05 0.00 1.84 0.00 0.00 41.12 39.66 1q8y n ASP 155 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 1q8y n ALA 156 N -4.63 -0.16 -0.09 2.24 0.00 -0.98 -4.90 120.51 111.98 1q8y n ALA 156 Ca -0.00 0.17 -0.14 0.00 0.00 0.00 0.00 53.44 53.47 1q8y n ALA 156 Cb 0.54 -1.46 -0.04 0.00 0.00 0.00 0.00 19.45 18.50 1q8y n ALA 156 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 1q8y h ARG 157 N 0.08 0.82 -5.97 0.00 2.43 0.00 -3.45 114.38 108.29 1q8y h ARG 157 Ca -0.22 -0.47 -0.68 0.00 -0.81 0.00 0.00 59.98 57.80 1q8y h ARG 157 Cb 0.89 0.04 -0.19 0.00 -0.42 0.00 0.00 29.97 30.29 1q8y h ARG 157 CO 0.32 1.10 -0.68 0.71 -1.51 0.00 0.00 179.97 179.92 1q8y s TYR 158 N -4.26 2.99 -0.15 2.20 1.51 -0.71 -0.15 117.35 118.78 1q8y s TYR 158 Ca -0.12 -0.01 0.01 0.00 -1.01 0.00 0.00 57.07 55.95 1q8y s TYR 158 Cb 0.10 -1.76 0.02 0.00 -0.11 0.00 0.00 41.96 40.20 1q8y s TYR 158 CO 0.86 0.29 -0.17 0.42 -1.11 0.00 0.00 175.55 175.84 1q8y s ILE 159 N -0.63 1.78 0.48 2.71 -1.09 -0.71 0.21 121.20 123.96 1q8y s ILE 159 Ca 0.10 -0.78 -0.24 0.00 -2.23 0.00 0.00 60.65 57.50 1q8y s ILE 159 Cb -0.12 -1.62 -0.07 0.00 -1.58 0.00 0.00 42.46 39.07 1q8y s ILE 159 CO 0.02 0.49 1.36 -0.76 -1.23 0.00 0.00 174.94 174.82 1q8y s LEU 160 N 1.22 4.02 0.06 2.97 1.43 -0.82 -1.08 118.68 126.47 1q8y s LEU 160 Ca 0.01 2.76 -0.02 0.00 -1.03 0.00 0.00 54.13 55.85 1q8y s LEU 160 Cb -0.14 -4.09 -0.01 0.00 0.03 0.00 0.00 46.19 41.99 1q8y s LEU 160 CO -0.08 -1.25 -0.04 0.52 0.23 0.00 0.00 176.35 175.73 1q8y n VAL 161 N -0.49 1.11 -3.57 -1.59 0.31 0.47 -1.27 118.33 113.29 1q8y n VAL 161 Ca 0.07 0.34 -0.10 0.00 -0.01 0.00 0.00 64.34 64.64 1q8y n VAL 161 Cb 0.44 -1.60 -0.02 0.00 -0.91 0.00 0.00 33.84 31.75 1q8y n VAL 161 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1q8y s ARG 162 N -1.97 1.37 0.03 5.55 1.70 -1.16 -4.72 118.95 119.75 1q8y s ARG 162 Ca -0.03 -0.61 -0.30 0.00 -0.47 0.00 0.00 55.73 54.32 1q8y s ARG 162 Cb 0.00 0.57 -0.05 0.00 -0.57 0.00 0.00 34.95 34.90 1q8y s ARG 162 CO 0.05 -0.61 1.22 0.15 -1.08 0.00 0.00 175.30 175.03 1q8y s LYS 163 N -3.71 4.39 -0.18 3.89 1.02 -1.26 0.02 119.74 123.91 1q8y s LYS 163 Ca 0.05 1.77 0.05 0.00 0.02 0.00 0.00 55.97 57.86 1q8y s LYS 163 Cb -0.02 -3.42 -0.22 0.00 -0.52 0.00 0.00 37.83 33.65 1q8y s LYS 163 CO -0.06 -0.34 0.11 1.28 -0.92 0.00 0.00 175.35 175.42 1q8y n LEU 164 N 4.39 1.95 -3.61 3.17 4.77 0.66 -4.84 117.00 123.49 1q8y n LEU 164 Ca 0.10 0.06 -0.07 0.00 -0.03 0.00 0.00 56.01 56.07 1q8y n LEU 164 Cb 0.46 -0.50 -0.02 0.00 -2.33 0.00 0.00 43.42 41.03 1q8y n LEU 164 CO 0.56 0.74 0.63 -0.83 -1.33 0.00 0.00 177.39 177.16 1q8y s GLY 165 N -5.86 -0.37 0.18 -0.72 0.00 -0.87 -5.00 107.32 94.68 1q8y s GLY 165 Ca -0.22 0.48 0.05 0.00 0.00 0.00 0.00 44.72 45.04 1q8y s GLY 165 CO 0.73 0.15 -0.10 -0.98 0.00 0.00 0.00 173.10 172.89 1q8y s TRP 166 N -3.36 1.44 0.27 1.90 0.51 -1.26 0.83 118.94 119.27 1q8y s TRP 166 Ca 0.07 -0.72 -0.04 0.00 -2.12 0.00 0.00 56.10 53.29 1q8y s TRP 166 Cb -0.02 -0.73 0.02 0.00 -0.81 0.00 0.00 33.47 31.93 1q8y s TRP 166 CO -0.04 0.15 0.43 0.41 -0.51 0.00 0.00 176.95 177.39 1q8y n GLY 167 N -0.28 2.06 0.16 0.98 0.00 0.20 -4.92 105.19 103.38 1q8y n GLY 167 Ca -0.09 -1.46 0.09 0.00 0.00 0.00 0.00 46.02 44.56 1q8y n GLY 167 CO 0.00 0.00 0.00 1.12 0.00 0.00 0.00 173.32 174.44 1q8y h HIS 168 N 1.75 0.00 0.00 1.61 -0.00 -2.03 -3.30 115.15 113.18 1q8y h HIS 168 Ca -0.22 0.00 -0.12 0.00 -0.00 0.00 0.00 60.37 60.03 1q8y h HIS 168 Cb 0.90 0.00 -0.02 0.00 -0.00 0.00 0.00 27.41 28.29 1q8y h HIS 168 CO 0.00 0.17 -1.67 0.34 -0.00 0.00 0.00 177.93 176.76 1q8y n PHE 169 N -2.98 0.53 -3.65 6.12 7.35 -1.26 -4.99 117.46 118.58 1q8y n PHE 169 Ca 0.01 0.17 0.00 0.00 -0.76 0.00 0.00 57.45 56.87 1q8y n PHE 169 Cb 0.61 -0.88 0.00 0.00 0.35 0.00 0.00 39.48 39.56 1q8y n PHE 169 CO 0.00 0.00 0.00 -1.13 -0.76 0.00 0.00 176.76 174.87 1q8y n SER 170 N -2.64 0.00 -4.03 -2.13 3.41 -1.25 -2.71 113.62 104.27 1q8y n SER 170 Ca -0.10 -0.88 -0.19 0.00 -0.26 0.00 0.00 58.87 57.44 1q8y n SER 170 Cb 0.76 0.00 -0.15 0.00 -0.26 0.00 0.00 64.21 64.56 1q8y n SER 170 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 1q8y s THR 171 N -2.23 0.78 -0.19 6.66 -4.23 -1.08 0.58 115.64 115.93 1q8y s THR 171 Ca 0.00 -0.40 -0.07 0.00 -1.18 0.00 0.00 61.69 60.03 1q8y s THR 171 Cb 0.00 -0.66 -0.04 0.00 1.34 0.00 0.00 72.50 73.14 1q8y s THR 171 CO 0.00 0.23 0.06 -0.69 -0.54 0.00 0.00 174.62 173.68 1q8y s VAL 172 N -0.12 4.70 0.09 2.29 1.01 0.24 -1.53 120.40 127.08 1q8y s VAL 172 Ca 0.02 -0.06 0.09 0.00 0.00 0.00 0.00 61.98 62.03 1q8y s VAL 172 Cb -0.05 -3.13 -0.04 0.00 0.00 0.00 0.00 36.38 33.17 1q8y s VAL 172 CO -0.00 0.44 -0.21 0.26 0.00 0.00 0.00 175.10 175.59 1q8y s TRP 173 N 0.54 2.47 -0.02 5.22 0.52 0.27 -0.24 118.94 127.70 1q8y s TRP 173 Ca 0.03 -0.30 -0.25 0.00 0.02 0.00 0.00 56.10 55.59 1q8y s TRP 173 Cb -0.13 -1.37 -0.04 0.00 -1.15 0.00 0.00 33.47 30.78 1q8y s TRP 173 CO 0.01 0.30 0.79 -1.17 0.02 0.00 0.00 176.95 176.90 1q8y s LEU 174 N -1.79 4.37 0.06 2.99 2.96 0.10 -0.14 118.68 127.23 1q8y s LEU 174 Ca 0.15 1.38 -0.02 0.00 -0.22 0.00 0.00 54.13 55.42 1q8y s LEU 174 Cb -0.10 -3.24 -0.04 0.00 0.50 0.00 0.00 46.19 43.31 1q8y s LEU 174 CO 0.07 -0.11 -0.00 0.00 -1.32 0.00 0.00 176.35 174.98 1q8y s ALA 175 N 0.59 0.46 -0.18 5.97 0.00 -0.00 -0.40 121.76 128.20 1q8y s ALA 175 Ca 0.41 -1.17 -0.09 0.00 0.00 0.00 0.00 51.96 51.12 1q8y s ALA 175 Cb -0.19 0.32 -0.05 0.00 0.00 0.00 0.00 23.12 23.20 1q8y s ALA 175 CO 0.22 -0.39 0.11 0.21 0.00 0.00 0.00 175.76 175.91 1q8y s LYS 176 N -3.92 3.95 -0.77 0.00 2.20 -0.24 -0.62 119.74 120.34 1q8y s LYS 176 Ca 0.08 -0.23 -0.20 0.00 -0.36 0.00 0.00 55.97 55.25 1q8y s LYS 176 Cb 0.08 -3.31 0.10 0.00 -1.51 0.00 0.00 37.83 33.19 1q8y s LYS 176 CO -0.10 0.41 0.99 0.34 -0.36 0.00 0.00 175.35 176.64 1q8y s ASP 177 N 0.02 6.38 0.38 1.43 -1.08 0.25 -1.74 116.67 122.31 1q8y s ASP 177 Ca 0.09 -1.54 0.23 0.00 -0.52 0.00 0.00 52.55 50.82 1q8y s ASP 177 Cb -0.11 -2.39 1.28 0.00 -1.46 0.00 0.00 42.92 40.24 1q8y s ASP 177 CO -0.00 -1.22 1.70 0.24 0.52 0.00 0.00 175.17 176.41 1q8y h MET 178 N 9.17 0.00 0.08 4.34 2.86 -0.82 0.68 114.93 131.23 1q8y h MET 178 Ca -0.09 0.00 -0.21 0.00 -2.06 0.00 0.00 59.70 57.33 1q8y h MET 178 Cb 1.05 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.71 1q8y h MET 178 CO 1.13 0.00 -1.09 0.28 1.06 0.00 0.00 176.91 178.29 1q8y h VAL 179 N 0.00 1.18 -0.02 -2.22 2.07 -1.90 -3.36 116.25 112.00 1q8y h VAL 179 Ca 0.00 -2.36 0.00 0.00 0.82 0.00 0.00 66.70 65.16 1q8y h VAL 179 Cb 0.14 2.78 0.00 0.00 -1.52 0.00 0.00 31.29 32.69 1q8y h VAL 179 CO 0.00 0.61 -0.22 0.59 0.02 0.00 0.00 177.57 178.58 1q8y n ASN 180 N -4.16 2.10 -1.91 0.57 3.02 -0.94 -4.94 115.26 109.01 1q8y n ASN 180 Ca -0.23 -1.57 -0.20 0.00 -0.03 0.00 0.00 54.58 52.55 1q8y n ASN 180 Cb 0.78 0.20 -0.06 0.00 -0.61 0.00 0.00 39.78 40.09 1q8y n ASN 180 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 1q8y n ASN 181 N 0.35 -5.50 -4.86 6.41 5.15 0.23 -4.96 115.26 112.08 1q8y n ASN 181 Ca 0.13 0.31 -0.26 0.00 -0.60 0.00 0.00 54.58 54.15 1q8y n ASN 181 Cb 0.47 -4.75 -0.02 0.00 -0.53 0.00 0.00 39.78 34.95 1q8y n ASN 181 CO 0.00 0.00 0.00 0.42 1.40 0.00 0.00 177.26 179.08 1q8y s THR 182 N -2.83 1.77 0.12 -0.44 -4.23 -1.13 -4.89 115.64 104.02 1q8y s THR 182 Ca 0.00 -1.56 0.05 0.00 -1.18 0.00 0.00 61.69 59.00 1q8y s THR 182 Cb 0.00 -2.33 -0.04 0.00 1.34 0.00 0.00 72.50 71.47 1q8y s THR 182 CO 0.00 0.00 0.06 -1.00 -0.54 0.00 0.00 174.62 173.14 1q8y s HIS 183 N -2.74 3.07 0.14 3.99 3.76 -1.26 0.86 115.29 123.13 1q8y s HIS 183 Ca 0.33 -0.01 -0.04 0.00 -0.15 0.00 0.00 55.06 55.20 1q8y s HIS 183 Cb -0.01 -1.53 -0.03 0.00 1.11 0.00 0.00 32.58 32.12 1q8y s HIS 183 CO 0.20 0.51 0.13 0.14 -0.85 0.00 0.00 174.74 174.87 1q8y s VAL 184 N -1.52 0.09 -0.20 -0.90 -7.23 0.21 -4.50 120.40 106.34 1q8y s VAL 184 Ca 0.29 -1.75 -0.04 0.00 -1.81 0.00 0.00 61.98 58.67 1q8y s VAL 184 Cb -0.11 -2.00 -0.02 0.00 0.56 0.00 0.00 36.38 34.81 1q8y s VAL 184 CO 0.21 -0.39 -0.03 0.00 -0.31 0.00 0.00 175.10 174.58 1q8y s ALA 185 N -4.03 2.89 -0.17 1.32 0.00 0.63 -0.82 121.76 121.58 1q8y s ALA 185 Ca 0.23 -1.05 -0.02 0.00 0.00 0.00 0.00 51.96 51.12 1q8y s ALA 185 Cb 0.06 -1.68 -0.01 0.00 0.00 0.00 0.00 23.12 21.49 1q8y s ALA 185 CO 0.02 -0.22 -0.10 -1.64 0.00 0.00 0.00 175.76 173.82 1q8y s MET 186 N 1.13 3.36 -0.48 0.00 -1.94 0.80 -0.53 119.30 121.63 1q8y s MET 186 Ca 0.02 -0.67 -0.19 0.00 -1.71 0.00 0.00 55.69 53.14 1q8y s MET 186 Cb -0.15 -2.79 0.04 0.00 2.01 0.00 0.00 34.83 33.95 1q8y s MET 186 CO 0.00 0.01 0.59 0.21 -0.01 0.00 0.00 175.02 175.83 1q8y s LYS 187 N 0.88 3.15 -0.41 2.03 2.20 0.57 -0.57 119.74 127.59 1q8y s LYS 187 Ca -0.03 -0.76 -0.16 0.00 -0.36 0.00 0.00 55.97 54.66 1q8y s LYS 187 Cb -0.15 -4.04 0.02 0.00 -1.51 0.00 0.00 37.83 32.15 1q8y s LYS 187 CO 0.00 -1.11 0.36 0.42 -0.36 0.00 0.00 175.35 174.67 1q8y s ILE 188 N 2.57 5.18 0.47 5.43 1.01 -0.58 -1.68 121.20 133.60 1q8y s ILE 188 Ca 0.16 -0.50 -0.20 0.00 0.00 0.00 0.00 60.65 60.11 1q8y s ILE 188 Cb -0.18 -3.98 -0.09 0.00 0.01 0.00 0.00 42.46 38.22 1q8y s ILE 188 CO 0.14 -0.36 1.00 -0.69 0.00 0.00 0.00 174.94 175.03 1q8y s VAL 189 N 1.90 4.07 0.31 2.92 1.01 -0.46 -2.62 120.40 127.54 1q8y s VAL 189 Ca 0.08 1.24 -0.29 0.00 0.00 0.00 0.00 61.98 63.02 1q8y s VAL 189 Cb -0.18 -3.52 -0.12 0.00 0.00 0.00 0.00 36.38 32.56 1q8y s VAL 189 CO 0.12 -0.32 1.40 -1.14 0.00 0.00 0.00 175.10 175.15 1q8y n ARG 190 N -0.97 2.29 -2.35 2.72 0.63 -1.10 -4.22 116.66 113.65 1q8y n ARG 190 Ca 0.08 0.81 -0.36 0.00 -0.92 0.00 0.00 57.85 57.46 1q8y n ARG 190 Cb 0.53 -2.46 -0.03 0.00 0.45 0.00 0.00 32.46 30.94 1q8y n ARG 190 CO 0.00 0.00 0.00 0.20 -2.51 0.00 0.00 177.63 175.32 1q8y s GLY 191 N 0.00 0.87 -0.05 5.14 0.00 -1.26 -4.53 107.32 107.50 1q8y s GLY 191 Ca 0.60 -2.17 -0.13 0.00 0.00 0.00 0.00 44.72 43.02 1q8y s GLY 191 CO 0.57 3.05 0.30 -0.35 0.00 0.00 0.00 173.10 176.67 1q8y s ASP 192 N 5.90 -0.22 0.12 1.64 -1.08 -1.26 -4.89 116.67 116.87 1q8y s ASP 192 Ca 0.58 0.24 -0.20 0.00 -0.52 0.00 0.00 52.55 52.64 1q8y s ASP 192 Cb -0.01 0.41 -0.07 0.00 -1.46 0.00 0.00 42.92 41.79 1q8y s ASP 192 CO -0.00 -0.34 1.75 0.50 0.52 0.00 0.00 175.17 177.60 1q8y h LYS 193 N 4.43 0.15 -0.52 4.34 1.63 -1.93 0.32 116.57 124.99 1q8y h LYS 193 Ca -0.29 -0.01 -0.08 0.00 -0.85 0.00 0.00 60.65 59.43 1q8y h LYS 193 Cb 1.18 -0.03 -0.02 0.00 -0.60 0.00 0.00 32.23 32.76 1q8y h LYS 193 CO 0.37 0.10 0.02 0.28 -3.45 0.00 0.00 179.45 176.77 1q8y h VAL 194 N 0.15 1.26 -0.67 2.00 2.07 -1.97 -1.89 116.25 117.20 1q8y h VAL 194 Ca 0.07 -1.05 -0.05 0.00 0.82 0.00 0.00 66.70 66.48 1q8y h VAL 194 Cb 0.03 0.92 -0.03 0.00 -1.52 0.00 0.00 31.29 30.69 1q8y h VAL 194 CO -0.06 0.37 0.23 1.88 0.02 0.00 0.00 177.57 180.02 1q8y h TYR 195 N 0.77 1.07 -0.49 1.57 0.05 -1.82 -1.85 116.97 116.26 1q8y h TYR 195 Ca 0.15 -0.10 -0.00 0.00 0.05 0.00 0.00 58.73 58.83 1q8y h TYR 195 Cb 0.49 -0.31 -0.02 0.00 1.01 0.00 0.00 36.73 37.90 1q8y h TYR 195 CO 0.04 0.85 0.30 1.15 -1.05 0.00 0.00 178.16 179.44 1q8y h THR 196 N 0.97 1.15 -0.78 -2.88 2.02 -0.15 0.08 112.91 113.32 1q8y h THR 196 Ca 0.22 -0.34 -0.01 0.00 0.77 0.00 0.00 66.41 67.05 1q8y h THR 196 Cb 0.27 0.49 -0.04 0.00 -1.74 0.00 0.00 68.15 67.13 1q8y h THR 196 CO -0.01 0.15 0.43 -0.33 0.37 0.00 0.00 175.52 176.13 1q8y h GLU 197 N 0.66 1.08 -0.47 6.66 5.08 -1.10 -0.86 114.58 125.63 1q8y h GLU 197 Ca 0.18 -0.12 -0.07 0.00 -1.00 0.00 0.00 59.36 58.35 1q8y h GLU 197 Cb -0.01 -0.21 -0.02 0.00 0.50 0.00 0.00 28.75 29.00 1q8y h GLU 197 CO -0.03 0.79 0.01 0.00 -1.00 0.00 0.00 179.01 178.78 1q8y h ALA 198 N 1.23 1.15 -0.52 3.43 0.00 -0.87 -2.58 119.26 121.10 1q8y h ALA 198 Ca 0.27 -0.25 -0.10 0.00 0.00 0.00 0.00 54.91 54.83 1q8y h ALA 198 Cb 0.02 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.60 1q8y h ALA 198 CO -0.05 0.55 -0.08 0.00 0.00 0.00 0.00 179.25 179.67 1q8y h ALA 199 N 1.30 0.87 -0.55 0.00 0.00 -0.31 -1.95 119.26 118.62 1q8y h ALA 199 Ca 0.14 -0.33 -0.00 0.00 0.00 0.00 0.00 54.91 54.72 1q8y h ALA 199 Cb 0.42 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.99 1q8y h ALA 199 CO 0.02 0.65 0.33 0.93 0.00 0.00 0.00 179.25 181.17 1q8y h GLU 200 N 0.85 0.74 -0.23 0.00 4.39 -0.84 0.20 114.58 119.69 1q8y h GLU 200 Ca 0.14 -0.06 -0.03 0.00 0.34 0.00 0.00 59.36 59.74 1q8y h GLU 200 Cb 0.62 -0.16 -0.01 0.00 -0.10 0.00 0.00 28.75 29.10 1q8y h GLU 200 CO 0.04 0.52 0.01 -0.44 -1.16 0.00 0.00 179.01 177.98 1q8y h ASP 201 N 0.76 0.39 -0.53 1.42 3.32 -1.06 -1.82 116.42 118.90 1q8y h ASP 201 Ca 0.20 -0.30 0.07 0.00 0.02 0.00 0.00 57.03 57.01 1q8y h ASP 201 Cb -0.02 -0.10 -0.06 0.00 0.22 0.00 0.00 39.33 39.37 1q8y h ASP 201 CO -0.04 0.59 0.22 -0.08 -1.72 0.00 0.00 179.24 178.21 1q8y h GLU 202 N 0.17 0.40 -0.94 3.56 4.81 -0.58 -0.48 114.58 121.52 1q8y h GLU 202 Ca 0.06 -0.02 0.04 0.00 -0.13 0.00 0.00 59.36 59.31 1q8y h GLU 202 Cb 0.39 -0.09 -0.06 0.00 0.63 0.00 0.00 28.75 29.63 1q8y h GLU 202 CO 0.01 0.27 0.62 0.82 -0.73 0.00 0.00 179.01 179.99 1q8y h ILE 203 N 0.42 1.15 -0.43 2.32 2.04 -0.80 0.95 117.51 123.15 1q8y h ILE 203 Ca 0.25 -0.40 -0.11 0.00 1.00 0.00 0.00 64.86 65.60 1q8y h ILE 203 Cb 0.25 -0.12 -0.02 0.00 -0.74 0.00 0.00 36.82 36.19 1q8y h ILE 203 CO -0.23 0.21 -0.17 0.11 0.00 0.00 0.00 178.15 178.08 1q8y h LYS 204 N 1.17 0.82 -0.38 2.37 1.57 -0.29 0.10 116.57 121.94 1q8y h LYS 204 Ca 0.38 -0.31 -0.09 0.00 -1.87 0.00 0.00 60.65 58.76 1q8y h LYS 204 Cb 0.03 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.28 1q8y h LYS 204 CO -0.12 0.93 -0.12 -0.07 -0.57 0.00 0.00 179.45 179.50 1q8y h LEU 205 N 0.73 0.76 -1.03 2.94 3.38 -0.28 -2.01 115.31 119.81 1q8y h LEU 205 Ca 0.11 -0.38 -0.06 0.00 0.09 0.00 0.00 57.88 57.64 1q8y h LEU 205 Cb 0.68 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 41.20 1q8y h LEU 205 CO 0.05 0.97 -0.00 -0.07 0.09 0.00 0.00 178.44 179.47 1q8y h LEU 206 N 0.55 0.66 -0.99 1.67 3.38 -0.64 -2.21 115.31 117.73 1q8y h LEU 206 Ca 0.09 -0.15 -0.11 0.00 0.09 0.00 0.00 57.88 57.81 1q8y h LEU 206 Cb 0.65 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 41.21 1q8y h LEU 206 CO 0.04 0.73 -0.50 1.56 0.09 0.00 0.00 178.44 180.37 1q8y h GLN 207 N 0.65 0.02 -0.59 1.13 4.20 -0.83 -2.29 115.11 117.41 1q8y h GLN 207 Ca 0.13 -0.01 -0.10 0.00 0.06 0.00 0.00 58.65 58.73 1q8y h GLN 207 Cb 0.41 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.17 1q8y h GLN 207 CO 0.02 0.51 -0.03 -0.09 -0.67 0.00 0.00 178.83 178.57 1q8y h ARG 208 N 0.02 1.06 -0.68 1.46 9.65 -0.84 -0.13 114.38 124.92 1q8y h ARG 208 Ca -0.00 -0.35 0.06 0.00 -1.10 0.00 0.00 59.98 58.59 1q8y h ARG 208 Cb 0.89 -0.09 -0.06 0.00 -1.39 0.00 0.00 29.97 29.32 1q8y h ARG 208 CO 0.07 1.05 0.38 0.28 2.80 0.00 0.00 179.97 184.54 1q8y h VAL 209 N 0.96 0.96 -0.27 0.20 2.07 -0.87 -1.52 116.25 117.77 1q8y h VAL 209 Ca 0.16 -0.24 -0.14 0.00 0.82 0.00 0.00 66.70 67.31 1q8y h VAL 209 Cb 0.59 0.21 -0.00 0.00 -1.52 0.00 0.00 31.29 30.57 1q8y h VAL 209 CO 0.04 0.13 -0.37 0.78 0.02 0.00 0.00 177.57 178.16 1q8y h ASN 210 N 0.69 0.79 0.59 0.57 2.35 -1.04 -3.27 115.58 116.26 1q8y h ASN 210 Ca 0.31 -0.51 -0.03 0.00 -0.55 0.00 0.00 56.30 55.52 1q8y h ASN 210 Cb 0.20 -0.22 -0.00 0.00 0.05 0.00 0.00 38.32 38.35 1q8y h ASN 210 CO -0.19 1.14 -0.13 0.44 -1.65 0.00 0.00 177.43 177.04 1q8y h ASP 211 N 0.46 0.00 -0.27 5.81 3.32 -0.60 -2.76 116.42 122.38 1q8y h ASP 211 Ca 0.03 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.08 1q8y h ASP 211 Cb 0.96 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.51 1q8y h ASP 211 CO 0.09 0.13 0.00 0.00 -1.72 0.00 0.00 179.24 177.74 1q8y n ALA 212 N -2.23 2.47 -2.96 3.45 0.00 -0.61 -4.70 120.51 115.93 1q8y n ALA 212 Ca -0.01 -0.76 -0.44 0.00 0.00 0.00 0.00 53.44 52.23 1q8y n ALA 212 Cb 0.30 -0.97 -0.01 0.00 0.00 0.00 0.00 19.45 18.77 1q8y n ALA 212 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1q8y s ASP 213 N -1.54 6.98 -0.03 0.00 2.15 -1.04 -4.70 116.67 118.49 1q8y s ASP 213 Ca 0.35 -2.80 -0.06 0.00 0.43 0.00 0.00 52.55 50.47 1q8y s ASP 213 Cb 0.20 -2.39 -0.03 0.00 -0.30 0.00 0.00 42.92 40.40 1q8y s ASP 213 CO 0.29 -0.80 -0.13 0.59 -0.17 0.00 0.00 175.17 174.94 1q8y n ASN 214 N 5.75 1.27 -4.86 -0.34 3.02 -1.26 -4.89 115.26 113.94 1q8y n ASN 214 Ca 0.33 0.19 -0.30 0.00 -0.03 0.00 0.00 54.58 54.77 1q8y n ASN 214 Cb 0.44 -0.45 0.06 0.00 -0.61 0.00 0.00 39.78 39.22 1q8y n ASN 214 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 1q8y s THR 215 N -2.31 3.41 0.43 3.41 -4.23 -1.26 -4.88 115.64 110.22 1q8y s THR 215 Ca -0.12 0.46 0.14 0.00 -1.18 0.00 0.00 61.69 60.99 1q8y s THR 215 Cb 0.03 -3.39 0.17 0.00 1.34 0.00 0.00 72.50 70.64 1q8y s THR 215 CO 0.17 -0.60 1.96 0.11 -0.54 0.00 0.00 174.62 175.72 1q8y h LYS 216 N -0.75 0.01 -0.18 3.99 1.57 -1.99 -0.30 116.57 118.92 1q8y h LYS 216 Ca -0.45 -0.00 -0.13 0.00 -1.87 0.00 0.00 60.65 58.20 1q8y h LYS 216 Cb 1.26 -0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.55 1q8y h LYS 216 CO 0.63 0.22 -0.42 1.49 -0.57 0.00 0.00 179.45 180.79 1q8y h GLU 217 N 0.01 0.43 0.13 3.15 4.81 -2.00 -2.20 114.58 118.90 1q8y h GLU 217 Ca -0.00 -0.22 -0.01 0.00 -0.13 0.00 0.00 59.36 59.01 1q8y h GLU 217 Cb 0.37 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.76 1q8y h GLU 217 CO 0.03 0.78 -0.06 -0.44 -0.73 0.00 0.00 179.01 178.58 1q8y h ASP 218 N 0.35 -0.15 -0.98 1.04 3.32 -1.47 -2.74 116.42 115.79 1q8y h ASP 218 Ca 0.03 -0.17 0.25 0.00 0.02 0.00 0.00 57.03 57.16 1q8y h ASP 218 Cb 0.89 0.04 -0.07 0.00 0.22 0.00 0.00 39.33 40.41 1q8y h ASP 218 CO 0.08 0.08 0.65 -1.28 -1.72 0.00 0.00 179.24 177.05 1q8y h SER 219 N -0.38 0.33 -0.95 6.45 0.87 -1.00 0.11 113.55 118.99 1q8y h SER 219 Ca -0.02 0.05 0.08 0.00 -1.23 0.00 0.00 61.79 60.67 1q8y h SER 219 Cb 0.31 -0.01 -0.07 0.00 -0.44 0.00 0.00 62.40 62.19 1q8y h SER 219 CO 0.03 0.10 0.61 0.24 -0.53 0.00 0.00 176.83 177.28 1q8y h MET 220 N 0.32 1.00 0.07 2.24 2.86 -1.08 -1.05 114.93 119.28 1q8y h MET 220 Ca 0.52 -0.06 -0.36 0.00 -2.06 0.00 0.00 59.70 57.74 1q8y h MET 220 Cb 1.46 -0.23 -0.04 0.00 0.06 0.00 0.00 31.60 32.85 1q8y h MET 220 CO -0.18 0.66 -2.12 0.41 1.06 0.00 0.00 176.91 176.74 1q8y n GLY 221 N -1.38 -0.59 0.35 8.32 0.00 -0.06 -4.29 105.19 107.54 1q8y n GLY 221 Ca 0.15 -0.23 0.11 0.00 0.00 0.00 0.00 46.02 46.06 1q8y n GLY 221 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1q8y h ALA 222 N 0.24 1.93 0.00 4.61 0.00 -0.73 -0.70 119.26 124.62 1q8y h ALA 222 Ca -0.46 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.44 1q8y h ALA 222 Cb 2.01 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 19.69 1q8y h ALA 222 CO 0.04 -0.06 0.00 0.09 0.00 0.00 0.00 179.25 179.31 1q8y n ASN 223 N -4.48 0.00 -0.61 0.00 3.02 -0.41 -2.49 115.26 110.29 1q8y n ASN 223 Ca 0.10 -0.48 0.05 0.00 -0.03 0.00 0.00 54.58 54.23 1q8y n ASN 223 Cb 0.34 -0.04 0.20 0.00 -0.61 0.00 0.00 39.78 39.67 1q8y n ASN 223 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 1q8y n HIS 224 N -1.04 0.12 -4.18 3.10 8.25 -0.27 -4.85 115.22 116.35 1q8y n HIS 224 Ca 0.13 -1.46 -0.21 0.00 -0.26 0.00 0.00 57.72 55.92 1q8y n HIS 224 Cb 0.07 -0.27 -0.16 0.00 1.12 0.00 0.00 29.99 30.75 1q8y n HIS 224 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 1q8y s ILE 225 N -3.21 0.61 -0.14 1.59 1.01 -1.04 -0.02 121.20 120.00 1q8y s ILE 225 Ca 0.38 -0.15 -0.29 0.00 0.00 0.00 0.00 60.65 60.59 1q8y s ILE 225 Cb 0.37 -0.63 -0.06 0.00 0.01 0.00 0.00 42.46 42.14 1q8y s ILE 225 CO -0.05 0.25 2.13 -0.22 0.00 0.00 0.00 174.94 177.04 1q8y s LEU 226 N 0.99 3.75 0.11 2.97 2.96 0.30 -4.80 118.68 124.96 1q8y s LEU 226 Ca -0.10 2.12 -0.23 0.00 -0.22 0.00 0.00 54.13 55.70 1q8y s LEU 226 Cb -0.14 -3.52 -0.07 0.00 0.50 0.00 0.00 46.19 42.96 1q8y s LEU 226 CO -0.00 -1.68 0.70 -0.54 -1.32 0.00 0.00 176.35 173.51 1q8y s LYS 227 N 5.75 4.43 -0.05 1.98 1.02 -1.26 -4.96 119.74 126.64 1q8y s LYS 227 Ca 0.96 0.99 -0.30 0.00 0.02 0.00 0.00 55.97 57.64 1q8y s LYS 227 Cb -0.36 -3.27 -0.04 0.00 -0.52 0.00 0.00 37.83 33.65 1q8y s LYS 227 CO 0.37 0.55 1.25 -1.17 -0.92 0.00 0.00 175.35 175.43 1q8y s LEU 228 N -0.95 4.28 -0.15 3.17 2.96 -1.26 -4.49 118.68 122.25 1q8y s LEU 228 Ca 0.34 1.87 0.16 0.00 -0.22 0.00 0.00 54.13 56.28 1q8y s LEU 228 Cb -0.21 -3.56 -0.24 0.00 0.50 0.00 0.00 46.19 42.68 1q8y s LEU 228 CO 0.23 -0.63 0.28 0.18 -1.32 0.00 0.00 176.35 175.09 1q8y n LEU 229 N 5.38 0.32 -3.57 -0.68 4.77 0.19 -5.01 117.00 118.40 1q8y n LEU 229 Ca 0.12 0.15 -0.06 0.00 -0.03 0.00 0.00 56.01 56.19 1q8y n LEU 229 Cb 0.45 0.38 -0.02 0.00 -2.33 0.00 0.00 43.42 41.90 1q8y n LEU 229 CO 0.56 0.46 0.86 -0.62 -1.33 0.00 0.00 177.39 177.32 1q8y s ASP 230 N -5.71 -0.23 -0.01 -1.43 2.15 -1.16 -4.99 116.67 105.30 1q8y s ASP 230 Ca -0.08 -0.03 -0.23 0.00 0.43 0.00 0.00 52.55 52.63 1q8y s ASP 230 Cb 0.07 0.27 0.05 0.00 -0.30 0.00 0.00 42.92 43.00 1q8y s ASP 230 CO 0.83 -0.44 0.52 -1.38 -0.17 0.00 0.00 175.17 174.52 1q8y s HIS 231 N -2.77 -0.44 0.08 -5.34 -3.43 -1.26 0.52 115.29 102.65 1q8y s HIS 231 Ca 0.08 0.65 -0.27 0.00 -0.80 0.00 0.00 55.06 54.73 1q8y s HIS 231 Cb -0.01 0.29 0.08 0.00 -1.43 0.00 0.00 32.58 31.52 1q8y s HIS 231 CO -0.06 -0.56 0.89 -0.59 -2.00 0.00 0.00 174.74 172.43 1q8y s PHE 232 N -1.67 -0.27 -0.18 0.38 -0.12 -0.29 -4.99 117.98 110.84 1q8y s PHE 232 Ca -0.10 0.05 -0.16 0.00 -0.05 0.00 0.00 56.93 56.67 1q8y s PHE 232 Cb -0.02 0.59 -0.04 0.00 -0.63 0.00 0.00 43.02 42.92 1q8y s PHE 232 CO 0.04 -0.70 0.41 -0.80 -0.05 0.00 0.00 175.22 174.13 1q8y s ASN 233 N -2.70 6.49 -0.21 1.98 0.01 -1.26 -0.54 114.94 118.71 1q8y s ASN 233 Ca 0.08 0.58 -0.09 0.00 -0.71 0.00 0.00 52.86 52.72 1q8y s ASN 233 Cb -0.01 -2.24 -0.04 0.00 0.41 0.00 0.00 41.25 39.36 1q8y s ASN 233 CO -0.04 -0.05 0.11 -2.28 -1.51 0.00 0.00 177.10 173.32 1q8y s HIS 234 N 1.13 3.28 -0.14 2.20 5.65 0.16 -4.87 115.29 122.70 1q8y s HIS 234 Ca 0.20 0.12 -0.29 0.00 0.25 0.00 0.00 55.06 55.34 1q8y s HIS 234 Cb -0.15 -2.17 -0.02 0.00 -1.18 0.00 0.00 32.58 29.07 1q8y s HIS 234 CO 0.08 0.10 1.28 0.15 -0.65 0.00 0.00 174.74 175.70 1q8y s LYS 235 N 0.70 4.24 0.32 2.88 1.02 -1.26 -0.71 119.74 126.93 1q8y s LYS 235 Ca 0.06 1.70 0.10 0.00 0.02 0.00 0.00 55.97 57.84 1q8y s LYS 235 Cb -0.13 -3.75 -0.06 0.00 -0.52 0.00 0.00 37.83 33.37 1q8y s LYS 235 CO 0.02 -0.68 -0.13 0.20 -0.92 0.00 0.00 175.35 173.83 1q8y s GLY 236 N 1.99 2.07 0.43 -3.33 0.00 0.03 -4.96 107.32 103.57 1q8y s GLY 236 Ca 0.56 -2.01 0.11 0.00 0.00 0.00 0.00 44.72 43.38 1q8y s GLY 236 CO 0.16 -2.00 2.05 -0.56 0.00 0.00 0.00 173.10 172.75 1q8y h PRO 237 N 2.12 0.41 -0.43 2.90 0.13 -1.98 -1.79 132.00 133.36 1q8y h PRO 237 Ca -0.41 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 64.69 1q8y h PRO 237 Cb 1.25 -0.09 0.00 0.00 0.13 0.00 0.00 31.00 32.29 1q8y h PRO 237 CO 0.67 0.27 0.00 0.27 -0.23 0.00 0.00 178.00 178.98 1q8y n ASN 238 N -4.48 3.15 0.00 1.44 2.04 -1.26 -5.06 115.26 111.09 1q8y n ASN 238 Ca 0.05 -1.95 0.00 0.00 -0.44 0.00 0.00 54.58 52.23 1q8y n ASN 238 Cb 0.17 -0.28 0.00 0.00 -2.53 0.00 0.00 39.78 37.15 1q8y n ASN 238 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 1q8y n GLY 239 N 1.45 0.76 3.75 4.83 0.00 -0.68 -4.97 105.19 110.34 1q8y n GLY 239 Ca 0.19 -2.13 -0.40 0.00 0.00 0.00 0.00 46.02 43.68 1q8y n GLY 239 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1q8y s VAL 240 N -0.97 4.07 -0.08 1.61 1.01 -1.26 -0.79 120.40 124.00 1q8y s VAL 240 Ca 0.00 2.08 0.04 0.00 0.00 0.00 0.00 61.98 64.10 1q8y s VAL 240 Cb 0.00 -4.32 -0.00 0.00 0.00 0.00 0.00 36.38 32.06 1q8y s VAL 240 CO 0.00 0.49 -0.22 -1.00 0.00 0.00 0.00 175.10 174.37 1q8y s HIS 241 N -1.20 2.27 0.12 5.22 0.09 0.11 -4.25 115.29 117.65 1q8y s HIS 241 Ca 0.41 -0.83 -0.27 0.00 -0.00 0.00 0.00 55.06 54.37 1q8y s HIS 241 Cb -0.26 -1.53 -0.07 0.00 -0.00 0.00 0.00 32.58 30.73 1q8y s HIS 241 CO 0.32 -0.32 0.85 0.08 -0.00 0.00 0.00 174.74 175.67 1q8y s VAL 242 N 0.22 4.49 -0.05 -0.90 1.01 -1.26 0.36 120.40 124.28 1q8y s VAL 242 Ca -0.13 1.84 0.04 0.00 0.00 0.00 0.00 61.98 63.73 1q8y s VAL 242 Cb -0.16 -4.21 -0.00 0.00 0.00 0.00 0.00 36.38 32.01 1q8y s VAL 242 CO 0.06 0.40 -0.16 -0.69 0.00 0.00 0.00 175.10 174.71 1q8y s VAL 243 N -0.43 1.39 -0.09 2.92 1.01 0.30 -1.35 120.40 124.15 1q8y s VAL 243 Ca 0.41 -0.68 0.02 0.00 0.00 0.00 0.00 61.98 61.73 1q8y s VAL 243 Cb -0.23 -1.21 -0.02 0.00 0.00 0.00 0.00 36.38 34.93 1q8y s VAL 243 CO 0.27 0.40 -0.15 -0.04 0.00 0.00 0.00 175.10 175.58 1q8y s MET 244 N 0.16 2.94 -0.16 2.72 -1.94 -0.68 -1.14 119.30 121.20 1q8y s MET 244 Ca -0.06 -0.72 -0.04 0.00 -1.71 0.00 0.00 55.69 53.16 1q8y s MET 244 Cb -0.12 -2.47 -0.03 0.00 2.01 0.00 0.00 34.83 34.22 1q8y s MET 244 CO 0.03 0.39 -0.04 0.08 -0.01 0.00 0.00 175.02 175.48 1q8y s VAL 245 N -0.14 3.88 0.29 -6.03 1.01 0.18 -0.31 120.40 119.29 1q8y s VAL 245 Ca -0.01 -0.36 0.02 0.00 0.00 0.00 0.00 61.98 61.63 1q8y s VAL 245 Cb -0.14 -2.70 -0.05 0.00 0.00 0.00 0.00 36.38 33.49 1q8y s VAL 245 CO 0.04 0.49 0.10 -0.36 0.00 0.00 0.00 175.10 175.37 1q8y s PHE 246 N 0.40 1.66 0.62 5.22 0.40 0.31 0.54 117.98 127.13 1q8y s PHE 246 Ca -0.04 -1.18 -0.12 0.00 -0.60 0.00 0.00 56.93 55.00 1q8y s PHE 246 Cb -0.14 -1.00 -0.04 0.00 0.51 0.00 0.00 43.02 42.35 1q8y s PHE 246 CO 0.03 -0.29 1.03 -1.83 0.70 0.00 0.00 175.22 174.86 1q8y s GLU 247 N -3.94 3.53 0.01 0.44 -1.05 -1.26 -0.27 118.70 116.17 1q8y s GLU 247 Ca 0.36 0.82 -0.30 0.00 -0.15 0.00 0.00 54.97 55.70 1q8y s GLU 247 Cb 0.07 -2.07 -0.04 0.00 -0.44 0.00 0.00 34.13 31.65 1q8y s GLU 247 CO 0.15 -0.62 1.04 0.08 0.95 0.00 0.00 175.26 176.86 1q8y s VAL 248 N -3.07 4.65 -0.45 1.83 1.01 -1.26 -4.33 120.40 118.78 1q8y s VAL 248 Ca 0.56 1.91 0.03 0.00 0.00 0.00 0.00 61.98 64.48 1q8y s VAL 248 Cb -0.11 -4.22 0.16 0.00 0.00 0.00 0.00 36.38 32.20 1q8y s VAL 248 CO 0.51 0.14 0.31 -0.22 0.00 0.00 0.00 175.10 175.84 1q8y s LEU 249 N 1.10 2.11 0.00 3.92 2.96 -1.26 -5.02 118.68 122.50 1q8y s LEU 249 Ca 0.53 -2.90 0.00 0.00 -0.22 0.00 0.00 54.13 51.55 1q8y s LEU 249 Cb -0.23 -0.74 0.00 0.00 0.50 0.00 0.00 46.19 45.72 1q8y s LEU 249 CO 0.28 -0.21 0.00 0.61 -1.32 0.00 0.00 176.35 175.71 1q8y n GLY 250 N 3.13 0.71 3.75 7.98 0.00 -1.18 -4.08 105.19 115.50 1q8y n GLY 250 Ca 0.20 -0.23 -0.25 0.00 0.00 0.00 0.00 46.02 45.74 1q8y n GLY 250 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1q8y s GLU 251 N 0.00 2.25 0.73 1.61 2.02 -1.09 -4.83 118.70 119.38 1q8y s GLU 251 Ca 0.00 -1.84 -0.09 0.00 0.02 0.00 0.00 54.97 53.06 1q8y s GLU 251 Cb 0.00 -2.01 0.05 0.00 0.10 0.00 0.00 34.13 32.28 1q8y s GLU 251 CO 0.00 -0.14 1.07 0.54 0.02 0.00 0.00 175.26 176.75 1q8y s ASN 252 N -3.93 4.89 0.41 -0.19 2.20 -1.26 -0.87 114.94 116.19 1q8y s ASN 252 Ca 0.41 0.70 0.29 0.00 -0.94 0.00 0.00 52.86 53.31 1q8y s ASN 252 Cb 0.03 -1.36 1.45 0.00 -2.00 0.00 0.00 41.25 39.37 1q8y s ASN 252 CO 0.23 -1.61 1.87 -0.07 -2.94 0.00 0.00 177.10 174.58 1q8y h LEU 253 N -0.72 0.00 -0.79 3.54 4.07 -1.02 -2.34 115.31 118.05 1q8y h LEU 253 Ca -0.45 0.00 -0.03 0.00 0.08 0.00 0.00 57.88 57.48 1q8y h LEU 253 Cb 1.30 0.00 -0.04 0.00 1.08 0.00 0.00 40.66 43.01 1q8y h LEU 253 CO 0.63 0.00 0.37 0.25 -1.08 0.00 0.00 178.44 178.61 1q8y h LEU 254 N 0.00 1.05 -0.39 1.67 6.46 -1.86 -0.68 115.31 121.55 1q8y h LEU 254 Ca 0.00 -0.14 -0.07 0.00 -0.12 0.00 0.00 57.88 57.55 1q8y h LEU 254 Cb 0.12 -0.27 -0.01 0.00 -0.73 0.00 0.00 40.66 39.77 1q8y h LEU 254 CO 0.00 0.90 -0.03 0.00 -0.62 0.00 0.00 178.44 178.69 1q8y h ALA 255 N 1.19 0.53 -0.86 1.25 0.00 -1.79 -1.58 119.26 118.00 1q8y h ALA 255 Ca 0.27 -0.27 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 1q8y h ALA 255 Cb 0.14 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 17.75 1q8y h ALA 255 CO -0.03 0.33 0.49 1.25 0.00 0.00 0.00 179.25 181.29 1q8y h LEU 256 N 0.53 1.06 0.07 0.00 5.85 -1.52 0.81 115.31 122.10 1q8y h LEU 256 Ca 0.11 -0.09 -0.00 0.00 0.84 0.00 0.00 57.88 58.74 1q8y h LEU 256 Cb 0.52 -0.27 0.00 0.00 0.37 0.00 0.00 40.66 41.28 1q8y h LEU 256 CO 0.03 0.84 -0.03 0.40 -0.34 0.00 0.00 178.44 179.33 1q8y h ILE 257 N 1.19 1.02 -0.78 4.05 2.04 -0.98 -2.51 117.51 121.55 1q8y h ILE 257 Ca 0.31 -0.31 -0.02 0.00 1.00 0.00 0.00 64.86 65.83 1q8y h ILE 257 Cb -0.00 1.23 -0.04 0.00 -0.74 0.00 0.00 36.82 37.27 1q8y h ILE 257 CO -0.05 0.08 0.40 0.11 0.00 0.00 0.00 178.15 178.69 1q8y h LYS 258 N -0.23 1.10 -0.96 2.37 1.57 -0.91 -2.00 116.57 117.50 1q8y h LYS 258 Ca -0.01 -0.14 0.17 0.00 -1.87 0.00 0.00 60.65 58.80 1q8y h LYS 258 Cb 0.20 -0.21 -0.09 0.00 0.08 0.00 0.00 32.23 32.22 1q8y h LYS 258 CO 0.02 0.83 0.61 -0.22 -0.57 0.00 0.00 179.45 180.11 1q8y h LYS 259 N 1.10 0.71 -0.88 3.15 3.64 0.95 0.22 116.57 125.45 1q8y h LYS 259 Ca 0.27 -0.04 -0.21 0.00 -1.27 0.00 0.00 60.65 59.40 1q8y h LYS 259 Cb 0.07 -0.16 -0.12 0.00 -0.41 0.00 0.00 32.23 31.60 1q8y h LYS 259 CO -0.04 0.47 0.27 0.66 -2.27 0.00 0.00 179.45 178.53 1q8y n TYR 260 N -4.63 1.83 -3.90 1.91 4.02 -0.79 -4.91 117.16 110.69 1q8y n TYR 260 Ca 0.20 -1.04 -0.31 0.00 -0.01 0.00 0.00 57.90 56.74 1q8y n TYR 260 Cb 0.53 -0.59 -0.01 0.00 -0.02 0.00 0.00 39.34 39.25 1q8y n TYR 260 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 176.86 176.24 1q8y n GLU 261 N -0.19 -3.79 -1.32 -0.72 1.02 0.77 -1.16 120.64 115.23 1q8y n GLU 261 Ca 0.32 0.45 -0.11 0.00 -0.02 0.00 0.00 57.16 57.80 1q8y n GLU 261 Cb 1.14 -5.22 -0.05 0.00 -0.02 0.00 0.00 31.44 27.29 1q8y n GLU 261 CO 0.00 0.00 0.00 0.72 1.18 0.00 0.00 177.13 179.03 1q8y n HIS 262 N -4.32 -0.45 0.14 -0.32 8.25 -1.01 -4.77 115.22 112.75 1q8y n HIS 262 Ca 0.05 0.00 0.09 0.00 -0.26 0.00 0.00 57.72 57.60 1q8y n HIS 262 Cb 0.51 -2.36 0.06 0.00 1.12 0.00 0.00 29.99 29.32 1q8y n HIS 262 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1q8y h ARG 263 N 0.00 0.00 0.00 -0.41 3.08 -1.35 -3.37 114.38 112.33 1q8y h ARG 263 Ca -0.23 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.82 1q8y h ARG 263 Cb 0.75 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.80 1q8y h ARG 263 CO 0.34 0.09 0.00 0.41 -1.07 0.00 0.00 179.97 179.74 1q8y n GLY 264 N 1.18 3.91 3.84 0.04 0.00 -1.22 -4.55 105.19 108.39 1q8y n GLY 264 Ca 0.01 -1.46 -0.37 0.00 0.00 0.00 0.00 46.02 44.20 1q8y n GLY 264 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1q8y s ILE 265 N -1.51 5.35 0.16 -0.61 1.01 0.02 -4.90 121.20 120.71 1q8y s ILE 265 Ca 0.00 0.41 -0.34 0.00 0.00 0.00 0.00 60.65 60.73 1q8y s ILE 265 Cb 0.00 -3.52 -0.16 0.00 0.01 0.00 0.00 42.46 38.80 1q8y s ILE 265 CO 0.00 0.56 1.25 -2.65 0.00 0.00 0.00 174.94 174.11 1q8y n PRO 266 N 2.28 1.30 -0.06 2.79 -0.02 -1.26 -4.69 135.00 135.34 1q8y n PRO 266 Ca -0.17 0.46 0.13 0.00 -2.02 0.00 0.00 63.50 61.90 1q8y n PRO 266 Cb 0.54 -2.03 0.53 0.00 -0.02 0.00 0.00 33.50 32.53 1q8y n PRO 266 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 1q8y h LEU 267 N 3.87 0.30 -1.99 2.45 3.38 -1.96 -0.52 115.31 120.83 1q8y h LEU 267 Ca -0.45 0.01 0.14 0.00 0.09 0.00 0.00 57.88 57.67 1q8y h LEU 267 Cb 1.33 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 42.01 1q8y h LEU 267 CO 0.73 0.18 0.34 0.16 0.09 0.00 0.00 178.44 179.94 1q8y h ILE 268 N 0.33 0.77 0.12 1.22 3.07 -1.99 0.50 117.51 121.52 1q8y h ILE 268 Ca 0.26 -0.00 -0.31 0.00 1.55 0.00 0.00 64.86 66.36 1q8y h ILE 268 Cb 0.59 0.76 -0.01 0.00 -0.27 0.00 0.00 36.82 37.90 1q8y h ILE 268 CO -0.06 0.00 -1.61 1.88 -1.05 0.00 0.00 178.15 177.30 1q8y h TYR 269 N 0.01 0.45 -0.50 0.16 -1.99 -1.46 -3.32 116.97 110.31 1q8y h TYR 269 Ca 0.22 -0.33 0.06 0.00 2.00 0.00 0.00 58.73 60.69 1q8y h TYR 269 Cb 0.89 -0.02 -0.05 0.00 2.00 0.00 0.00 36.73 39.55 1q8y h TYR 269 CO -0.00 1.63 0.22 0.28 -0.00 0.00 0.00 178.16 180.29 1q8y h VAL 270 N -0.22 0.90 -0.86 -2.88 2.07 -0.75 -1.43 116.25 113.08 1q8y h VAL 270 Ca -0.35 -0.15 -0.01 0.00 0.82 0.00 0.00 66.70 67.01 1q8y h VAL 270 Cb 1.84 0.43 -0.04 0.00 -1.52 0.00 0.00 31.29 31.99 1q8y h VAL 270 CO 0.05 0.08 0.48 0.11 0.02 0.00 0.00 177.57 178.32 1q8y h LYS 271 N 0.43 1.19 -0.64 1.57 1.57 -1.11 0.12 116.57 119.70 1q8y h LYS 271 Ca 0.23 -0.13 -0.07 0.00 -1.87 0.00 0.00 60.65 58.81 1q8y h LYS 271 Cb 0.20 -0.24 -0.03 0.00 0.08 0.00 0.00 32.23 32.24 1q8y h LYS 271 CO -0.20 0.86 0.12 1.96 -0.57 0.00 0.00 179.45 181.62 1q8y h GLN 272 N 1.20 1.06 -0.21 3.15 4.20 -1.52 -0.42 115.11 122.56 1q8y h GLN 272 Ca 0.30 -0.28 -0.03 0.00 0.06 0.00 0.00 58.65 58.71 1q8y h GLN 272 Cb 0.01 -0.13 -0.01 0.00 0.30 0.00 0.00 27.48 27.65 1q8y h GLN 272 CO -0.05 0.97 0.01 0.82 -0.67 0.00 0.00 178.83 179.91 1q8y h ILE 273 N 0.98 1.25 0.11 2.54 2.04 -0.72 -2.32 117.51 121.37 1q8y h ILE 273 Ca 0.20 -0.84 -0.01 0.00 1.00 0.00 0.00 64.86 65.21 1q8y h ILE 273 Cb 0.42 1.38 0.00 0.00 -0.74 0.00 0.00 36.82 37.88 1q8y h ILE 273 CO 0.01 0.26 -0.05 0.28 0.00 0.00 0.00 178.15 178.65 1q8y h SER 274 N 0.15 -0.12 -0.74 1.72 0.02 -0.62 0.13 113.55 114.09 1q8y h SER 274 Ca 0.06 -0.01 -0.05 0.00 -0.84 0.00 0.00 61.79 60.96 1q8y h SER 274 Cb 0.38 0.03 -0.03 0.00 0.14 0.00 0.00 62.40 62.91 1q8y h SER 274 CO 0.01 -0.07 0.29 0.50 -1.14 0.00 0.00 176.83 176.42 1q8y h LYS 275 N -0.16 1.12 -0.32 3.45 3.64 -1.11 -1.31 116.57 121.89 1q8y h LYS 275 Ca -0.01 -0.20 -0.15 0.00 -1.27 0.00 0.00 60.65 59.02 1q8y h LYS 275 Cb 0.12 -0.18 -0.01 0.00 -0.41 0.00 0.00 32.23 31.75 1q8y h LYS 275 CO 0.02 0.92 -0.39 1.96 -2.27 0.00 0.00 179.45 179.69 1q8y h GLN 276 N 1.09 0.75 -0.35 1.90 4.20 -1.29 -1.97 115.11 119.44 1q8y h GLN 276 Ca 0.25 -0.39 -0.01 0.00 0.06 0.00 0.00 58.65 58.56 1q8y h GLN 276 Cb 0.22 0.01 -0.02 0.00 0.30 0.00 0.00 27.48 28.00 1q8y h GLN 276 CO -0.02 1.01 0.17 1.25 -0.67 0.00 0.00 178.83 180.57 1q8y h LEU 277 N 0.62 0.45 -0.68 1.46 6.46 -0.62 -1.64 115.31 121.35 1q8y h LEU 277 Ca 0.05 -0.12 -0.04 0.00 -0.12 0.00 0.00 57.88 57.65 1q8y h LEU 277 Cb 0.94 -0.12 -0.03 0.00 -0.73 0.00 0.00 40.66 40.72 1q8y h LEU 277 CO 0.09 0.44 0.27 -0.07 -0.62 0.00 0.00 178.44 178.54 1q8y h LEU 278 N 0.43 0.95 -0.41 2.25 3.38 -1.16 0.28 115.31 121.02 1q8y h LEU 278 Ca 0.12 -0.18 0.02 0.00 0.09 0.00 0.00 57.88 57.93 1q8y h LEU 278 Cb 0.10 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.58 1q8y h LEU 278 CO -0.02 0.87 0.25 -0.07 0.09 0.00 0.00 178.44 179.56 1q8y h LEU 279 N 0.97 0.40 -0.14 1.67 3.38 -1.12 0.43 115.31 120.90 1q8y h LEU 279 Ca 0.23 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.19 1q8y h LEU 279 Cb 0.22 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 40.88 1q8y h LEU 279 CO -0.02 0.29 0.06 1.23 0.09 0.00 0.00 178.44 180.10 1q8y h GLY 280 N 0.50 0.22 1.13 0.83 0.00 -0.89 -2.10 103.07 102.76 1q8y h GLY 280 Ca 0.16 -0.11 -0.00 0.00 0.00 0.00 0.00 47.33 47.37 1q8y h GLY 280 CO -0.07 0.11 0.52 1.41 0.00 0.00 0.00 176.54 178.51 1q8y h LEU 281 N 0.09 1.02 -0.75 3.11 3.38 -0.69 -0.59 115.31 120.89 1q8y h LEU 281 Ca 0.05 -0.06 -0.01 0.00 0.09 0.00 0.00 57.88 57.95 1q8y h LEU 281 Cb 0.14 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 40.59 1q8y h LEU 281 CO -0.01 0.79 0.44 -0.78 0.09 0.00 0.00 178.44 178.97 1q8y h ASP 282 N 1.18 0.91 -0.10 -0.43 3.58 -0.76 0.81 116.42 121.61 1q8y h ASP 282 Ca 0.31 -0.07 -0.01 0.00 0.42 0.00 0.00 57.03 57.68 1q8y h ASP 282 Cb -0.05 -0.23 -0.00 0.00 1.72 0.00 0.00 39.33 40.76 1q8y h ASP 282 CO -0.06 0.72 0.04 0.22 -2.88 0.00 0.00 179.24 177.28 1q8y h TYR 283 N 1.02 0.16 0.00 0.28 3.20 -0.69 -1.14 116.97 119.80 1q8y h TYR 283 Ca 0.27 -0.01 0.02 0.00 3.14 0.00 0.00 58.73 62.14 1q8y h TYR 283 Cb -0.01 -0.05 -0.02 0.00 1.54 0.00 0.00 36.73 38.19 1q8y h TYR 283 CO -0.01 0.27 -0.10 0.52 -1.64 0.00 0.00 178.16 177.21 1q8y h MET 284 N -0.00 -0.16 0.09 1.82 2.86 -0.70 -0.31 114.93 118.53 1q8y h MET 284 Ca 0.03 0.01 -0.00 0.00 -2.06 0.00 0.00 59.70 57.68 1q8y h MET 284 Cb 0.18 0.04 0.00 0.00 0.06 0.00 0.00 31.60 31.88 1q8y h MET 284 CO -0.00 -0.11 -0.04 0.45 1.06 0.00 0.00 176.91 178.27 1q8y h HIS 285 N -0.17 -0.11 0.18 -0.22 3.86 -0.82 0.40 115.15 118.27 1q8y h HIS 285 Ca 0.04 -0.00 -0.35 0.00 -1.16 0.00 0.00 60.37 58.89 1q8y h HIS 285 Cb 0.21 0.04 0.01 0.00 1.06 0.00 0.00 27.41 28.73 1q8y h HIS 285 CO -0.16 0.20 -1.75 0.00 0.86 0.00 0.00 177.93 177.08 1q8y h ARG 286 N -0.43 0.39 0.04 2.45 3.08 -1.26 -3.20 114.38 115.44 1q8y h ARG 286 Ca -0.01 -0.66 -0.27 0.00 0.07 0.00 0.00 59.98 59.11 1q8y h ARG 286 Cb 0.37 0.25 -0.03 0.00 0.08 0.00 0.00 29.97 30.64 1q8y h ARG 286 CO 0.02 1.31 -1.45 -0.09 -1.07 0.00 0.00 179.97 178.69 1q8y h ARG 287 N 0.11 0.08 0.07 0.04 9.65 -1.24 -3.41 114.38 119.68 1q8y h ARG 287 Ca -0.34 -0.14 -0.28 0.00 -1.10 0.00 0.00 59.98 58.12 1q8y h ARG 287 Cb 2.10 0.05 -0.02 0.00 -1.39 0.00 0.00 29.97 30.71 1q8y h ARG 287 CO 0.18 1.07 -1.44 0.00 2.80 0.00 0.00 179.97 182.58 1q8y n GLY 289 N 1.57 0.38 3.31 0.00 0.00 0.12 -4.99 105.19 105.57 1q8y n GLY 289 Ca -0.12 -0.75 -0.31 0.00 0.00 0.00 0.00 46.02 44.83 1q8y n GLY 289 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1q8y s ILE 290 N -2.28 2.16 -0.12 -0.61 1.01 -0.13 -1.41 121.20 119.82 1q8y s ILE 290 Ca 0.01 -1.05 -0.03 0.00 0.00 0.00 0.00 60.65 59.59 1q8y s ILE 290 Cb -0.01 -1.77 -0.03 0.00 0.01 0.00 0.00 42.46 40.66 1q8y s ILE 290 CO 0.01 0.58 -0.02 -0.63 0.00 0.00 0.00 174.94 174.88 1q8y s ILE 291 N -0.39 4.08 -0.02 2.92 1.01 -0.47 -3.62 121.20 124.70 1q8y s ILE 291 Ca 0.03 -0.31 -0.22 0.00 0.00 0.00 0.00 60.65 60.15 1q8y s ILE 291 Cb -0.12 -2.75 -0.23 0.00 0.01 0.00 0.00 42.46 39.37 1q8y s ILE 291 CO 0.01 0.54 1.07 -0.74 0.00 0.00 0.00 174.94 175.83 1q8y h HIS 292 N 5.97 0.45 0.00 3.97 -0.00 -1.90 -1.14 115.15 122.49 1q8y h HIS 292 Ca -0.41 -0.24 0.00 0.00 -0.00 0.00 0.00 60.37 59.72 1q8y h HIS 292 Cb 1.19 -0.05 0.00 0.00 -0.00 0.00 0.00 27.41 28.54 1q8y h HIS 292 CO 0.57 1.05 0.00 0.25 -0.00 0.00 0.00 177.93 179.80 1q8y n THR 293 N -4.35 0.00 -2.68 6.26 -2.24 -1.26 -3.14 114.28 106.87 1q8y n THR 293 Ca -0.10 0.00 -0.09 0.00 -2.27 0.00 0.00 64.05 61.59 1q8y n THR 293 Cb 0.59 -0.07 0.04 0.00 -2.10 0.00 0.00 70.33 68.79 1q8y n THR 293 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 1q8y n ASP 294 N 0.00 0.84 -4.71 3.42 2.03 -1.26 -0.57 116.55 116.30 1q8y n ASP 294 Ca 0.00 -2.67 -0.42 0.00 0.52 0.00 0.00 54.79 52.22 1q8y n ASP 294 Cb 0.00 -0.26 -0.03 0.00 -0.72 0.00 0.00 41.12 40.11 1q8y n ASP 294 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 1q8y s ILE 295 N -2.53 3.94 -0.06 5.18 -1.09 -1.26 -4.78 121.20 120.60 1q8y s ILE 295 Ca 0.26 1.40 -0.31 0.00 -2.23 0.00 0.00 60.65 59.77 1q8y s ILE 295 Cb 0.45 -3.89 0.11 0.00 -1.58 0.00 0.00 42.46 37.55 1q8y s ILE 295 CO 0.02 0.11 1.09 -1.59 -1.23 0.00 0.00 174.94 173.33 1q8y s LYS 296 N 1.04 0.60 0.38 2.79 -2.85 -1.26 -4.79 119.74 115.66 1q8y s LYS 296 Ca 0.59 -0.26 0.14 0.00 -1.00 0.00 0.00 55.97 55.44 1q8y s LYS 296 Cb -0.30 0.25 0.98 0.00 -2.06 0.00 0.00 37.83 36.70 1q8y s LYS 296 CO 0.29 -0.27 1.83 -1.00 0.10 0.00 0.00 175.35 176.30 1q8y h PRO 297 N 2.00 0.50 0.00 1.78 0.13 -1.93 -1.09 132.00 133.40 1q8y h PRO 297 Ca -0.19 -0.03 -0.01 0.00 -0.87 0.00 0.00 66.00 64.90 1q8y h PRO 297 Cb 1.20 -0.11 -0.00 0.00 0.13 0.00 0.00 31.00 32.22 1q8y h PRO 297 CO 0.27 0.33 -0.06 0.93 -0.23 0.00 0.00 178.00 179.24 1q8y h GLU 298 N 0.52 0.00 -0.51 0.86 3.07 -1.95 -2.64 114.58 113.94 1q8y h GLU 298 Ca 0.51 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.37 1q8y h GLU 298 Cb 1.11 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.02 1q8y h GLU 298 CO -0.24 0.06 0.00 0.09 -1.40 0.00 0.00 179.01 177.52 1q8y n ASN 299 N -3.71 5.07 -3.95 1.42 3.02 -0.41 -4.84 115.26 111.85 1q8y n ASN 299 Ca -0.02 -2.85 -0.29 0.00 -0.03 0.00 0.00 54.58 51.38 1q8y n ASN 299 Cb 0.16 -0.62 -0.16 0.00 -0.61 0.00 0.00 39.78 38.55 1q8y n ASN 299 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1q8y s VAL 300 N -2.59 1.35 0.12 2.41 1.01 -1.02 -0.41 120.40 121.27 1q8y s VAL 300 Ca 0.50 -0.68 -0.03 0.00 0.00 0.00 0.00 61.98 61.77 1q8y s VAL 300 Cb 0.38 -1.41 -0.05 0.00 0.00 0.00 0.00 36.38 35.30 1q8y s VAL 300 CO 0.16 0.26 0.33 -0.76 0.00 0.00 0.00 175.10 175.08 1q8y s LEU 301 N 1.55 4.29 0.07 3.92 1.43 -0.04 -1.58 118.68 128.32 1q8y s LEU 301 Ca 0.02 0.48 0.00 0.00 -1.03 0.00 0.00 54.13 53.60 1q8y s LEU 301 Cb -0.14 -3.20 -0.04 0.00 0.03 0.00 0.00 46.19 42.84 1q8y s LEU 301 CO -0.09 0.08 -0.04 -0.32 0.23 0.00 0.00 176.35 176.22 1q8y s MET 302 N -2.64 0.71 -0.03 1.70 -2.45 -0.05 -0.42 119.30 116.12 1q8y s MET 302 Ca 0.39 -1.27 -0.28 0.00 -1.25 0.00 0.00 55.69 53.28 1q8y s MET 302 Cb -0.12 0.06 0.06 0.00 1.25 0.00 0.00 34.83 36.08 1q8y s MET 302 CO 0.26 -0.08 0.61 -1.83 1.05 0.00 0.00 175.02 175.03 1q8y s GLU 303 N -3.89 1.01 -0.07 4.11 -1.05 -0.77 -2.66 118.70 115.37 1q8y s GLU 303 Ca 0.10 0.14 -0.25 0.00 -0.15 0.00 0.00 54.97 54.81 1q8y s GLU 303 Cb 0.07 0.47 -0.03 0.00 -0.44 0.00 0.00 34.13 34.20 1q8y s GLU 303 CO -0.08 -0.32 0.76 0.42 0.95 0.00 0.00 175.26 177.00 1q8y s ILE 304 N -1.38 5.00 -0.22 1.83 1.09 -1.26 -1.28 121.20 124.98 1q8y s ILE 304 Ca -0.11 1.57 0.09 0.00 -1.10 0.00 0.00 60.65 61.11 1q8y s ILE 304 Cb -0.01 -4.10 -0.20 0.00 -1.06 0.00 0.00 42.46 37.09 1q8y s ILE 304 CO 0.08 0.21 -0.08 0.55 -0.10 0.00 0.00 174.94 175.59 1q8y n VAL 305 N 3.92 1.40 -3.39 2.92 3.14 -0.66 -4.87 118.33 120.79 1q8y n VAL 305 Ca 0.01 -0.69 -0.18 0.00 -2.96 0.00 0.00 64.34 60.52 1q8y n VAL 305 Cb 0.51 -0.95 -0.09 0.00 -1.06 0.00 0.00 33.84 32.25 1q8y n VAL 305 CO 0.00 0.00 0.00 -0.62 -6.46 0.00 0.00 176.83 169.75 1q8y s ASP 306 N -5.94 1.59 0.09 6.55 3.68 -0.94 -5.01 116.67 116.69 1q8y s ASP 306 Ca -0.22 -1.08 -0.26 0.00 2.13 0.00 0.00 52.55 53.12 1q8y s ASP 306 Cb 0.07 0.48 -0.15 0.00 -1.45 0.00 0.00 42.92 41.87 1q8y s ASP 306 CO 0.69 -0.35 1.70 -1.28 0.13 0.00 0.00 175.17 176.06 1q8y h SER 539 N 7.84 -0.28 -0.37 -0.34 0.87 -1.90 0.69 113.55 120.06 1q8y h SER 539 Ca -0.07 0.01 0.11 0.00 -1.23 0.00 0.00 61.79 60.61 1q8y h SER 539 Cb 1.06 0.08 -0.01 0.00 -0.44 0.00 0.00 62.40 63.09 1q8y h SER 539 CO 0.29 -0.19 0.36 -0.65 -0.53 0.00 0.00 176.83 176.11 1q8y h PRO 540 N -0.30 0.00 -0.11 2.24 0.11 -1.96 0.76 132.00 132.73 1q8y h PRO 540 Ca -0.02 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.09 1q8y h PRO 540 Cb 0.24 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.35 1q8y h PRO 540 CO 0.03 0.00 0.00 0.39 -0.21 0.00 0.00 178.00 178.21 1q8y n GLU 541 N -3.91 1.91 -2.44 1.05 -0.58 -1.03 -4.97 120.64 110.67 1q8y n GLU 541 Ca 0.06 -1.80 -0.21 0.00 -0.42 0.00 0.00 57.16 54.79 1q8y n GLU 541 Cb 0.53 -1.40 -0.01 0.00 -0.57 0.00 0.00 31.44 30.00 1q8y n GLU 541 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 1q8y n ASN 542 N 1.14 -5.85 -4.77 1.62 3.02 0.26 -4.96 115.26 105.71 1q8y n ASN 542 Ca 0.13 -0.04 -0.38 0.00 -0.03 0.00 0.00 54.58 54.26 1q8y n ASN 542 Cb 0.51 -4.85 -0.06 0.00 -0.61 0.00 0.00 39.78 34.77 1q8y n ASN 542 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1q8y s LEU 543 N -5.95 4.41 0.27 3.41 1.43 0.07 -4.89 118.68 117.43 1q8y s LEU 543 Ca 0.02 1.05 0.05 0.00 -1.03 0.00 0.00 54.13 54.22 1q8y s LEU 543 Cb -0.01 -2.80 -0.06 0.00 0.03 0.00 0.00 46.19 43.36 1q8y s LEU 543 CO 0.03 0.14 -0.01 0.27 0.23 0.00 0.00 176.35 177.01 1q8y s ILE 544 N -0.28 1.30 -0.02 -0.59 -4.36 -1.26 -1.65 121.20 114.33 1q8y s ILE 544 Ca 0.28 -2.06 0.00 0.00 -0.26 0.00 0.00 60.65 58.62 1q8y s ILE 544 Cb -0.17 -2.50 0.02 0.00 1.25 0.00 0.00 42.46 41.06 1q8y s ILE 544 CO 0.15 -0.23 0.00 -1.58 0.24 0.00 0.00 174.94 173.52 1q8y s GLN 545 N -3.82 0.13 0.30 0.37 0.74 -0.40 -4.80 119.66 112.18 1q8y s GLN 545 Ca 0.31 0.07 0.10 0.00 0.05 0.00 0.00 55.36 55.89 1q8y s GLN 545 Cb 0.06 -0.28 -0.05 0.00 1.10 0.00 0.00 33.01 33.84 1q8y s GLN 545 CO 0.12 -0.09 -0.06 0.96 -0.55 0.00 0.00 175.29 175.67 1q8y s ILE 546 N 0.67 2.79 -0.05 -2.34 -5.25 -1.26 -1.85 121.20 113.91 1q8y s ILE 546 Ca -0.06 -2.10 -0.03 0.00 -0.99 0.00 0.00 60.65 57.47 1q8y s ILE 546 Cb -0.09 -2.65 0.03 0.00 2.95 0.00 0.00 42.46 42.70 1q8y s ILE 546 CO -0.02 -0.31 0.12 -0.54 -1.79 0.00 0.00 174.94 172.41 1q8y s LYS 547 N -3.64 0.08 0.05 0.37 1.02 0.44 -4.51 119.74 113.56 1q8y s LYS 547 Ca 0.32 0.30 -0.31 0.00 0.02 0.00 0.00 55.97 56.31 1q8y s LYS 547 Cb -0.03 -0.15 -0.06 0.00 -0.52 0.00 0.00 37.83 37.07 1q8y s LYS 547 CO 0.18 -0.14 1.25 0.42 -0.92 0.00 0.00 175.35 176.14 1q8y s ILE 548 N 0.96 3.90 0.50 2.17 1.01 0.97 -0.86 121.20 129.86 1q8y s ILE 548 Ca -0.08 1.35 0.00 0.00 0.00 0.00 0.00 60.65 61.93 1q8y s ILE 548 Cb -0.10 -3.86 -0.00 0.00 0.01 0.00 0.00 42.46 38.51 1q8y s ILE 548 CO -0.04 0.08 0.01 0.00 0.00 0.00 0.00 174.94 174.99 1q8y n ALA 549 N 4.22 0.44 -3.15 9.38 0.00 0.45 -0.54 120.51 131.31 1q8y n ALA 549 Ca 0.10 -2.26 -0.21 0.00 0.00 0.00 0.00 53.44 51.07 1q8y n ALA 549 Cb 0.45 1.25 0.02 0.00 0.00 0.00 0.00 19.45 21.18 1q8y n ALA 549 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1q8y n ASP 550 N -1.32 -6.81 -1.55 0.00 2.03 -1.26 -4.80 116.55 102.83 1q8y n ASP 550 Ca -0.20 0.26 -0.04 0.00 0.52 0.00 0.00 54.79 55.34 1q8y n ASP 550 Cb 0.64 -3.56 0.20 0.00 -0.72 0.00 0.00 41.12 37.68 1q8y n ASP 550 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 1q8y n LEU 551 N -0.14 4.59 0.26 -2.67 4.77 -1.26 -4.35 117.00 118.20 1q8y n LEU 551 Ca 0.02 -2.37 0.18 0.00 -0.03 0.00 0.00 56.01 53.80 1q8y n LEU 551 Cb 0.54 -0.66 0.88 0.00 -2.33 0.00 0.00 43.42 41.85 1q8y n LEU 551 CO 0.49 0.64 1.02 1.23 -1.33 0.00 0.00 177.39 179.45 1q8y h GLY 552 N 3.45 0.00 -0.30 -0.72 0.00 -1.92 -1.94 103.07 101.64 1q8y h GLY 552 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.50 1q8y h GLY 552 CO 0.48 0.00 0.00 0.70 0.00 0.00 0.00 176.54 177.72 1q8y n ASN 553 N -2.79 1.81 -4.75 0.19 3.02 -1.26 -4.91 115.26 106.56 1q8y n ASN 553 Ca -0.01 -1.62 -0.33 0.00 -0.03 0.00 0.00 54.58 52.59 1q8y n ASN 553 Cb 0.13 -0.03 0.07 0.00 -0.61 0.00 0.00 39.78 39.34 1q8y n ASN 553 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1q8y s ALA 554 N -0.67 2.29 0.35 5.41 0.00 -0.73 -4.65 121.76 123.74 1q8y s ALA 554 Ca 0.05 0.56 0.03 0.00 0.00 0.00 0.00 51.96 52.61 1q8y s ALA 554 Cb 0.03 -3.35 -0.01 0.00 0.00 0.00 0.00 23.12 19.79 1q8y s ALA 554 CO 0.04 -1.60 0.38 0.00 0.00 0.00 0.00 175.76 174.59 1q8y s TRP 556 N -3.17 3.48 0.38 0.00 0.52 -0.69 -1.37 118.94 118.09 1q8y s TRP 556 Ca 0.36 0.21 0.21 0.00 0.02 0.00 0.00 56.10 56.90 1q8y s TRP 556 Cb 0.01 -1.75 1.15 0.00 -1.15 0.00 0.00 33.47 31.72 1q8y s TRP 556 CO 0.25 0.40 1.97 0.10 0.02 0.00 0.00 176.95 179.69 1q8y h TYR 557 N 1.74 0.00 -0.45 -1.98 -0.00 -1.58 -2.11 116.97 112.59 1q8y h TYR 557 Ca -0.49 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.24 1q8y h TYR 557 Cb 1.20 0.00 0.00 0.00 0.00 0.00 0.00 36.73 37.93 1q8y h TYR 557 CO 0.52 0.20 0.00 -0.40 -0.00 0.00 0.00 178.16 178.49 1q8y n ASP 558 N -3.82 3.56 -3.18 0.10 5.75 -1.26 -1.55 116.55 116.14 1q8y n ASP 558 Ca -0.02 -2.24 0.02 0.00 -0.01 0.00 0.00 54.79 52.54 1q8y n ASP 558 Cb 0.30 -0.38 -0.01 0.00 -1.03 0.00 0.00 41.12 40.00 1q8y n ASP 558 CO 0.00 0.00 0.00 -0.70 -0.11 0.00 0.00 177.20 176.39 1q8y s GLU 559 N -1.43 0.74 0.39 0.11 2.12 -0.79 -4.63 118.70 115.21 1q8y s GLU 559 Ca 0.35 -0.12 -0.23 0.00 0.36 0.00 0.00 54.97 55.33 1q8y s GLU 559 Cb 0.21 0.12 -0.10 0.00 0.26 0.00 0.00 34.13 34.62 1q8y s GLU 559 CO 0.19 -1.11 0.99 -1.01 -0.54 0.00 0.00 175.26 173.79 1q8y s HIS 560 N 2.02 3.37 -0.22 5.30 3.76 -1.24 -1.71 115.29 126.57 1q8y s HIS 560 Ca 0.15 1.67 -0.07 0.00 -0.15 0.00 0.00 55.06 56.66 1q8y s HIS 560 Cb -0.05 -2.99 -0.18 0.00 1.11 0.00 0.00 32.58 30.47 1q8y s HIS 560 CO -0.11 -0.28 -0.05 0.66 -0.85 0.00 0.00 174.74 174.11 1q8y n TYR 561 N -0.13 0.46 -3.90 1.40 0.53 -1.26 -4.97 117.16 109.30 1q8y n TYR 561 Ca 0.05 0.13 -0.10 0.00 -1.02 0.00 0.00 57.90 56.96 1q8y n TYR 561 Cb 0.51 -1.06 -0.09 0.00 -1.03 0.00 0.00 39.34 37.67 1q8y n TYR 561 CO 0.00 0.00 0.00 0.99 -1.02 0.00 0.00 176.86 176.83 1q8y s THR 562 N -2.51 0.11 -0.53 -0.72 2.01 -1.26 -5.03 115.64 107.71 1q8y s THR 562 Ca -0.32 -0.93 0.23 0.00 0.31 0.00 0.00 61.69 60.99 1q8y s THR 562 Cb 0.09 -0.73 -0.03 0.00 0.01 0.00 0.00 72.50 71.85 1q8y s THR 562 CO 0.62 -0.51 1.14 0.59 -0.69 0.00 0.00 174.62 175.77 1q8y n ASN 563 N 0.99 0.68 -4.49 3.53 3.02 -1.26 -4.56 115.26 113.17 1q8y n ASN 563 Ca -0.20 0.05 -0.43 0.00 -0.03 0.00 0.00 54.58 53.96 1q8y n ASN 563 Cb 0.57 0.48 -0.01 0.00 -0.61 0.00 0.00 39.78 40.21 1q8y n ASN 563 CO 0.00 0.00 0.00 -0.44 -2.62 0.00 0.00 177.26 174.20 1q8y s SER 564 N -4.36 6.87 0.48 6.41 0.01 -1.26 -4.96 113.70 116.89 1q8y s SER 564 Ca 0.04 -2.53 0.03 0.00 1.31 0.00 0.00 55.95 54.80 1q8y s SER 564 Cb 0.13 -2.45 -0.03 0.00 0.21 0.00 0.00 66.02 63.88 1q8y s SER 564 CO 0.77 -0.97 0.01 0.27 0.41 0.00 0.00 173.24 173.73 1q8y s ILE 565 N 2.63 1.37 0.52 1.44 -4.36 -1.26 -5.09 121.20 116.45 1q8y s ILE 565 Ca 0.43 -2.00 0.00 0.00 -0.26 0.00 0.00 60.65 58.82 1q8y s ILE 565 Cb -0.02 -2.40 0.00 0.00 1.25 0.00 0.00 42.46 41.29 1q8y s ILE 565 CO -0.02 0.00 0.00 0.00 0.24 0.00 0.00 174.94 175.16 1q8y n GLN 566 N -1.17 -3.45 -3.28 0.37 6.02 0.26 -4.88 117.38 111.25 1q8y n GLN 566 Ca -0.15 2.71 -0.38 0.00 -0.01 0.00 0.00 57.00 59.17 1q8y n GLN 566 Cb 0.67 -3.48 -0.06 0.00 1.02 0.00 0.00 30.24 28.39 1q8y n GLN 566 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 177.06 177.04 1q8y s THR 567 N -5.01 5.12 0.00 5.09 2.01 -1.26 -4.83 115.64 116.76 1q8y s THR 567 Ca 0.00 1.05 0.00 0.00 0.31 0.00 0.00 61.69 63.05 1q8y s THR 567 Cb 0.00 -3.85 0.00 0.00 0.01 0.00 0.00 72.50 68.66 1q8y s THR 567 CO 0.00 0.34 0.00 -1.14 -0.69 0.00 0.00 174.62 173.13 1q8y n ARG 568 N 3.45 0.00 0.16 4.92 3.00 -1.26 0.11 116.66 127.04 1q8y n ARG 568 Ca -0.07 0.00 0.17 0.00 -0.00 0.00 0.00 57.85 57.96 1q8y n ARG 568 Cb 0.52 0.00 0.78 0.00 0.00 0.00 0.00 32.46 33.75 1q8y n ARG 568 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.63 178.56 1q8y h GLU 569 N 0.00 0.00 -0.44 -0.14 3.07 -1.94 -1.57 114.58 113.57 1q8y h GLU 569 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 1q8y h GLU 569 Cb 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.91 1q8y h GLU 569 CO 0.00 0.00 0.00 0.66 -1.40 0.00 0.00 179.01 178.27 1q8y n TYR 570 N -3.97 1.26 -2.82 4.33 4.02 0.31 -4.76 117.16 115.53 1q8y n TYR 570 Ca 0.03 -0.72 -0.41 0.00 -0.01 0.00 0.00 57.90 56.79 1q8y n TYR 570 Cb 0.40 -0.30 -0.04 0.00 -0.02 0.00 0.00 39.34 39.37 1q8y n TYR 570 CO 0.00 0.00 0.00 0.50 -1.01 0.00 0.00 176.86 176.35 1q8y s ARG 571 N -2.31 4.58 0.66 -0.72 3.52 -0.59 -4.01 118.95 120.09 1q8y s ARG 571 Ca 0.45 1.28 -0.11 0.00 -0.13 0.00 0.00 55.73 57.22 1q8y s ARG 571 Cb 0.32 -3.40 -0.02 0.00 -1.56 0.00 0.00 34.95 30.30 1q8y s ARG 571 CO 0.15 0.16 1.05 -1.54 -0.81 0.00 0.00 175.30 174.31 1q8y s SER 572 N 0.30 5.84 0.40 -2.12 1.04 -1.26 -4.89 113.70 113.00 1q8y s SER 572 Ca 0.45 1.38 0.13 0.00 0.48 0.00 0.00 55.95 58.39 1q8y s SER 572 Cb -0.21 -2.34 0.81 0.00 0.10 0.00 0.00 66.02 64.38 1q8y s SER 572 CO 0.26 -1.12 1.89 1.55 0.98 0.00 0.00 173.24 176.80 1q8y h PRO 573 N -0.49 0.04 0.03 4.02 0.13 -1.96 -1.11 132.00 132.65 1q8y h PRO 573 Ca -0.44 -0.01 -0.00 0.00 -0.87 0.00 0.00 66.00 64.67 1q8y h PRO 573 Cb 1.21 -0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 1q8y h PRO 573 CO 0.61 0.32 -0.01 0.93 -0.23 0.00 0.00 178.00 179.62 1q8y h GLU 574 N 0.03 -0.04 -0.60 0.86 3.07 -1.89 -0.87 114.58 115.14 1q8y h GLU 574 Ca 0.00 0.00 -0.05 0.00 -0.50 0.00 0.00 59.36 58.81 1q8y h GLU 574 Cb 0.52 0.01 -0.02 0.00 -0.84 0.00 0.00 28.75 28.41 1q8y h GLU 574 CO 0.04 -0.02 0.17 0.28 -1.40 0.00 0.00 179.01 178.07 1q8y h VAL 575 N -0.05 1.25 -0.73 3.13 2.07 -1.72 0.15 116.25 120.34 1q8y h VAL 575 Ca -0.00 -0.86 -0.01 0.00 0.82 0.00 0.00 66.70 66.64 1q8y h VAL 575 Cb 0.04 0.67 -0.04 0.00 -1.52 0.00 0.00 31.29 30.44 1q8y h VAL 575 CO 0.01 0.32 0.41 -0.07 0.02 0.00 0.00 177.57 178.26 1q8y h LEU 576 N 0.86 0.90 -0.47 2.57 3.38 -1.00 -2.30 115.31 119.25 1q8y h LEU 576 Ca 0.19 -0.07 0.00 0.00 0.09 0.00 0.00 57.88 58.09 1q8y h LEU 576 Cb 0.32 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 40.84 1q8y h LEU 576 CO -0.00 0.72 -0.19 0.18 0.09 0.00 0.00 178.44 179.24 1q8y n LEU 577 N -4.37 0.92 -1.06 1.67 4.32 -0.35 -4.90 117.00 113.23 1q8y n LEU 577 Ca 0.07 -0.21 -0.10 0.00 -0.02 0.00 0.00 56.01 55.76 1q8y n LEU 577 Cb 0.09 -0.12 -0.01 0.00 -1.62 0.00 0.00 43.42 41.76 1q8y n LEU 577 CO 0.38 0.17 -0.12 0.61 -1.22 0.00 0.00 177.39 177.21 1q8y n GLY 578 N 1.30 0.06 3.97 -0.72 0.00 -0.25 -1.37 105.19 108.19 1q8y n GLY 578 Ca 0.14 -0.49 -0.21 0.00 0.00 0.00 0.00 46.02 45.45 1q8y n GLY 578 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1q8y s ALA 579 N -2.47 3.90 0.71 4.61 0.00 0.36 -2.36 121.76 126.51 1q8y s ALA 579 Ca 0.00 -1.28 -0.16 0.00 0.00 0.00 0.00 51.96 50.53 1q8y s ALA 579 Cb 0.00 -2.06 0.03 0.00 0.00 0.00 0.00 23.12 21.08 1q8y s ALA 579 CO 0.00 -0.62 1.21 -1.25 0.00 0.00 0.00 175.76 175.11 1q8y s PRO 580 N -4.68 2.27 0.19 0.00 0.04 -1.26 -4.49 135.00 127.07 1q8y s PRO 580 Ca 0.55 1.78 -0.05 0.00 0.04 0.00 0.00 61.00 63.32 1q8y s PRO 580 Cb -0.10 -1.85 -0.03 0.00 0.04 0.00 0.00 34.50 32.57 1q8y s PRO 580 CO 0.38 -1.74 0.22 1.67 0.04 0.00 0.00 177.00 177.57 1q8y s TRP 581 N -1.91 0.78 0.00 0.56 1.48 -1.09 -4.82 118.94 113.95 1q8y s TRP 581 Ca 0.75 -1.09 0.00 0.00 -1.06 0.00 0.00 56.10 54.70 1q8y s TRP 581 Cb -0.30 -0.29 0.00 0.00 -1.16 0.00 0.00 33.47 31.73 1q8y s TRP 581 CO 0.44 -0.71 0.00 0.41 -4.06 0.00 0.00 176.95 173.03 1q8y n GLY 582 N -0.25 3.98 0.38 3.67 0.00 -1.21 -2.49 105.19 109.26 1q8y n GLY 582 Ca -0.02 -0.78 0.19 0.00 0.00 0.00 0.00 46.02 45.41 1q8y n GLY 582 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1q8y h GLY 584 N 0.07 0.00 1.52 0.00 0.00 -1.39 -1.25 103.07 102.02 1q8y h GLY 584 Ca 0.26 0.00 -0.07 0.00 0.00 0.00 0.00 47.33 47.52 1q8y h GLY 584 CO -0.02 0.00 -0.07 0.00 0.00 0.00 0.00 176.54 176.45 1q8y h ALA 585 N 1.92 1.22 -0.15 3.60 0.00 -1.48 -2.44 119.26 121.93 1q8y h ALA 585 Ca 0.00 -0.26 -0.06 0.00 0.00 0.00 0.00 54.91 54.59 1q8y h ALA 585 Cb 0.06 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 1q8y h ALA 585 CO 0.00 0.51 -0.17 -0.44 0.00 0.00 0.00 179.25 179.15 1q8y h ASP 586 N 0.55 0.24 -0.38 0.00 3.32 -1.43 -2.63 116.42 116.09 1q8y h ASP 586 Ca 0.11 -0.05 -0.05 0.00 0.02 0.00 0.00 57.03 57.05 1q8y h ASP 586 Cb 0.46 -0.06 -0.01 0.00 0.22 0.00 0.00 39.33 39.93 1q8y h ASP 586 CO 0.02 0.43 0.03 0.40 -1.72 0.00 0.00 179.24 178.40 1q8y h ILE 587 N 0.23 1.25 0.00 0.35 1.08 -1.56 -1.10 117.51 117.77 1q8y h ILE 587 Ca 0.04 -0.94 0.01 0.00 -0.39 0.00 0.00 64.86 63.59 1q8y h ILE 587 Cb 0.44 1.12 -0.01 0.00 -3.07 0.00 0.00 36.82 35.30 1q8y h ILE 587 CO 0.03 0.32 -0.05 -0.25 -0.69 0.00 0.00 178.15 177.50 1q8y h TRP 588 N 0.48 -0.13 -0.90 1.37 2.91 -1.38 -1.43 115.95 116.87 1q8y h TRP 588 Ca 0.11 0.00 0.10 0.00 1.13 0.00 0.00 58.89 60.24 1q8y h TRP 588 Cb 0.42 0.06 -0.08 0.00 -0.51 0.00 0.00 29.16 29.05 1q8y h TRP 588 CO 0.03 -0.08 0.54 0.77 -1.03 0.00 0.00 178.44 178.67 1q8y h SER 589 N -0.09 0.80 -0.57 2.65 0.02 -1.37 -1.52 113.55 113.47 1q8y h SER 589 Ca 0.02 0.04 -0.03 0.00 -0.84 0.00 0.00 61.79 60.98 1q8y h SER 589 Cb 0.12 -0.11 -0.03 0.00 0.14 0.00 0.00 62.40 62.52 1q8y h SER 589 CO -0.05 0.45 0.25 0.74 -1.14 0.00 0.00 176.83 177.07 1q8y h THR 590 N 0.90 1.21 -0.52 -2.27 2.02 -0.52 -0.49 112.91 113.25 1q8y h THR 590 Ca 0.44 -0.65 -0.11 0.00 0.77 0.00 0.00 66.41 66.86 1q8y h THR 590 Cb 0.39 0.48 -0.02 0.00 -1.74 0.00 0.00 68.15 67.27 1q8y h THR 590 CO -0.25 0.26 -0.12 0.00 0.37 0.00 0.00 175.52 175.78 1q8y h ALA 591 N 1.42 0.71 -0.63 6.16 0.00 -0.28 -0.25 119.26 126.39 1q8y h ALA 591 Ca 0.21 -0.35 -0.07 0.00 0.00 0.00 0.00 54.91 54.70 1q8y h ALA 591 Cb 0.15 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.73 1q8y h ALA 591 CO -0.02 0.63 0.13 0.00 0.00 0.00 0.00 179.25 179.99 1q8y h LEU 593 N 0.94 -0.32 -0.80 0.00 5.85 -0.88 -2.38 115.31 117.73 1q8y h LEU 593 Ca 0.20 -0.10 0.07 0.00 0.84 0.00 0.00 57.88 58.89 1q8y h LEU 593 Cb 0.39 0.08 -0.06 0.00 0.37 0.00 0.00 40.66 41.44 1q8y h LEU 593 CO 0.01 -0.10 0.47 0.40 -0.34 0.00 0.00 178.44 178.89 1q8y h ILE 594 N -0.55 0.99 -0.94 4.05 2.04 -0.97 -0.70 117.51 121.43 1q8y h ILE 594 Ca -0.04 -0.29 -0.00 0.00 1.00 0.00 0.00 64.86 65.53 1q8y h ILE 594 Cb 0.40 0.07 -0.05 0.00 -0.74 0.00 0.00 36.82 36.50 1q8y h ILE 594 CO 0.06 0.16 0.58 0.15 0.00 0.00 0.00 178.15 179.10 1q8y h PHE 595 N 0.85 1.23 -0.60 1.37 3.57 -1.29 -1.37 116.94 120.69 1q8y h PHE 595 Ca 0.36 0.00 -0.04 0.00 3.53 0.00 0.00 57.97 61.82 1q8y h PHE 595 Cb 0.22 -0.41 -0.03 0.00 2.79 0.00 0.00 35.95 38.53 1q8y h PHE 595 CO -0.05 0.81 0.21 1.49 -2.23 0.00 0.00 178.31 178.53 1q8y h GLU 596 N 1.29 0.93 -0.58 1.11 4.81 -0.68 0.15 114.58 121.61 1q8y h GLU 596 Ca 0.34 -0.19 -0.05 0.00 -0.13 0.00 0.00 59.36 59.33 1q8y h GLU 596 Cb -0.08 -0.14 -0.03 0.00 0.63 0.00 0.00 28.75 29.14 1q8y h GLU 596 CO -0.07 0.81 0.18 -0.07 -0.73 0.00 0.00 179.01 179.13 1q8y h LEU 597 N 0.85 0.81 -0.10 1.64 3.38 -0.65 0.70 115.31 121.95 1q8y h LEU 597 Ca 0.20 -0.13 -0.07 0.00 0.09 0.00 0.00 57.88 57.96 1q8y h LEU 597 Cb 0.26 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 40.80 1q8y h LEU 597 CO -0.01 0.77 -0.21 0.40 0.09 0.00 0.00 178.44 179.48 1q8y h ILE 598 N 0.85 1.40 0.02 1.22 2.04 -0.84 0.08 117.51 122.27 1q8y h ILE 598 Ca 0.19 -1.51 -0.36 0.00 1.00 0.00 0.00 64.86 64.19 1q8y h ILE 598 Cb 0.26 2.14 -0.06 0.00 -0.74 0.00 0.00 36.82 38.42 1q8y h ILE 598 CO -0.01 0.43 -2.21 0.35 0.00 0.00 0.00 178.15 176.72 1q8y n THR 599 N -4.52 1.51 -0.03 -0.27 -2.24 0.00 -3.88 114.28 104.85 1q8y n THR 599 Ca -0.07 -0.76 0.00 0.00 -2.27 0.00 0.00 64.05 60.95 1q8y n THR 599 Cb 0.42 -0.96 0.00 0.00 -2.10 0.00 0.00 70.33 67.69 1q8y n THR 599 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1q8y n GLY 600 N 1.85 0.34 3.60 3.38 0.00 0.24 -3.45 105.19 111.15 1q8y n GLY 600 Ca -0.32 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.46 1q8y n GLY 600 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1q8y s ASP 601 N -2.47 4.12 0.46 1.61 1.01 -1.25 -4.79 116.67 115.36 1q8y s ASP 601 Ca 0.00 -0.93 -0.21 0.00 0.71 0.00 0.00 52.55 52.12 1q8y s ASP 601 Cb 0.00 -0.55 -0.09 0.00 1.01 0.00 0.00 42.92 43.29 1q8y s ASP 601 CO 0.00 -0.12 1.02 -0.36 0.21 0.00 0.00 175.17 175.92 1q8y s PHE 602 N -2.48 3.11 0.12 4.23 0.40 -1.26 -3.73 117.98 118.37 1q8y s PHE 602 Ca 0.33 1.60 -0.13 0.00 -0.60 0.00 0.00 56.93 58.13 1q8y s PHE 602 Cb -0.02 -3.03 -0.07 0.00 0.51 0.00 0.00 43.02 40.40 1q8y s PHE 602 CO 0.18 -0.65 1.43 1.25 0.70 0.00 0.00 175.22 178.14 1q8y h LEU 603 N 1.79 0.90 0.00 -0.37 5.85 -1.90 -3.48 115.31 118.11 1q8y h LEU 603 Ca -0.49 -0.49 0.00 0.00 0.84 0.00 0.00 57.88 57.74 1q8y h LEU 603 Cb 1.21 -0.26 0.00 0.00 0.37 0.00 0.00 40.66 41.99 1q8y h LEU 603 CO 0.60 1.22 0.00 0.49 -0.34 0.00 0.00 178.44 180.41 1q8y n PHE 604 N -4.12 0.00 0.00 1.25 3.01 -1.26 -5.08 117.46 111.26 1q8y n PHE 604 Ca -0.04 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.42 1q8y n PHE 604 Cb 0.55 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 40.02 1q8y n PHE 604 CO 0.00 0.00 0.00 0.36 1.01 0.00 0.00 176.76 178.13 1q8y n LYS 614 N 0.00 0.00 -0.26 -1.08 -0.00 -1.26 -4.96 118.16 110.60 1q8y n LYS 614 Ca 0.00 0.00 0.05 0.00 -0.00 0.00 0.00 58.31 58.36 1q8y n LYS 614 Cb 0.00 0.00 0.19 0.00 -0.00 0.00 0.00 35.03 35.22 1q8y n LYS 614 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.40 176.96 1q8y h ASP 615 N 0.00 0.27 -0.04 -5.58 5.19 -2.00 -0.86 116.42 113.41 1q8y h ASP 615 Ca 0.00 0.11 0.02 0.00 -0.62 0.00 0.00 57.03 56.54 1q8y h ASP 615 Cb 0.00 0.09 -0.03 0.00 0.18 0.00 0.00 39.33 39.57 1q8y h ASP 615 CO 0.00 0.10 -0.10 0.44 -3.12 0.00 0.00 179.24 176.56 1q8y h ASP 616 N 0.44 -0.30 -0.54 6.45 5.19 -1.99 0.55 116.42 126.21 1q8y h ASP 616 Ca 0.41 0.05 -0.00 0.00 -0.62 0.00 0.00 57.03 56.87 1q8y h ASP 616 Cb 0.63 0.14 -0.03 0.00 0.18 0.00 0.00 39.33 40.25 1q8y h ASP 616 CO -0.41 -0.14 0.32 0.44 -3.12 0.00 0.00 179.24 176.33 1q8y h ASP 617 N -0.15 0.66 -0.58 6.45 3.32 -1.88 -1.52 116.42 122.72 1q8y h ASP 617 Ca 0.05 -0.07 0.05 0.00 0.02 0.00 0.00 57.03 57.08 1q8y h ASP 617 Cb 0.22 -0.17 -0.05 0.00 0.22 0.00 0.00 39.33 39.56 1q8y h ASP 617 CO -0.13 0.53 0.31 -0.74 -1.72 0.00 0.00 179.24 177.49 1q8y h HIS 618 N 0.73 0.56 -0.47 4.55 2.76 -0.73 -0.80 115.15 121.76 1q8y h HIS 618 Ca 0.19 0.02 -0.09 0.00 -2.20 0.00 0.00 60.37 58.30 1q8y h HIS 618 Cb 0.00 -0.17 -0.02 0.00 1.55 0.00 0.00 27.41 28.77 1q8y h HIS 618 CO -0.02 0.27 -0.07 0.82 -1.30 0.00 0.00 177.93 177.63 1q8y h ILE 619 N 0.58 1.25 -0.28 6.26 2.04 -0.53 -2.17 117.51 124.67 1q8y h ILE 619 Ca 0.25 -1.13 -0.09 0.00 1.00 0.00 0.00 64.86 64.90 1q8y h ILE 619 Cb 0.15 0.97 -0.01 0.00 -0.74 0.00 0.00 36.82 37.19 1q8y h ILE 619 CO -0.17 0.39 -0.21 0.00 0.00 0.00 0.00 178.15 178.17 1q8y h ALA 620 N 1.17 1.13 -0.26 1.87 0.00 -0.62 -1.29 119.26 121.26 1q8y h ALA 620 Ca 0.13 -0.32 -0.13 0.00 0.00 0.00 0.00 54.91 54.59 1q8y h ALA 620 Cb 0.55 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.20 1q8y h ALA 620 CO 0.03 0.54 -0.36 1.96 0.00 0.00 0.00 179.25 181.43 1q8y h GLN 621 N 0.46 0.58 -0.58 0.00 4.20 -0.85 -0.38 115.11 118.55 1q8y h GLN 621 Ca 0.07 -0.28 -0.09 0.00 0.06 0.00 0.00 58.65 58.42 1q8y h GLN 621 Cb 0.61 -0.01 -0.02 0.00 0.30 0.00 0.00 27.48 28.37 1q8y h GLN 621 CO 0.04 0.86 0.01 0.82 -0.67 0.00 0.00 178.83 179.89 1q8y h ILE 622 N 0.49 1.26 -0.45 2.54 2.04 -0.93 -1.79 117.51 120.67 1q8y h ILE 622 Ca 0.05 -1.12 -0.03 0.00 1.00 0.00 0.00 64.86 64.76 1q8y h ILE 622 Cb 0.85 0.84 -0.02 0.00 -0.74 0.00 0.00 36.82 37.75 1q8y h ILE 622 CO 0.07 0.41 0.17 0.40 0.00 0.00 0.00 178.15 179.19 1q8y h ILE 623 N 0.91 1.21 -0.97 -0.67 1.08 -0.99 0.45 117.51 118.54 1q8y h ILE 623 Ca 0.16 -0.68 0.03 0.00 -0.39 0.00 0.00 64.86 63.99 1q8y h ILE 623 Cb 0.54 0.80 -0.05 0.00 -3.07 0.00 0.00 36.82 35.04 1q8y h ILE 623 CO 0.03 0.25 0.63 -0.08 -0.69 0.00 0.00 178.15 178.29 1q8y h GLU 624 N 0.59 1.21 0.21 2.37 4.81 -0.80 1.09 114.58 124.07 1q8y h GLU 624 Ca 0.15 -0.07 -0.34 0.00 -0.13 0.00 0.00 59.36 58.97 1q8y h GLU 624 Cb 0.22 -0.27 0.02 0.00 0.63 0.00 0.00 28.75 29.35 1q8y h GLU 624 CO -0.01 0.80 -1.60 1.25 -0.73 0.00 0.00 179.01 178.72 1q8y h LEU 625 N 1.24 0.70 -2.20 1.64 5.85 -1.18 0.43 115.31 121.80 1q8y h LEU 625 Ca 0.38 -0.93 0.00 0.00 0.84 0.00 0.00 57.88 58.17 1q8y h LEU 625 Cb -0.04 -0.23 0.00 0.00 0.37 0.00 0.00 40.66 40.76 1q8y h LEU 625 CO -0.11 1.74 0.00 0.18 -0.34 0.00 0.00 178.44 179.91 1q8y n LEU 626 N -3.68 1.93 0.00 2.25 4.77 0.14 -4.25 117.00 118.16 1q8y n LEU 626 Ca -0.21 -1.58 0.00 0.00 -0.03 0.00 0.00 56.01 54.19 1q8y n LEU 626 Cb 1.07 -0.05 0.00 0.00 -2.33 0.00 0.00 43.42 42.11 1q8y n LEU 626 CO 0.55 0.46 0.00 0.61 -1.33 0.00 0.00 177.39 177.68 1q8y n GLY 627 N 0.03 -0.75 3.75 -0.72 0.00 0.38 -4.94 105.19 102.94 1q8y n GLY 627 Ca 0.04 -1.72 -0.39 0.00 0.00 0.00 0.00 46.02 43.95 1q8y n GLY 627 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1q8y n GLU 628 N -0.69 1.80 -2.14 1.61 -0.58 -1.26 -4.23 120.64 115.14 1q8y n GLU 628 Ca 0.00 0.66 -0.38 0.00 -0.42 0.00 0.00 57.16 57.02 1q8y n GLU 628 Cb 0.00 -2.60 -0.00 0.00 -0.57 0.00 0.00 31.44 28.27 1q8y n GLU 628 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 1q8y s LEU 629 N -3.39 4.05 0.51 -4.62 1.02 -1.26 -5.00 118.68 109.99 1q8y s LEU 629 Ca 0.70 2.46 -0.22 0.00 0.02 0.00 0.00 54.13 57.09 1q8y s LEU 629 Cb -0.42 -4.14 -0.06 0.00 0.02 0.00 0.00 46.19 41.59 1q8y s LEU 629 CO 0.50 -0.97 1.22 -2.84 0.02 0.00 0.00 176.35 174.28 1q8y s PRO 630 N -2.58 3.44 0.50 1.29 0.02 -1.26 -4.90 135.00 131.51 1q8y s PRO 630 Ca 0.63 1.89 0.20 0.00 0.02 0.00 0.00 61.00 63.73 1q8y s PRO 630 Cb -0.33 -2.26 1.27 0.00 0.02 0.00 0.00 34.50 33.20 1q8y s PRO 630 CO 0.40 -0.85 2.04 0.66 -0.33 0.00 0.00 177.00 178.93 1q8y h SER 631 N 1.64 0.09 -0.40 2.53 4.64 -1.99 -2.01 113.55 118.05 1q8y h SER 631 Ca -0.50 0.00 0.07 0.00 -0.47 0.00 0.00 61.79 60.89 1q8y h SER 631 Cb 1.27 -0.02 -0.06 0.00 -0.31 0.00 0.00 62.40 63.28 1q8y h SER 631 CO 0.58 0.06 0.02 0.22 -0.87 0.00 0.00 176.83 176.84 1q8y h TYR 632 N 0.10 0.02 0.34 4.77 3.20 -1.98 0.49 116.97 123.92 1q8y h TYR 632 Ca 0.18 0.03 -0.02 0.00 3.14 0.00 0.00 58.73 62.06 1q8y h TYR 632 Cb 0.57 0.05 0.00 0.00 1.54 0.00 0.00 36.73 38.89 1q8y h TYR 632 CO -0.00 -0.05 -0.16 -0.07 -1.64 0.00 0.00 178.16 176.23 1q8y h LEU 633 N 0.13 -0.39 -1.15 2.82 3.38 -1.73 -1.33 115.31 117.03 1q8y h LEU 633 Ca 0.19 -0.10 0.04 0.00 0.09 0.00 0.00 57.88 58.10 1q8y h LEU 633 Cb 0.26 0.10 -0.05 0.00 0.09 0.00 0.00 40.66 41.06 1q8y h LEU 633 CO -0.30 -0.13 0.58 -0.07 0.09 0.00 0.00 178.44 178.60 1q8y h LEU 634 N -0.64 0.94 -0.27 1.67 3.38 -1.43 -0.02 115.31 118.95 1q8y h LEU 634 Ca -0.05 -0.01 -0.00 0.00 0.09 0.00 0.00 57.88 57.91 1q8y h LEU 634 Cb 0.46 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.98 1q8y h LEU 634 CO 0.08 0.65 0.16 -0.09 0.09 0.00 0.00 178.44 179.33 1q8y h ARG 635 N 1.09 0.37 -0.57 1.13 2.43 0.14 -3.17 114.38 115.81 1q8y h ARG 635 Ca 0.35 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.49 1q8y h ARG 635 Cb 0.03 -0.08 0.00 0.00 -0.42 0.00 0.00 29.97 29.50 1q8y h ARG 635 CO -0.11 0.29 0.00 0.09 -1.51 0.00 0.00 179.97 178.73 1q8y n ASN 636 N -4.86 4.67 -4.64 -3.80 4.13 -0.52 -4.95 115.26 105.29 1q8y n ASN 636 Ca -0.02 -2.56 -0.40 0.00 1.68 0.00 0.00 54.58 53.28 1q8y n ASN 636 Cb 0.05 -0.56 -0.07 0.00 -1.54 0.00 0.00 39.78 37.66 1q8y n ASN 636 CO 0.00 0.00 0.00 -0.83 0.28 0.00 0.00 177.26 176.71 1q8y s GLY 637 N -1.03 1.94 0.53 7.41 0.00 -0.05 -4.03 107.32 112.08 1q8y s GLY 637 Ca 0.48 -0.45 0.25 0.00 0.00 0.00 0.00 44.72 45.01 1q8y s GLY 637 CO 0.21 1.25 2.12 0.50 0.00 0.00 0.00 173.10 177.18 1q8y h LYS 638 N 7.73 0.00 -0.38 2.90 1.57 -1.01 -2.75 116.57 124.64 1q8y h LYS 638 Ca -0.30 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.48 1q8y h LYS 638 Cb 1.14 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.45 1q8y h LYS 638 CO 0.75 0.09 0.00 0.66 -0.57 0.00 0.00 179.45 180.38 1q8y n TYR 639 N -3.88 0.50 -0.16 -1.35 0.53 -0.47 -4.63 117.16 107.70 1q8y n TYR 639 Ca -0.02 -0.42 -0.03 0.00 -1.02 0.00 0.00 57.90 56.41 1q8y n TYR 639 Cb 0.18 -0.02 0.04 0.00 -1.03 0.00 0.00 39.34 38.52 1q8y n TYR 639 CO 0.00 0.00 0.00 1.15 -1.02 0.00 0.00 176.86 176.99 1q8y h THR 640 N 2.62 0.52 -0.84 -0.72 2.02 -1.62 -0.79 112.91 114.11 1q8y h THR 640 Ca 0.00 -0.01 0.16 0.00 0.77 0.00 0.00 66.41 67.33 1q8y h THR 640 Cb 0.77 0.49 -0.06 0.00 -1.74 0.00 0.00 68.15 67.61 1q8y h THR 640 CO 0.00 0.00 0.55 -0.09 0.37 0.00 0.00 175.52 176.35 1q8y h ARG 641 N 0.02 0.50 0.00 6.66 9.65 -1.82 0.40 114.38 129.78 1q8y h ARG 641 Ca 0.24 -0.03 0.00 0.00 -1.10 0.00 0.00 59.98 59.09 1q8y h ARG 641 Cb 0.37 -0.11 0.00 0.00 -1.39 0.00 0.00 29.97 28.84 1q8y h ARG 641 CO -0.50 0.33 0.00 0.25 2.80 0.00 0.00 179.97 182.85 1q8y n THR 642 N -4.52 0.48 -0.02 0.20 -2.24 -0.31 -3.89 114.28 103.98 1q8y n THR 642 Ca 0.17 0.09 -0.03 0.00 -2.27 0.00 0.00 64.05 62.01 1q8y n THR 642 Cb 0.55 -0.74 -0.03 0.00 -2.10 0.00 0.00 70.33 68.01 1q8y n THR 642 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 1q8y n PHE 643 N -1.60 0.00 -4.14 4.78 3.01 -0.15 -4.87 117.46 114.49 1q8y n PHE 643 Ca 0.05 0.00 -0.31 0.00 1.01 0.00 0.00 57.45 58.20 1q8y n PHE 643 Cb 0.28 -0.23 -0.08 0.00 -0.01 0.00 0.00 39.48 39.44 1q8y n PHE 643 CO 0.00 0.00 0.00 -0.06 1.01 0.00 0.00 176.76 177.71 1q8y s PHE 644 N -2.11 3.09 0.91 1.38 0.40 -0.05 0.55 117.98 122.14 1q8y s PHE 644 Ca -0.03 0.05 -0.16 0.00 -0.60 0.00 0.00 56.93 56.19 1q8y s PHE 644 Cb 0.01 -1.61 0.00 0.00 0.51 0.00 0.00 43.02 41.94 1q8y s PHE 644 CO 0.18 0.49 -0.41 0.27 0.70 0.00 0.00 175.22 176.45 1q8y n ASN 645 N 0.79 -2.65 0.00 1.36 0.23 -1.26 -4.71 115.26 109.02 1q8y n ASN 645 Ca -0.11 -0.13 0.00 0.00 -0.53 0.00 0.00 54.58 53.81 1q8y n ASN 645 Cb 0.52 -0.65 0.00 0.00 -2.08 0.00 0.00 39.78 37.57 1q8y n ASN 645 CO 0.00 0.00 0.00 -1.20 -0.93 0.00 0.00 177.26 175.13 1q8y n SER 646 N 1.19 0.00 -1.87 0.53 7.64 -1.26 -5.00 113.62 114.84 1q8y n SER 646 Ca 0.01 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.89 1q8y n SER 646 Cb 0.45 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.65 1q8y n SER 646 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1q8y n LEU 649 N 0.00 -4.29 -4.66 -3.43 -0.00 -1.26 -5.19 117.00 98.18 1q8y n LEU 649 Ca 0.00 2.62 -0.52 0.00 -0.00 0.00 0.00 56.01 58.11 1q8y n LEU 649 Cb 0.00 -2.69 -0.06 0.00 -0.00 0.00 0.00 43.42 40.67 1q8y n LEU 649 CO 0.00 -0.99 1.20 0.18 -0.00 0.00 0.00 177.39 177.78 1q8y n LEU 650 N 1.29 2.51 0.10 1.47 4.77 -1.26 -4.38 117.00 121.50 1q8y n LEU 650 Ca 0.00 1.07 0.07 0.00 -0.03 0.00 0.00 56.01 57.12 1q8y n LEU 650 Cb 0.00 -1.26 0.38 0.00 -2.33 0.00 0.00 43.42 40.21 1q8y n LEU 650 CO 0.00 -0.52 0.73 0.54 -1.33 0.00 0.00 177.39 176.81 1q8y n ARG 651 N 4.37 0.09 0.00 3.23 1.74 0.19 -3.22 116.66 123.07 1q8y n ARG 651 Ca 0.21 0.54 0.00 0.00 -0.77 0.00 0.00 57.85 57.84 1q8y n ARG 651 Cb 0.21 -1.78 0.00 0.00 -1.02 0.00 0.00 32.46 29.87 1q8y n ARG 651 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 1q8y n ASN 652 N -1.97 0.73 -4.08 0.55 4.13 -1.26 -5.02 115.26 108.34 1q8y n ASN 652 Ca -0.00 -0.14 -0.32 0.00 1.68 0.00 0.00 54.58 55.80 1q8y n ASN 652 Cb 0.06 0.42 -0.16 0.00 -1.54 0.00 0.00 39.78 38.56 1q8y n ASN 652 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 1q8y s ILE 653 N -0.57 1.90 -0.26 2.41 1.01 -1.20 -5.01 121.20 119.47 1q8y s ILE 653 Ca 0.00 -0.91 -0.15 0.00 0.00 0.00 0.00 60.65 59.59 1q8y s ILE 653 Cb 0.00 -1.77 -0.12 0.00 0.01 0.00 0.00 42.46 40.59 1q8y s ILE 653 CO 0.00 0.45 -0.33 -0.24 0.00 0.00 0.00 174.94 174.82 1q8y n SER 654 N 4.66 1.95 -4.63 3.58 2.88 -1.26 -4.14 113.62 116.66 1q8y n SER 654 Ca -0.19 0.35 -0.43 0.00 -1.33 0.00 0.00 58.87 57.27 1q8y n SER 654 Cb 0.49 -0.82 -0.02 0.00 -0.75 0.00 0.00 64.21 63.11 1q8y n SER 654 CO 0.00 0.00 0.00 -0.75 -1.23 0.00 0.00 175.04 173.06 1q8y s LYS 655 N -2.55 3.84 -0.21 -1.46 2.20 -1.26 -4.99 119.74 115.31 1q8y s LYS 655 Ca -0.37 1.49 -0.01 0.00 -0.36 0.00 0.00 55.97 56.72 1q8y s LYS 655 Cb 0.13 -3.97 0.06 0.00 -1.51 0.00 0.00 37.83 32.54 1q8y s LYS 655 CO 0.49 -1.22 -0.01 -0.51 -0.36 0.00 0.00 175.35 173.74 1q8y s LEU 656 N 4.86 1.77 -0.11 5.43 1.43 -1.26 -5.12 118.68 125.68 1q8y s LEU 656 Ca 0.65 -0.96 -0.04 0.00 -1.03 0.00 0.00 54.13 52.76 1q8y s LEU 656 Cb -0.21 -0.85 -0.04 0.00 0.03 0.00 0.00 46.19 45.12 1q8y s LEU 656 CO 0.27 -0.27 0.04 -0.54 0.23 0.00 0.00 176.35 176.08 1q8y s LYS 657 N 1.66 3.22 -0.05 1.70 1.02 -1.26 -5.06 119.74 120.97 1q8y s LYS 657 Ca -0.03 -0.33 -0.11 0.00 0.02 0.00 0.00 55.97 55.53 1q8y s LYS 657 Cb -0.18 -2.95 -0.05 0.00 -0.52 0.00 0.00 37.83 34.14 1q8y s LYS 657 CO -0.07 0.67 0.29 -0.06 -0.92 0.00 0.00 175.35 175.26 1q8y s PHE 658 N -0.77 3.66 -0.36 3.18 0.40 -1.26 -4.57 117.98 118.26 1q8y s PHE 658 Ca 0.12 0.77 0.04 0.00 -0.60 0.00 0.00 56.93 57.26 1q8y s PHE 658 Cb -0.12 -2.12 0.16 0.00 0.51 0.00 0.00 43.02 41.46 1q8y s PHE 658 CO 0.03 0.68 0.45 -0.46 0.70 0.00 0.00 175.22 176.62 1q8y s TRP 659 N -1.08 -0.84 0.60 0.36 -0.00 0.14 -5.03 118.94 113.09 1q8y s TRP 659 Ca 0.21 -0.27 -0.18 0.00 -0.00 0.00 0.00 56.10 55.85 1q8y s TRP 659 Cb -0.14 -0.16 -0.05 0.00 -0.00 0.00 0.00 33.47 33.11 1q8y s TRP 659 CO 0.10 -1.03 0.86 -2.30 -0.00 0.00 0.00 176.95 174.58 1q8y n PRO 660 N 4.55 0.78 -0.30 5.86 -0.02 -1.26 -4.35 135.00 140.25 1q8y n PRO 660 Ca 0.09 0.30 0.05 0.00 -2.02 0.00 0.00 63.50 61.92 1q8y n PRO 660 Cb 0.49 -2.07 0.20 0.00 -0.02 0.00 0.00 33.50 32.10 1q8y n PRO 660 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 1q8y h LEU 661 N 0.37 0.67 -0.78 2.45 5.85 -1.95 -0.97 115.31 120.95 1q8y h LEU 661 Ca -0.48 0.06 0.03 0.00 0.84 0.00 0.00 57.88 58.33 1q8y h LEU 661 Cb 1.37 -0.07 -0.05 0.00 0.37 0.00 0.00 40.66 42.29 1q8y h LEU 661 CO 0.50 0.35 0.50 -0.08 -0.34 0.00 0.00 178.44 179.37 1q8y h GLU 662 N 0.77 0.94 -0.06 1.25 4.81 -1.91 -0.17 114.58 120.22 1q8y h GLU 662 Ca 0.43 -0.06 -0.13 0.00 -0.13 0.00 0.00 59.36 59.47 1q8y h GLU 662 Cb 0.47 -0.21 -0.01 0.00 0.63 0.00 0.00 28.75 29.62 1q8y h GLU 662 CO -0.28 0.62 -0.56 -0.44 -0.73 0.00 0.00 179.01 177.62 1q8y h ASP 663 N 0.97 0.21 0.09 1.04 3.32 -1.65 -1.33 116.42 119.07 1q8y h ASP 663 Ca 0.31 -0.11 -0.00 0.00 0.02 0.00 0.00 57.03 57.24 1q8y h ASP 663 Cb 0.00 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 39.49 1q8y h ASP 663 CO -0.11 0.73 -0.04 0.58 -1.72 0.00 0.00 179.24 178.68 1q8y h VAL 664 N 0.14 0.99 -0.31 -1.35 2.07 -0.42 0.05 116.25 117.42 1q8y h VAL 664 Ca -0.00 -0.25 0.01 0.00 0.82 0.00 0.00 66.70 67.28 1q8y h VAL 664 Cb 1.04 1.15 -0.02 0.00 -1.52 0.00 0.00 31.29 31.93 1q8y h VAL 664 CO 0.08 0.06 0.18 -0.07 0.02 0.00 0.00 177.57 177.85 1q8y h LEU 665 N -0.23 0.30 0.29 2.57 3.38 -0.87 0.07 115.31 120.83 1q8y h LEU 665 Ca -0.01 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.95 1q8y h LEU 665 Cb 0.19 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 40.88 1q8y h LEU 665 CO 0.02 0.22 -0.14 0.71 0.09 0.00 0.00 178.44 179.34 1q8y h THR 666 N 0.37 0.44 -0.05 0.22 1.35 -1.21 -1.89 112.91 112.14 1q8y h THR 666 Ca 0.12 -0.84 -0.01 0.00 -0.55 0.00 0.00 66.41 65.13 1q8y h THR 666 Cb -0.00 0.73 -0.00 0.00 -1.73 0.00 0.00 68.15 67.14 1q8y h THR 666 CO -0.06 0.11 0.01 -0.33 -0.25 0.00 0.00 175.52 175.00 1q8y h GLU 667 N -0.98 0.09 0.06 4.72 5.08 -1.05 -2.16 114.58 120.33 1q8y h GLU 667 Ca -0.04 -0.02 -0.17 0.00 -1.00 0.00 0.00 59.36 58.12 1q8y h GLU 667 Cb 0.47 -0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.71 1q8y h GLU 667 CO 0.06 0.32 -0.88 -0.22 -1.00 0.00 0.00 179.01 177.29 1q8y h LYS 668 N -0.15 0.13 -0.17 2.33 3.64 -1.07 -3.38 116.57 117.90 1q8y h LYS 668 Ca 0.02 -0.23 0.00 0.00 -1.27 0.00 0.00 60.65 59.17 1q8y h LYS 668 Cb 0.27 0.08 0.00 0.00 -0.41 0.00 0.00 32.23 32.17 1q8y h LYS 668 CO 0.00 1.11 0.00 0.66 -2.27 0.00 0.00 179.45 178.95 1q8y n TYR 669 N -4.26 0.20 -2.66 1.91 4.02 -1.07 -4.97 117.16 110.33 1q8y n TYR 669 Ca -0.20 -0.10 -0.21 0.00 -0.01 0.00 0.00 57.90 57.38 1q8y n TYR 669 Cb 0.72 0.00 0.01 0.00 -0.02 0.00 0.00 39.34 40.05 1q8y n TYR 669 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 176.86 177.48 1q8y n LYS 670 N 0.95 -3.07 -2.05 -0.72 4.76 -0.81 -4.95 118.16 112.28 1q8y n LYS 670 Ca 0.17 0.93 -0.32 0.00 -2.87 0.00 0.00 58.31 56.22 1q8y n LYS 670 Cb 0.50 -5.63 0.00 0.00 -1.84 0.00 0.00 35.03 28.06 1q8y n LYS 670 CO 0.00 0.00 0.00 -0.06 -1.37 0.00 0.00 177.40 175.97 1q8y s PHE 671 N -3.08 3.32 0.71 2.13 0.40 -0.76 -4.97 117.98 115.73 1q8y s PHE 671 Ca 0.14 1.43 -0.11 0.00 -0.60 0.00 0.00 56.93 57.79 1q8y s PHE 671 Cb -0.06 -2.85 0.02 0.00 0.51 0.00 0.00 43.02 40.64 1q8y s PHE 671 CO 0.17 -0.78 1.07 -1.54 0.70 0.00 0.00 175.22 174.84 1q8y s SER 672 N -3.37 5.16 0.25 1.36 1.04 -1.26 -4.34 113.70 112.52 1q8y s SER 672 Ca 0.59 1.69 -0.04 0.00 0.48 0.00 0.00 55.95 58.67 1q8y s SER 672 Cb -0.12 -2.50 0.41 0.00 0.10 0.00 0.00 66.02 63.90 1q8y s SER 672 CO 0.42 -1.59 1.81 0.50 0.98 0.00 0.00 173.24 175.35 1q8y h LYS 673 N -0.77 0.75 -0.29 4.02 3.64 -1.97 -0.26 116.57 121.69 1q8y h LYS 673 Ca -0.44 -0.05 -0.06 0.00 -1.27 0.00 0.00 60.65 58.84 1q8y h LYS 673 Cb 1.22 -0.17 -0.01 0.00 -0.41 0.00 0.00 32.23 32.86 1q8y h LYS 673 CO 0.55 0.50 -0.04 -0.44 -2.27 0.00 0.00 179.45 177.75 1q8y h ASP 674 N 0.77 0.54 -0.06 4.20 3.32 -1.99 -1.73 116.42 121.47 1q8y h ASP 674 Ca 0.40 -0.34 -0.13 0.00 0.02 0.00 0.00 57.03 56.98 1q8y h ASP 674 Cb 0.39 -0.15 -0.01 0.00 0.22 0.00 0.00 39.33 39.78 1q8y h ASP 674 CO -0.26 0.75 -0.38 -0.08 -1.72 0.00 0.00 179.24 177.56 1q8y h GLU 675 N 0.31 0.56 -0.56 3.56 4.57 -1.85 -1.76 114.58 119.42 1q8y h GLU 675 Ca 0.08 -0.27 -0.08 0.00 -1.18 0.00 0.00 59.36 57.91 1q8y h GLU 675 Cb 0.50 -0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 29.07 1q8y h GLU 675 CO 0.02 0.85 0.05 0.00 -1.18 0.00 0.00 179.01 178.75 1q8y h ALA 676 N 1.12 0.75 -0.62 2.92 0.00 -1.02 -0.56 119.26 121.86 1q8y h ALA 676 Ca 0.05 -0.27 -0.09 0.00 0.00 0.00 0.00 54.91 54.59 1q8y h ALA 676 Cb 0.87 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.42 1q8y h ALA 676 CO 0.07 0.54 0.05 0.87 0.00 0.00 0.00 179.25 180.78 1q8y h LYS 677 N 0.85 1.06 -0.19 0.00 1.57 -1.15 0.73 116.57 119.44 1q8y h LYS 677 Ca 0.17 -0.31 -0.03 0.00 -1.87 0.00 0.00 60.65 58.60 1q8y h LYS 677 Cb 0.48 -0.11 -0.01 0.00 0.08 0.00 0.00 32.23 32.67 1q8y h LYS 677 CO 0.02 1.01 -0.00 1.49 -0.57 0.00 0.00 179.45 181.40 1q8y h GLU 678 N 0.96 0.33 -0.79 3.15 4.81 -1.11 0.92 114.58 122.84 1q8y h GLU 678 Ca 0.18 -0.10 -0.04 0.00 -0.13 0.00 0.00 59.36 59.26 1q8y h GLU 678 Cb 0.50 -0.03 -0.04 0.00 0.63 0.00 0.00 28.75 29.82 1q8y h GLU 678 CO 0.02 0.54 0.32 0.82 -0.73 0.00 0.00 179.01 179.98 1q8y h ILE 679 N 0.08 1.26 -0.31 2.32 2.04 -1.03 -2.00 117.51 119.87 1q8y h ILE 679 Ca 0.05 -0.81 -0.08 0.00 1.00 0.00 0.00 64.86 65.02 1q8y h ILE 679 Cb 0.39 0.31 -0.02 0.00 -0.74 0.00 0.00 36.82 36.76 1q8y h ILE 679 CO 0.01 0.33 -0.15 -1.28 0.00 0.00 0.00 178.15 177.06 1q8y h SER 680 N 1.15 0.53 0.53 1.72 0.87 -0.67 -1.01 113.55 116.68 1q8y h SER 680 Ca 0.27 -0.15 -0.06 0.00 -1.23 0.00 0.00 61.79 60.62 1q8y h SER 680 Cb 0.21 -0.14 -0.01 0.00 -0.44 0.00 0.00 62.40 62.02 1q8y h SER 680 CO -0.02 0.71 -0.28 0.44 -0.53 0.00 0.00 176.83 177.15 1q8y h ASP 681 N 0.50 0.00 0.06 6.23 3.32 -0.28 0.26 116.42 126.50 1q8y h ASP 681 Ca 0.09 0.00 -0.09 0.00 0.02 0.00 0.00 57.03 57.05 1q8y h ASP 681 Cb 0.55 0.00 0.01 0.00 0.22 0.00 0.00 39.33 40.11 1q8y h ASP 681 CO 0.04 0.28 -0.37 0.15 -1.72 0.00 0.00 179.24 177.61 1q8y h PHE 682 N 0.00 0.26 0.22 4.55 3.57 -0.82 -3.39 116.94 121.33 1q8y h PHE 682 Ca -0.00 -0.18 -0.32 0.00 3.53 0.00 0.00 57.97 61.00 1q8y h PHE 682 Cb 0.62 -0.01 0.04 0.00 2.79 0.00 0.00 35.95 39.39 1q8y h PHE 682 CO 0.00 1.13 -1.38 -0.07 -2.23 0.00 0.00 178.31 175.75 1q8y h LEU 683 N -0.69 0.83 -1.06 0.59 3.38 -1.14 -3.37 115.31 113.84 1q8y h LEU 683 Ca -0.06 -0.91 0.14 0.00 0.09 0.00 0.00 57.88 57.14 1q8y h LEU 683 Cb 1.28 -0.27 -0.09 0.00 0.09 0.00 0.00 40.66 41.67 1q8y h LEU 683 CO 0.07 1.67 0.62 0.28 0.09 0.00 0.00 178.44 181.17 1q8y h SER 684 N 0.12 0.85 0.46 -0.43 0.02 -1.15 0.22 113.55 113.65 1q8y h SER 684 Ca -0.24 0.06 -0.02 0.00 -0.84 0.00 0.00 61.79 60.75 1q8y h SER 684 Cb 2.08 -0.11 -0.00 0.00 0.14 0.00 0.00 62.40 64.51 1q8y h SER 684 CO 0.26 0.42 -0.09 -0.65 -1.14 0.00 0.00 176.83 175.63 1q8y h PRO 685 N 0.89 0.00 0.00 3.45 0.11 -1.76 -0.48 132.00 134.22 1q8y h PRO 685 Ca 0.51 0.00 -0.06 0.00 0.11 0.00 0.00 66.00 66.56 1q8y h PRO 685 Cb 0.62 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.72 1q8y h PRO 685 CO -0.28 0.09 -0.29 0.52 -0.21 0.00 0.00 178.00 177.83 1q8y h MET 686 N 0.00 0.00 -0.61 1.05 2.86 -0.77 -2.79 114.93 114.67 1q8y h MET 686 Ca -0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 1q8y h MET 686 Cb 0.34 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.00 1q8y h MET 686 CO 0.01 0.29 0.00 1.28 1.06 0.00 0.00 176.91 179.55 1q8y n LEU 687 N -3.21 5.40 -4.67 1.22 4.77 -0.22 -3.75 117.00 116.56 1q8y n LEU 687 Ca 0.02 -2.74 -0.43 0.00 -0.03 0.00 0.00 56.01 52.83 1q8y n LEU 687 Cb 0.61 -0.66 -0.03 0.00 -2.33 0.00 0.00 43.42 41.01 1q8y n LEU 687 CO 0.37 0.67 1.58 1.67 -1.33 0.00 0.00 177.39 180.35 1q8y n GLN 688 N 0.76 2.79 -0.15 3.23 -0.06 -1.03 -4.85 117.38 118.07 1q8y n GLN 688 Ca 0.27 1.02 0.03 0.00 -2.00 0.00 0.00 57.00 56.32 1q8y n GLN 688 Cb 1.10 -2.96 0.32 0.00 -4.06 0.00 0.00 30.24 24.64 1q8y n GLN 688 CO 0.00 0.00 0.00 -0.07 -0.20 0.00 0.00 177.06 176.79 1q8y h LEU 689 N 10.26 0.71 -8.55 1.69 3.38 -1.93 -3.38 115.31 117.49 1q8y h LEU 689 Ca -0.49 -0.01 -0.60 0.00 0.09 0.00 0.00 57.88 56.86 1q8y h LEU 689 Cb 1.24 -0.17 -0.11 0.00 0.09 0.00 0.00 40.66 41.71 1q8y h LEU 689 CO 0.94 0.50 0.62 -0.62 0.09 0.00 0.00 178.44 179.98 1q8y s ASP 690 N -6.42 6.40 0.57 -0.43 -1.08 -1.26 -4.77 116.67 109.68 1q8y s ASP 690 Ca -0.10 -0.16 0.27 0.00 -0.52 0.00 0.00 52.55 52.04 1q8y s ASP 690 Cb 0.18 -2.46 1.55 0.00 -1.46 0.00 0.00 42.92 40.73 1q8y s ASP 690 CO 0.77 -1.21 2.07 1.55 0.52 0.00 0.00 175.17 178.86 1q8y h PRO 691 N 9.28 0.00 0.00 4.34 0.13 -1.96 -0.32 132.00 143.47 1q8y h PRO 691 Ca -0.25 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 64.85 1q8y h PRO 691 Cb 1.07 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.20 1q8y h PRO 691 CO 1.08 0.00 -0.13 0.00 -0.23 0.00 0.00 178.00 178.73 1q8y h ARG 692 N 0.00 0.00 -0.00 0.86 3.08 -1.92 -2.91 114.38 113.48 1q8y h ARG 692 Ca 0.12 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.17 1q8y h ARG 692 Cb 0.60 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.65 1q8y h ARG 692 CO -0.00 0.13 -0.64 1.63 -1.07 0.00 0.00 179.97 180.02 1q8y n LYS 693 N -3.40 1.60 -1.71 0.04 5.02 -0.17 -4.20 118.16 115.34 1q8y n LYS 693 Ca -0.01 -0.27 -0.43 0.00 -2.02 0.00 0.00 58.31 55.58 1q8y n LYS 693 Cb 0.31 -1.28 -0.03 0.00 -0.02 0.00 0.00 35.03 34.00 1q8y n LYS 693 CO 0.00 0.00 0.00 -2.13 -0.52 0.00 0.00 177.40 174.75 1q8y n ARG 694 N -0.97 2.54 -2.07 1.97 0.63 -0.95 -4.55 116.66 113.26 1q8y n ARG 694 Ca 0.04 0.91 -0.36 0.00 -0.92 0.00 0.00 57.85 57.53 1q8y n ARG 694 Cb 0.29 -2.72 0.02 0.00 0.45 0.00 0.00 32.46 30.51 1q8y n ARG 694 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1q8y s ALA 695 N 0.84 2.64 0.31 5.13 0.00 -1.06 -1.90 121.76 127.72 1q8y s ALA 695 Ca 0.74 1.00 -0.03 0.00 0.00 0.00 0.00 51.96 53.67 1q8y s ALA 695 Cb -0.56 -3.44 -0.04 0.00 0.00 0.00 0.00 23.12 19.08 1q8y s ALA 695 CO 0.37 -1.06 0.55 0.16 0.00 0.00 0.00 175.76 175.79 1q8y s ASP 696 N -1.55 6.38 0.25 0.00 -4.77 -1.16 -4.67 116.67 111.15 1q8y s ASP 696 Ca 0.75 0.61 -0.04 0.00 -3.30 0.00 0.00 52.55 50.57 1q8y s ASP 696 Cb -0.30 -2.10 0.38 0.00 -1.09 0.00 0.00 42.92 39.81 1q8y s ASP 696 CO 0.33 -0.24 1.84 0.00 0.70 0.00 0.00 175.17 177.80 1q8y h ALA 697 N 1.31 1.23 -0.07 2.11 0.00 -1.93 -2.64 119.26 119.28 1q8y h ALA 697 Ca -0.48 0.00 0.04 0.00 0.00 0.00 0.00 54.91 54.47 1q8y h ALA 697 Cb 1.20 -0.21 -0.06 0.00 0.00 0.00 0.00 17.79 18.72 1q8y h ALA 697 CO 0.64 0.24 -0.40 0.78 0.00 0.00 0.00 179.25 180.51 1q8y h GLY 698 N 0.94 -0.69 1.05 0.00 0.00 -1.92 -1.75 103.07 100.71 1q8y h GLY 698 Ca 0.40 0.49 0.01 0.00 0.00 0.00 0.00 47.33 48.23 1q8y h GLY 698 CO -0.20 -0.23 0.64 -1.33 0.00 0.00 0.00 176.54 175.41 1q8y h GLY 699 N -0.51 1.36 2.00 4.60 0.00 -1.70 -2.72 103.07 106.10 1q8y h GLY 699 Ca 0.07 -0.51 -0.02 0.00 0.00 0.00 0.00 47.33 46.87 1q8y h GLY 699 CO -0.35 0.50 -0.11 1.41 0.00 0.00 0.00 176.54 177.99 1q8y h LEU 700 N 1.31 0.00 -1.87 3.11 3.38 -1.05 -1.91 115.31 118.28 1q8y h LEU 700 Ca 0.35 0.00 0.01 0.00 0.09 0.00 0.00 57.88 58.34 1q8y h LEU 700 Cb -0.15 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.59 1q8y h LEU 700 CO -0.08 0.11 0.12 0.58 0.09 0.00 0.00 178.44 179.26 1q8y h VAL 701 N 0.00 1.01 -0.03 1.22 2.07 -1.00 -1.76 116.25 117.76 1q8y h VAL 701 Ca -0.00 -0.06 0.00 0.00 0.82 0.00 0.00 66.70 67.46 1q8y h VAL 701 Cb 0.24 0.82 0.00 0.00 -1.52 0.00 0.00 31.29 30.83 1q8y h VAL 701 CO 0.01 0.03 0.00 0.59 0.02 0.00 0.00 177.57 178.23 1q8y n ASN 702 N -4.51 0.40 -4.77 0.57 3.02 -0.72 -4.83 115.26 104.42 1q8y n ASN 702 Ca -0.00 -1.41 -0.40 0.00 -0.03 0.00 0.00 54.58 52.74 1q8y n ASN 702 Cb 0.12 -0.02 -0.00 0.00 -0.61 0.00 0.00 39.78 39.27 1q8y n ASN 702 CO 0.00 0.00 0.00 -2.28 -2.62 0.00 0.00 177.26 172.36 1q8y s HIS 703 N -1.96 2.70 0.58 3.10 2.46 -0.66 -4.90 115.29 116.61 1q8y s HIS 703 Ca 0.33 1.32 0.28 0.00 0.47 0.00 0.00 55.06 57.45 1q8y s HIS 703 Cb 0.16 -3.81 1.57 0.00 -0.13 0.00 0.00 32.58 30.36 1q8y s HIS 703 CO 0.26 -2.48 2.05 -1.00 -2.47 0.00 0.00 174.74 171.09 1q8y h PRO 704 N 2.74 0.00 0.00 2.88 0.13 -1.91 -0.85 132.00 134.99 1q8y h PRO 704 Ca -0.50 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.61 1q8y h PRO 704 Cb 1.25 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.38 1q8y h PRO 704 CO 0.63 0.00 -0.08 2.35 -0.23 0.00 0.00 178.00 180.67 1q8y h TRP 705 N 0.00 0.00 -0.30 1.56 7.01 -1.90 -2.20 115.95 120.12 1q8y h TRP 705 Ca 0.13 0.00 0.00 0.00 2.11 0.00 0.00 58.89 61.13 1q8y h TRP 705 Cb 0.68 0.00 0.00 0.00 -2.10 0.00 0.00 29.16 27.74 1q8y h TRP 705 CO 0.00 0.08 0.00 1.28 -2.79 0.00 0.00 178.44 177.01 1q8y n LEU 706 N -3.31 3.32 0.22 0.65 4.77 -0.33 -4.45 117.00 117.87 1q8y n LEU 706 Ca -0.01 -1.40 0.06 0.00 -0.03 0.00 0.00 56.01 54.64 1q8y n LEU 706 Cb 0.27 -0.19 0.50 0.00 -2.33 0.00 0.00 43.42 41.68 1q8y n LEU 706 CO 0.28 0.68 0.86 0.50 -1.33 0.00 0.00 177.39 178.38 1q8y h LYS 707 N 4.41 0.00 -0.51 3.23 1.63 -1.33 -2.74 116.57 121.26 1q8y h LYS 707 Ca 0.00 0.00 -0.13 0.00 -0.85 0.00 0.00 60.65 59.67 1q8y h LYS 707 Cb 0.97 0.00 -0.08 0.00 -0.60 0.00 0.00 32.23 32.52 1q8y h LYS 707 CO 0.00 0.23 0.11 -0.40 -3.45 0.00 0.00 179.45 175.94 1q8y n ASP 708 N -4.08 4.15 -4.70 4.20 5.68 -1.26 -4.39 116.55 116.14 1q8y n ASP 708 Ca -0.02 -3.25 -0.42 0.00 -0.50 0.00 0.00 54.79 50.60 1q8y n ASP 708 Cb 0.30 -0.66 -0.03 0.00 -1.14 0.00 0.00 41.12 39.59 1q8y n ASP 708 CO 0.00 0.00 0.00 -0.89 -1.33 0.00 0.00 177.20 174.98 1q8y s THR 709 N -2.98 2.45 0.25 2.12 2.01 -1.04 -4.87 115.64 113.58 1q8y s THR 709 Ca 0.49 0.14 -0.31 0.00 0.31 0.00 0.00 61.69 62.32 1q8y s THR 709 Cb 0.40 -3.09 -0.13 0.00 0.01 0.00 0.00 72.50 69.69 1q8y s THR 709 CO 0.10 0.00 1.51 0.18 -0.69 0.00 0.00 174.62 175.72 1q8y n LEU 710 N 4.93 3.64 0.00 4.42 4.77 -1.26 -1.49 117.00 132.01 1q8y n LEU 710 Ca 0.16 1.14 0.00 0.00 -0.03 0.00 0.00 56.01 57.28 1q8y n LEU 710 Cb 0.38 -1.50 0.00 0.00 -2.33 0.00 0.00 43.42 39.96 1q8y n LEU 710 CO 0.64 -0.19 0.00 0.61 -1.33 0.00 0.00 177.39 177.12 1q8y n GLY 711 N 2.33 0.40 0.63 -0.72 0.00 -1.26 -4.73 105.19 101.84 1q8y n GLY 711 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.13 1q8y n GLY 711 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1q8y n MET 712 N -1.79 0.00 -0.06 1.61 2.81 -0.56 -4.96 117.12 114.17 1q8y n MET 712 Ca 0.00 -1.03 -0.11 0.00 -1.81 0.00 0.00 57.70 54.74 1q8y n MET 712 Cb 0.05 -0.38 -0.06 0.00 -0.71 0.00 0.00 33.22 32.12 1q8y n MET 712 CO 0.00 0.00 0.00 0.93 1.51 0.00 0.00 175.97 178.41 1q8y h GLU 713 N 0.12 -0.40 -0.93 0.03 3.07 -1.58 -2.05 114.58 112.84 1q8y h GLU 713 Ca -0.04 0.03 -0.37 0.00 -0.50 0.00 0.00 59.36 58.48 1q8y h GLU 713 Cb 1.43 0.09 -0.22 0.00 -0.84 0.00 0.00 28.75 29.21 1q8y h GLU 713 CO 0.01 -0.27 0.47 0.39 -1.40 0.00 0.00 179.01 178.21 1q8y n GLU 714 N -5.42 2.52 -3.25 2.33 -0.58 -1.26 -4.74 120.64 110.23 1q8y n GLU 714 Ca -0.02 -2.64 -0.39 0.00 -0.42 0.00 0.00 57.16 53.69 1q8y n GLU 714 Cb 0.36 -2.05 -0.06 0.00 -0.57 0.00 0.00 31.44 29.12 1q8y n GLU 714 CO 0.00 0.00 0.00 0.42 -0.48 0.00 0.00 177.13 177.07 1q8y s ILE 715 N -2.80 4.80 0.25 -3.67 1.01 -0.77 -5.05 121.20 114.97 1q8y s ILE 715 Ca 0.49 1.22 -0.16 0.00 0.00 0.00 0.00 60.65 62.20 1q8y s ILE 715 Cb 0.41 -3.91 0.01 0.00 0.01 0.00 0.00 42.46 38.98 1q8y s ILE 715 CO 0.10 0.51 0.57 0.00 0.00 0.00 0.00 174.94 176.12 1q8y s ARG 716 N -0.79 1.60 -0.36 2.79 1.70 -1.26 -4.86 118.95 117.78 1q8y s ARG 716 Ca 0.30 -1.11 -0.07 0.00 -0.47 0.00 0.00 55.73 54.38 1q8y s ARG 716 Cb -0.19 0.52 0.05 0.00 -0.57 0.00 0.00 34.95 34.77 1q8y s ARG 716 CO 0.18 -0.69 0.15 0.08 -1.08 0.00 0.00 175.30 173.94 1q8y s VAL 717 N -3.96 3.89 0.25 4.99 1.01 -1.26 -5.00 120.40 120.32 1q8y s VAL 717 Ca 0.17 -1.23 -0.03 0.00 0.00 0.00 0.00 61.98 60.88 1q8y s VAL 717 Cb -0.02 -3.27 0.13 0.00 0.00 0.00 0.00 36.38 33.22 1q8y s VAL 717 CO 0.07 -0.28 1.77 -0.65 0.00 0.00 0.00 175.10 176.01 1q8y h PRO 718 N 8.26 0.89 -0.66 2.72 0.11 -1.99 -3.26 132.00 138.06 1q8y h PRO 718 Ca -0.23 -0.21 0.00 0.00 0.11 0.00 0.00 66.00 65.67 1q8y h PRO 718 Cb 1.08 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 32.07 1q8y h PRO 718 CO 0.64 0.83 0.00 -0.40 -0.21 0.00 0.00 178.00 178.87 1q8y n ASP 719 N -4.24 3.74 -3.89 -2.05 5.75 -1.26 -4.81 116.55 109.79 1q8y n ASP 719 Ca 0.04 -2.45 -0.24 0.00 -0.01 0.00 0.00 54.79 52.12 1q8y n ASP 719 Cb 0.26 -0.55 -0.17 0.00 -1.03 0.00 0.00 41.12 39.64 1q8y n ASP 719 CO 0.00 0.00 0.00 -0.13 -0.11 0.00 0.00 177.20 176.96 1q8y s ARG 720 N -1.95 1.21 0.08 0.11 1.81 -1.23 -5.05 118.95 113.93 1q8y s ARG 720 Ca 0.35 -0.17 -0.30 0.00 -1.72 0.00 0.00 55.73 53.89 1q8y s ARG 720 Cb 0.25 -1.26 -0.05 0.00 -0.45 0.00 0.00 34.95 33.44 1q8y s ARG 720 CO 0.14 -0.18 0.98 -2.00 -0.68 0.00 0.00 175.30 173.56 1q8y s GLU 721 N 1.41 4.64 0.24 3.54 2.12 -1.26 -4.35 118.70 125.04 1q8y s GLU 721 Ca -0.02 1.46 -0.31 0.00 0.36 0.00 0.00 54.97 56.46 1q8y s GLU 721 Cb -0.13 -3.40 -0.13 0.00 0.26 0.00 0.00 34.13 30.73 1q8y s GLU 721 CO -0.04 0.11 1.54 -0.11 -0.54 0.00 0.00 175.26 176.22 1q8y n LEU 722 N 3.16 3.65 0.00 2.70 7.94 -1.26 -0.87 117.00 132.32 1q8y n LEU 722 Ca 0.04 1.12 0.00 0.00 -1.11 0.00 0.00 56.01 56.06 1q8y n LEU 722 Cb 0.50 -1.50 0.00 0.00 0.53 0.00 0.00 43.42 42.94 1q8y n LEU 722 CO 0.52 -0.15 0.00 -1.22 -1.11 0.00 0.00 177.39 175.43 1q8y n TYR 723 N 2.52 0.00 -2.37 1.96 0.53 -1.26 -5.00 117.16 113.53 1q8y n TYR 723 Ca 0.12 0.00 -0.39 0.00 -1.02 0.00 0.00 57.90 56.61 1q8y n TYR 723 Cb 0.33 -0.27 -0.03 0.00 -1.03 0.00 0.00 39.34 38.34 1q8y n TYR 723 CO 0.00 0.00 0.00 0.20 -1.02 0.00 0.00 176.86 176.04 1q8y s GLY 724 N -2.00 2.91 0.62 2.72 0.00 -0.05 -4.86 107.32 106.65 1q8y s GLY 724 Ca 0.00 0.93 -0.16 0.00 0.00 0.00 0.00 44.72 45.49 1q8y s GLY 724 CO 0.00 1.46 1.08 -0.45 0.00 0.00 0.00 173.10 175.19 1q8y s SER 725 N -1.09 5.54 0.00 1.64 0.15 -1.26 -2.99 113.70 115.69 1q8y s SER 725 Ca 0.53 1.89 0.16 0.00 0.70 0.00 0.00 55.95 59.23 1q8y s SER 725 Cb -0.30 -2.54 0.46 0.00 -1.71 0.00 0.00 66.02 61.93 1q8y s SER 725 CO 0.38 -1.33 1.37 0.61 1.20 0.00 0.00 173.24 175.48 1q8y n GLY 726 N -0.79 1.08 0.26 9.45 0.00 -0.80 -4.48 105.19 109.92 1q8y n GLY 726 Ca 0.09 -0.51 0.12 0.00 0.00 0.00 0.00 46.02 45.73 1q8y n GLY 726 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1q8y h SER 727 N 2.75 0.00 0.22 1.61 4.64 -1.81 0.19 113.55 121.16 1q8y h SER 727 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1q8y h SER 727 Cb 0.62 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.71 1q8y h SER 727 CO 0.00 0.00 -0.25 -0.90 -0.87 0.00 0.00 176.83 174.81 1q8y n ASP 728 N -2.52 1.05 -4.73 4.97 5.75 -1.26 -4.82 116.55 114.99 1q8y n ASP 728 Ca -0.02 -0.92 -0.39 0.00 -0.01 0.00 0.00 54.79 53.45 1q8y n ASP 728 Cb 0.33 0.13 -0.05 0.00 -1.03 0.00 0.00 41.12 40.50 1q8y n ASP 728 CO 0.00 0.00 0.00 -0.63 -0.11 0.00 0.00 177.20 176.46 1q8y s ILE 729 N -2.48 5.02 -0.01 2.12 1.01 0.68 -5.00 121.20 122.55 1q8y s ILE 729 Ca 0.25 1.32 -0.36 0.00 0.00 0.00 0.00 60.65 61.86 1q8y s ILE 729 Cb 0.19 -3.98 -0.14 0.00 0.01 0.00 0.00 42.46 38.54 1q8y s ILE 729 CO 0.51 0.31 1.62 -2.65 0.00 0.00 0.00 174.94 174.74 1q8y n PRO 730 N 3.45 1.69 -2.00 2.79 -0.02 -1.26 -1.66 135.00 137.99 1q8y n PRO 730 Ca -0.04 0.61 -0.11 0.00 -2.02 0.00 0.00 63.50 61.94 1q8y n PRO 730 Cb 0.51 -2.35 -0.02 0.00 -0.02 0.00 0.00 33.50 31.63 1q8y n PRO 730 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1q8y n GLY 731 N 3.58 0.24 0.20 -1.23 0.00 -1.26 -4.86 105.19 101.85 1q8y n GLY 731 Ca 0.21 -0.43 -0.08 0.00 0.00 0.00 0.00 46.02 45.72 1q8y n GLY 731 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 173.32 173.07 1q8y h TRP 732 N 0.00 0.59 0.00 1.61 2.91 -1.59 -1.43 115.95 118.04 1q8y h TRP 732 Ca -0.26 0.01 0.00 0.00 1.13 0.00 0.00 58.89 59.76 1q8y h TRP 732 Cb 1.09 -0.20 0.00 0.00 -0.51 0.00 0.00 29.16 29.54 1q8y h TRP 732 CO 0.31 0.40 0.00 1.97 -1.03 0.00 0.00 178.44 180.09 1q8y n PHE 733 N -4.74 0.00 -3.50 2.65 1.16 -1.26 -1.12 117.46 110.65 1q8y n PHE 733 Ca 0.02 -0.16 -0.14 0.00 -1.87 0.00 0.00 57.45 55.30 1q8y n PHE 733 Cb 0.04 -0.02 -0.04 0.00 -1.61 0.00 0.00 39.48 37.85 1q8y n PHE 733 CO 0.00 0.00 0.00 -1.83 -1.87 0.00 0.00 176.76 173.06 1q8y s GLU 734 N -0.33 1.00 0.18 3.97 -1.05 -1.04 -2.67 118.70 118.76 1q8y s GLU 734 Ca 0.00 -0.04 -0.31 0.00 -0.15 0.00 0.00 54.97 54.46 1q8y s GLU 734 Cb 0.00 0.47 -0.10 0.00 -0.44 0.00 0.00 34.13 34.06 1q8y s GLU 734 CO 0.00 -0.37 1.54 -2.00 0.95 0.00 0.00 175.26 175.38 1q8y s GLU 735 N -2.17 4.23 -0.03 -4.83 2.12 -1.21 -4.18 118.70 112.62 1q8y s GLU 735 Ca -0.04 2.34 -0.24 0.00 0.36 0.00 0.00 54.97 57.39 1q8y s GLU 735 Cb -0.01 -3.15 -0.04 0.00 0.26 0.00 0.00 34.13 31.19 1q8y s GLU 735 CO -0.01 -0.57 0.74 0.08 -0.54 0.00 0.00 175.26 174.97 1q8y s VAL 736 N 0.95 4.96 -2.71 3.70 1.01 -0.60 -5.00 120.40 122.72 1q8y s VAL 736 Ca 0.68 1.55 0.26 0.00 0.00 0.00 0.00 61.98 64.47 1q8y s VAL 736 Cb -0.43 -4.08 0.40 0.00 0.00 0.00 0.00 36.38 32.27 1q8y s VAL 736 CO 0.33 0.27 1.54 0.54 0.00 0.00 0.00 175.10 177.78