#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3g1i h TRP 153 N 0.00 0.52 0.00 6.00 5.08 -1.99 -2.64 115.95 122.93 3g1i h TRP 153 Ca 0.00 0.01 0.00 0.00 1.08 0.00 0.00 58.89 59.98 3g1i h TRP 153 Cb 0.00 -0.17 0.00 0.00 -3.00 0.00 0.00 29.16 25.99 3g1i h TRP 153 CO 0.00 0.26 0.00 0.00 -1.28 0.00 0.00 178.44 177.42 3g1i h ALA 154 N 1.68 1.00 -0.02 0.11 0.00 -2.01 -2.56 119.26 117.46 3g1i h ALA 154 Ca 0.27 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.18 3g1i h ALA 154 Cb 0.42 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.21 3g1i h ALA 154 CO -0.08 0.00 -0.19 -0.25 0.00 0.00 0.00 179.25 178.73 3g1i n ASP 155 N -2.60 2.11 -4.72 0.00 8.00 -1.00 -5.00 116.55 113.34 3g1i n ASP 155 Ca 0.01 -1.55 -0.42 0.00 0.71 0.00 0.00 54.79 53.54 3g1i n ASP 155 Cb 0.25 0.24 -0.03 0.00 -0.02 0.00 0.00 41.12 41.56 3g1i n ASP 155 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3g1i s ILE 156 N -1.78 3.58 0.02 0.53 1.01 -0.97 -5.04 121.20 118.56 3g1i s ILE 156 Ca 0.18 1.14 0.00 0.00 0.00 0.00 0.00 60.65 61.97 3g1i s ILE 156 Cb 0.15 -3.73 -0.02 0.00 0.01 0.00 0.00 42.46 38.86 3g1i s ILE 156 CO 0.34 0.09 -0.04 -0.04 0.00 0.00 0.00 174.94 175.29 3g1i s MET 157 N 1.01 0.34 0.26 2.79 -1.94 -1.26 -4.89 119.30 115.61 3g1i s MET 157 Ca 0.62 -0.62 -0.30 0.00 -1.71 0.00 0.00 55.69 53.68 3g1i s MET 157 Cb -0.34 0.05 -0.10 0.00 2.01 0.00 0.00 34.83 36.45 3g1i s MET 157 CO 0.30 -0.03 1.34 -1.14 -0.01 0.00 0.00 175.02 175.48 3g1i s GLN 158 N -1.45 4.35 0.42 2.03 0.74 -0.21 -5.01 119.66 120.54 3g1i s GLN 158 Ca -0.15 2.17 -0.17 0.00 0.05 0.00 0.00 55.36 57.26 3g1i s GLN 158 Cb -0.10 -3.13 -0.09 0.00 1.10 0.00 0.00 33.01 30.79 3g1i s GLN 158 CO -0.01 -0.26 0.89 0.20 -0.55 0.00 0.00 175.29 175.56 3g1i s GLY 159 N 0.01 2.24 0.63 2.59 0.00 -1.26 -4.63 107.32 106.91 3g1i s GLY 159 Ca 0.54 0.19 0.37 0.00 0.00 0.00 0.00 44.72 45.83 3g1i s GLY 159 CO 0.45 0.44 2.31 -0.56 0.00 0.00 0.00 173.10 175.74 3g1i h PRO 160 N 1.67 0.00 -0.18 2.90 0.13 -2.02 -1.49 132.00 133.01 3g1i h PRO 160 Ca -0.48 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 3g1i h PRO 160 Cb 1.18 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.31 3g1i h PRO 160 CO 0.62 0.00 0.00 -1.13 -0.23 0.00 0.00 178.00 177.26 3g1i n SER 161 N -3.43 2.39 -4.65 1.44 3.41 -1.26 -4.99 113.62 106.52 3g1i n SER 161 Ca -0.03 -1.75 -0.42 0.00 -0.26 0.00 0.00 58.87 56.42 3g1i n SER 161 Cb 0.09 -0.12 -0.04 0.00 -0.26 0.00 0.00 64.21 63.88 3g1i n SER 161 CO 0.00 0.00 0.00 -0.70 -0.16 0.00 0.00 175.04 174.18 3g1i s GLU 162 N -0.92 4.22 0.78 4.33 2.12 -0.56 -5.03 118.70 123.64 3g1i s GLU 162 Ca 0.17 0.97 -0.15 0.00 0.36 0.00 0.00 54.97 56.32 3g1i s GLU 162 Cb 0.10 -3.62 0.03 0.00 0.26 0.00 0.00 34.13 30.89 3g1i s GLU 162 CO 0.13 -0.46 0.87 -1.13 -0.54 0.00 0.00 175.26 174.13 3g1i n SER 163 N 5.77 -0.07 -0.16 -1.70 3.41 -1.26 -4.69 113.62 114.92 3g1i n SER 163 Ca 0.05 0.58 -0.08 0.00 -0.26 0.00 0.00 58.87 59.16 3g1i n SER 163 Cb 0.48 -1.37 0.01 0.00 -0.26 0.00 0.00 64.21 63.07 3g1i n SER 163 CO 0.00 0.00 0.00 0.15 -0.16 0.00 0.00 175.04 175.03 3g1i h PHE 164 N -0.69 0.64 -1.01 7.33 3.57 -1.96 -1.72 116.94 123.09 3g1i h PHE 164 Ca -0.46 -0.00 0.02 0.00 3.53 0.00 0.00 57.97 61.06 3g1i h PHE 164 Cb 1.32 -0.21 -0.05 0.00 2.79 0.00 0.00 35.95 39.80 3g1i h PHE 164 CO 0.41 0.45 0.67 -0.24 -2.23 0.00 0.00 178.31 177.36 3g1i h VAL 165 N 0.64 1.22 -0.31 1.41 3.04 -1.98 0.16 116.25 120.44 3g1i h VAL 165 Ca 0.17 -0.46 -0.06 0.00 -1.01 0.00 0.00 66.70 65.34 3g1i h VAL 165 Cb -0.00 -0.22 -0.01 0.00 -2.01 0.00 0.00 31.29 29.04 3g1i h VAL 165 CO -0.03 0.24 -0.05 0.44 -1.01 0.00 0.00 177.57 177.16 3g1i h ASP 166 N 1.33 0.58 -0.30 3.17 5.19 -1.85 -0.24 116.42 124.29 3g1i h ASP 166 Ca 0.38 -0.35 0.05 0.00 -0.62 0.00 0.00 57.03 56.49 3g1i h ASP 166 Cb -0.09 -0.16 -0.04 0.00 0.18 0.00 0.00 39.33 39.22 3g1i h ASP 166 CO -0.10 0.79 0.03 0.15 -3.12 0.00 0.00 179.24 176.99 3g1i h PHE 167 N 0.36 0.04 -0.24 4.55 3.57 -0.96 0.24 116.94 124.51 3g1i h PHE 167 Ca 0.08 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.60 3g1i h PHE 167 Cb 0.53 0.03 -0.01 0.00 2.79 0.00 0.00 35.95 39.28 3g1i h PHE 167 CO 0.05 -0.01 0.15 0.00 -2.23 0.00 0.00 178.31 176.26 3g1i h ALA 168 N 1.24 0.30 -0.29 2.41 0.00 -0.42 0.81 119.26 123.31 3g1i h ALA 168 Ca 0.14 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 55.02 3g1i h ALA 168 Cb 0.17 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 3g1i h ALA 168 CO -0.21 -0.20 0.17 -0.91 0.00 0.00 0.00 179.25 178.09 3g1i h ASN 169 N 0.31 0.35 -0.83 0.00 2.35 -0.93 -0.16 115.58 116.66 3g1i h ASN 169 Ca 0.09 -0.06 0.07 0.00 -0.55 0.00 0.00 56.30 55.85 3g1i h ASN 169 Cb -0.00 -0.09 -0.07 0.00 0.05 0.00 0.00 38.32 38.21 3g1i h ASN 169 CO -0.02 0.31 0.50 -0.09 -1.65 0.00 0.00 177.43 176.48 3g1i h ARG 170 N 0.37 0.86 -0.06 0.81 2.43 -0.72 -1.65 114.38 116.42 3g1i h ARG 170 Ca 0.10 -0.05 -0.09 0.00 -0.81 0.00 0.00 59.98 59.13 3g1i h ARG 170 Cb 0.02 -0.19 0.00 0.00 -0.42 0.00 0.00 29.97 29.38 3g1i h ARG 170 CO -0.02 0.57 -0.32 1.25 -1.51 0.00 0.00 179.97 179.94 3g1i h LEU 171 N 0.88 0.38 -0.81 3.80 5.85 -0.48 -2.26 115.31 122.68 3g1i h LEU 171 Ca 0.38 -0.66 0.00 0.00 0.84 0.00 0.00 57.88 58.44 3g1i h LEU 171 Cb 0.24 -0.11 -0.04 0.00 0.37 0.00 0.00 40.66 41.12 3g1i h LEU 171 CO -0.20 0.98 0.52 0.40 -0.34 0.00 0.00 178.44 179.80 3g1i h ILE 172 N -0.19 1.22 0.05 4.05 2.04 -0.98 -1.54 117.51 122.16 3g1i h ILE 172 Ca -0.02 -0.44 0.00 0.00 1.00 0.00 0.00 64.86 65.40 3g1i h ILE 172 Cb 0.98 0.05 -0.00 0.00 -0.74 0.00 0.00 36.82 37.10 3g1i h ILE 172 CO 0.07 0.22 -0.04 0.11 0.00 0.00 0.00 178.15 178.50 3g1i h LYS 173 N 1.11 -0.10 -0.64 2.37 1.57 -1.32 -0.57 116.57 118.99 3g1i h LYS 173 Ca 0.30 0.01 -0.03 0.00 -1.87 0.00 0.00 60.65 59.05 3g1i h LYS 173 Cb -0.09 0.02 -0.03 0.00 0.08 0.00 0.00 32.23 32.21 3g1i h LYS 173 CO -0.06 -0.06 0.28 0.00 -0.57 0.00 0.00 179.45 179.04 3g1i h ALA 174 N 0.85 1.29 -0.11 3.86 0.00 -1.14 -1.72 119.26 122.29 3g1i h ALA 174 Ca -0.00 -0.15 -0.08 0.00 0.00 0.00 0.00 54.91 54.68 3g1i h ALA 174 Cb 0.09 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 17.62 3g1i h ALA 174 CO -0.01 0.54 -0.24 0.28 0.00 0.00 0.00 179.25 179.83 3g1i h VAL 175 N 0.91 1.39 -0.88 0.00 2.07 -1.14 -1.89 116.25 116.71 3g1i h VAL 175 Ca 0.22 -1.54 0.04 0.00 0.82 0.00 0.00 66.70 66.25 3g1i h VAL 175 Cb 0.14 2.12 -0.05 0.00 -1.52 0.00 0.00 31.29 31.98 3g1i h VAL 175 CO -0.02 0.44 0.58 -0.33 0.02 0.00 0.00 177.57 178.26 3g1i h GLU 176 N -0.10 1.05 -0.01 1.57 5.08 -0.99 -1.98 114.58 119.20 3g1i h GLU 176 Ca 0.00 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.30 3g1i h GLU 176 Cb 0.83 -0.24 0.00 0.00 0.50 0.00 0.00 28.75 29.85 3g1i h GLU 176 CO 0.05 0.69 0.00 0.41 -1.00 0.00 0.00 179.01 179.17 3g1i n GLY 177 N -1.40 -0.48 3.94 -3.84 0.00 -0.66 -4.92 105.19 97.84 3g1i n GLY 177 Ca 0.12 -0.32 -0.29 0.00 0.00 0.00 0.00 46.02 45.53 3g1i n GLY 177 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3g1i s SER 178 N -1.98 3.37 -0.25 1.61 1.04 -0.72 -4.96 113.70 111.82 3g1i s SER 178 Ca 0.42 0.15 -0.01 0.00 0.48 0.00 0.00 55.95 56.99 3g1i s SER 178 Cb 0.21 -0.26 0.17 0.00 0.10 0.00 0.00 66.02 66.24 3g1i s SER 178 CO 0.35 -2.55 2.02 -0.67 0.98 0.00 0.00 173.24 173.36 3g1i n ASP 179 N -3.58 6.24 -4.88 7.02 2.03 -1.26 -4.91 116.55 117.21 3g1i n ASP 179 Ca 0.15 -2.93 -0.36 0.00 0.52 0.00 0.00 54.79 52.17 3g1i n ASP 179 Cb 0.60 -1.07 -0.06 0.00 -0.72 0.00 0.00 41.12 39.86 3g1i n ASP 179 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 3g1i s LEU 180 N -1.43 4.35 0.63 -2.67 1.43 -1.26 -5.09 118.68 114.64 3g1i s LEU 180 Ca 0.24 0.44 -0.18 0.00 -1.03 0.00 0.00 54.13 53.60 3g1i s LEU 180 Cb 0.19 -2.14 -0.02 0.00 0.03 0.00 0.00 46.19 44.25 3g1i s LEU 180 CO -0.00 0.39 1.23 -2.16 0.23 0.00 0.00 176.35 176.03 3g1i s PRO 181 N -1.16 2.71 0.36 1.29 0.04 -1.26 -4.91 135.00 132.07 3g1i s PRO 181 Ca 0.17 1.87 0.13 0.00 0.04 0.00 0.00 61.00 63.20 3g1i s PRO 181 Cb -0.12 -1.89 0.94 0.00 0.04 0.00 0.00 34.50 33.46 3g1i s PRO 181 CO 0.06 -1.42 1.80 -1.35 0.04 0.00 0.00 177.00 176.13 3g1i h PRO 182 N 0.57 0.55 0.00 0.56 0.11 -1.99 -0.35 132.00 131.46 3g1i h PRO 182 Ca -0.50 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.58 3g1i h PRO 182 Cb 1.31 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 32.29 3g1i h PRO 182 CO 0.54 0.36 0.00 -1.13 -0.21 0.00 0.00 178.00 177.56 3g1i n SER 183 N -4.65 0.42 -0.10 -2.05 3.41 -1.26 -1.97 113.62 107.41 3g1i n SER 183 Ca 0.23 0.67 0.08 0.00 -0.26 0.00 0.00 58.87 59.58 3g1i n SER 183 Cb 0.69 -0.73 -0.07 0.00 -0.26 0.00 0.00 64.21 63.83 3g1i n SER 183 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3g1i n ALA 184 N -1.70 4.00 0.10 7.33 0.00 -0.15 -4.68 120.51 125.42 3g1i n ALA 184 Ca 0.00 -0.51 -0.12 0.00 0.00 0.00 0.00 53.44 52.81 3g1i n ALA 184 Cb 0.08 -0.63 -0.08 0.00 0.00 0.00 0.00 19.45 18.82 3g1i n ALA 184 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3g1i h ARG 185 N 0.51 -0.28 -0.23 0.00 3.08 -1.37 -1.56 114.38 114.53 3g1i h ARG 185 Ca 0.00 0.02 0.02 0.00 0.07 0.00 0.00 59.98 60.09 3g1i h ARG 185 Cb 0.46 0.06 -0.02 0.00 0.08 0.00 0.00 29.97 30.55 3g1i h ARG 185 CO 0.00 0.09 0.10 0.00 -1.07 0.00 0.00 179.97 179.10 3g1i h ALA 186 N -0.15 0.27 -0.84 0.04 0.00 -1.84 -0.88 119.26 115.87 3g1i h ALA 186 Ca -0.03 0.01 0.03 0.00 0.00 0.00 0.00 54.91 54.93 3g1i h ALA 186 Cb 0.50 -0.02 -0.05 0.00 0.00 0.00 0.00 17.79 18.22 3g1i h ALA 186 CO 0.05 -0.31 0.54 -1.35 0.00 0.00 0.00 179.25 178.18 3g1i h PRO 187 N 0.22 1.01 -0.48 0.00 0.11 -1.83 -0.83 132.00 130.21 3g1i h PRO 187 Ca 0.10 -0.06 -0.03 0.00 0.11 0.00 0.00 66.00 66.12 3g1i h PRO 187 Cb 0.04 -0.23 -0.02 0.00 0.11 0.00 0.00 31.00 30.91 3g1i h PRO 187 CO -0.08 0.67 0.19 0.28 -0.21 0.00 0.00 178.00 178.84 3g1i h VAL 188 N 1.04 1.21 -0.08 3.15 2.07 -1.02 -1.45 116.25 121.18 3g1i h VAL 188 Ca 0.34 -0.65 -0.00 0.00 0.82 0.00 0.00 66.70 67.21 3g1i h VAL 188 Cb 0.02 0.74 -0.00 0.00 -1.52 0.00 0.00 31.29 30.53 3g1i h VAL 188 CO -0.12 0.24 0.04 0.40 0.02 0.00 0.00 177.57 178.15 3g1i h ILE 189 N 0.63 1.09 -0.44 4.57 2.04 -0.70 -1.05 117.51 123.64 3g1i h ILE 189 Ca 0.16 -0.26 -0.01 0.00 1.00 0.00 0.00 64.86 65.75 3g1i h ILE 189 Cb 0.20 1.13 -0.02 0.00 -0.74 0.00 0.00 36.82 37.38 3g1i h ILE 189 CO -0.01 0.08 0.24 0.40 0.00 0.00 0.00 178.15 178.85 3g1i h ILE 190 N 0.02 1.17 -0.44 -0.67 2.04 -1.11 0.10 117.51 118.62 3g1i h ILE 190 Ca 0.03 -0.44 0.05 0.00 1.00 0.00 0.00 64.86 65.50 3g1i h ILE 190 Cb 0.09 0.64 -0.05 0.00 -0.74 0.00 0.00 36.82 36.77 3g1i h ILE 190 CO -0.00 0.18 0.17 -0.78 0.00 0.00 0.00 178.15 177.72 3g1i h ASP 191 N 0.58 0.20 -0.74 1.72 3.58 -1.18 0.10 116.42 120.68 3g1i h ASP 191 Ca 0.16 0.05 -0.03 0.00 0.42 0.00 0.00 57.03 57.62 3g1i h ASP 191 Cb 0.07 0.02 -0.03 0.00 1.72 0.00 0.00 39.33 41.11 3g1i h ASP 191 CO -0.02 0.15 0.35 0.00 -2.88 0.00 0.00 179.24 176.84 3g1i h PHE 193 N 1.04 -0.20 -0.02 0.00 0.04 -0.42 0.25 116.94 117.62 3g1i h PHE 193 Ca 0.25 0.02 -0.06 0.00 2.80 0.00 0.00 57.97 60.98 3g1i h PHE 193 Cb 0.13 0.11 -0.01 0.00 2.20 0.00 0.00 35.95 38.38 3g1i h PHE 193 CO 0.01 -0.13 -0.25 0.00 -0.60 0.00 0.00 178.31 177.34 3g1i h ARG 194 N -0.08 0.04 0.00 1.51 3.08 -0.44 -3.22 114.38 115.26 3g1i h ARG 194 Ca 0.08 -0.01 -0.04 0.00 0.07 0.00 0.00 59.98 60.08 3g1i h ARG 194 Cb 0.20 -0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.24 3g1i h ARG 194 CO -0.19 0.29 -1.26 0.94 -1.07 0.00 0.00 179.97 178.67 3g1i n GLN 195 N -4.23 1.69 0.00 0.04 7.27 -0.46 -4.73 117.38 116.96 3g1i n GLN 195 Ca -0.02 -0.02 0.00 0.00 0.07 0.00 0.00 57.00 57.03 3g1i n GLN 195 Cb 0.31 -1.12 0.00 0.00 2.41 0.00 0.00 30.24 31.85 3g1i n GLN 195 CO 0.00 0.00 0.00 1.63 0.07 0.00 0.00 177.06 178.76 3g1i n LYS 196 N -1.92 0.11 -1.04 3.69 5.02 0.89 -5.02 118.16 119.89 3g1i n LYS 196 Ca -0.04 -0.67 -0.30 0.00 -2.02 0.00 0.00 58.31 55.28 3g1i n LYS 196 Cb 0.38 -0.92 0.23 0.00 -0.02 0.00 0.00 35.03 34.71 3g1i n LYS 196 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 3g1i s SER 197 N -0.24 1.20 0.72 4.39 1.04 -1.19 -1.04 113.70 118.60 3g1i s SER 197 Ca 0.00 0.81 -0.15 0.00 0.48 0.00 0.00 55.95 57.08 3g1i s SER 197 Cb 0.00 -1.18 0.03 0.00 0.10 0.00 0.00 66.02 64.97 3g1i s SER 197 CO 0.00 -3.97 1.22 -1.10 0.98 0.00 0.00 173.24 170.37 3g1i s GLN 198 N -5.24 2.17 0.26 4.02 -1.52 -1.26 -4.65 119.66 113.45 3g1i s GLN 198 Ca 0.69 1.79 -0.01 0.00 -1.95 0.00 0.00 55.36 55.89 3g1i s GLN 198 Cb -0.13 -1.83 0.55 0.00 -0.22 0.00 0.00 33.01 31.38 3g1i s GLN 198 CO 0.57 -1.82 1.74 -1.35 -0.25 0.00 0.00 175.29 174.18 3g1i h PRO 199 N -0.21 0.52 0.00 2.91 0.11 -1.97 0.80 132.00 134.16 3g1i h PRO 199 Ca -0.48 -0.03 -0.11 0.00 0.11 0.00 0.00 66.00 65.49 3g1i h PRO 199 Cb 1.30 -0.12 -0.02 0.00 0.11 0.00 0.00 31.00 32.28 3g1i h PRO 199 CO 0.50 0.34 -0.51 -0.44 -0.21 0.00 0.00 178.00 177.68 3g1i h ASP 200 N 0.53 0.00 0.20 -2.05 3.32 -1.99 -2.19 116.42 114.24 3g1i h ASP 200 Ca 0.47 0.00 -0.23 0.00 0.02 0.00 0.00 57.03 57.29 3g1i h ASP 200 Cb 0.73 0.00 0.01 0.00 0.22 0.00 0.00 39.33 40.29 3g1i h ASP 200 CO -0.41 0.51 -0.92 0.40 -1.72 0.00 0.00 179.24 177.10 3g1i h ILE 201 N 0.00 1.36 -1.00 0.35 1.08 -1.39 -1.04 117.51 116.86 3g1i h ILE 201 Ca -0.01 -2.31 0.02 0.00 -0.39 0.00 0.00 64.86 62.17 3g1i h ILE 201 Cb 0.92 2.33 -0.05 0.00 -3.07 0.00 0.00 36.82 36.94 3g1i h ILE 201 CO 0.07 0.70 0.66 1.56 -0.69 0.00 0.00 178.15 180.45 3g1i h GLN 202 N 0.31 1.29 -0.24 2.37 4.20 -0.51 -1.89 115.11 120.63 3g1i h GLN 202 Ca -0.08 -0.08 -0.17 0.00 0.06 0.00 0.00 58.65 58.38 3g1i h GLN 202 Cb 1.56 -0.29 -0.00 0.00 0.30 0.00 0.00 27.48 29.04 3g1i h GLN 202 CO 0.17 0.85 -0.55 1.96 -0.67 0.00 0.00 178.83 180.60 3g1i h GLN 203 N 1.33 0.71 -0.37 1.46 1.08 -1.28 -2.12 115.11 115.93 3g1i h GLN 203 Ca 0.38 -0.45 -0.00 0.00 -1.45 0.00 0.00 58.65 57.13 3g1i h GLN 203 Cb -0.10 0.05 -0.02 0.00 -0.05 0.00 0.00 27.48 27.36 3g1i h GLN 203 CO -0.10 1.07 0.23 1.25 -0.95 0.00 0.00 178.83 180.33 3g1i h LEU 204 N 0.55 0.44 -1.41 1.46 5.85 -0.85 -2.78 115.31 118.58 3g1i h LEU 204 Ca 0.01 -0.05 -0.03 0.00 0.84 0.00 0.00 57.88 58.65 3g1i h LEU 204 Cb 1.12 -0.11 -0.02 0.00 0.37 0.00 0.00 40.66 42.02 3g1i h LEU 204 CO 0.11 0.36 0.03 0.40 -0.34 0.00 0.00 178.44 179.00 3g1i h ILE 205 N 0.49 1.16 0.00 4.05 2.04 -1.25 -0.74 117.51 123.26 3g1i h ILE 205 Ca 0.13 -0.60 -0.00 0.00 1.00 0.00 0.00 64.86 65.40 3g1i h ILE 205 Cb -0.00 0.91 -0.00 0.00 -0.74 0.00 0.00 36.82 36.99 3g1i h ILE 205 CO -0.03 0.21 -0.01 -0.09 0.00 0.00 0.00 178.15 178.23 3g1i h ARG 206 N 0.42 0.00 0.00 2.37 2.43 -1.10 -0.70 114.38 117.79 3g1i h ARG 206 Ca 0.10 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.27 3g1i h ARG 206 Cb 0.23 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.78 3g1i h ARG 206 CO 0.00 0.01 -0.29 0.25 -1.51 0.00 0.00 179.97 178.42 3g1i n THR 207 N -4.16 0.20 -1.86 0.20 -2.24 -0.29 -4.94 114.28 101.19 3g1i n THR 207 Ca -0.03 -0.12 -0.39 0.00 -2.27 0.00 0.00 64.05 61.24 3g1i n THR 207 Cb 0.09 -0.22 0.03 0.00 -2.10 0.00 0.00 70.33 68.13 3g1i n THR 207 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3g1i s ALA 208 N -3.06 2.98 0.55 6.98 0.00 -0.27 -4.94 121.76 124.00 3g1i s ALA 208 Ca 0.11 1.32 -0.21 0.00 0.00 0.00 0.00 51.96 53.17 3g1i s ALA 208 Cb 0.16 -3.55 -0.05 0.00 0.00 0.00 0.00 23.12 19.68 3g1i s ALA 208 CO 0.64 -1.21 1.32 -2.30 0.00 0.00 0.00 175.76 174.21 3g1i n PRO 209 N -0.67 1.60 0.09 0.00 -0.02 -1.26 -4.85 135.00 129.89 3g1i n PRO 209 Ca 0.08 0.59 0.09 0.00 -2.02 0.00 0.00 63.50 62.24 3g1i n PRO 209 Cb 0.44 -2.53 0.40 0.00 -0.02 0.00 0.00 33.50 31.78 3g1i n PRO 209 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 3g1i n SER 210 N -1.00 0.39 -0.30 2.55 3.41 -1.26 -2.04 113.62 115.36 3g1i n SER 210 Ca 0.11 0.63 0.13 0.00 -0.26 0.00 0.00 58.87 59.47 3g1i n SER 210 Cb 0.45 -0.70 0.58 0.00 -0.26 0.00 0.00 64.21 64.28 3g1i n SER 210 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 3g1i n THR 211 N -1.96 0.06 -3.13 6.66 -2.24 -1.26 -4.63 114.28 107.78 3g1i n THR 211 Ca 0.01 -0.17 -0.43 0.00 -2.27 0.00 0.00 64.05 61.18 3g1i n THR 211 Cb 0.12 0.09 -0.06 0.00 -2.10 0.00 0.00 70.33 68.38 3g1i n THR 211 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 3g1i s LEU 212 N -1.80 4.82 0.00 3.22 1.43 -0.87 -4.89 118.68 120.59 3g1i s LEU 212 Ca 0.37 -0.78 0.00 0.00 -1.03 0.00 0.00 54.13 52.68 3g1i s LEU 212 Cb 0.19 -2.51 0.00 0.00 0.03 0.00 0.00 46.19 43.89 3g1i s LEU 212 CO 0.30 -0.90 0.34 0.35 0.23 0.00 0.00 176.35 176.66 3g1i n THR 213 N 5.70 0.00 -4.38 5.49 -2.24 -1.26 -4.86 114.28 112.72 3g1i n THR 213 Ca -0.05 -0.42 -0.26 0.00 -2.27 0.00 0.00 64.05 61.05 3g1i n THR 213 Cb 0.46 1.14 -0.11 0.00 -2.10 0.00 0.00 70.33 69.72 3g1i n THR 213 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 3g1i s THR 214 N -0.16 2.68 0.27 4.28 -4.23 -1.26 -5.03 115.64 112.19 3g1i s THR 214 Ca 0.00 -1.95 -0.00 0.00 -1.18 0.00 0.00 61.69 58.55 3g1i s THR 214 Cb 0.00 -2.32 0.26 0.00 1.34 0.00 0.00 72.50 71.78 3g1i s THR 214 CO 0.00 -0.16 1.82 -0.65 -0.54 0.00 0.00 174.62 175.10 3g1i h PRO 215 N 2.94 0.90 -0.53 3.99 0.11 -1.95 -2.35 132.00 135.12 3g1i h PRO 215 Ca -0.46 -0.05 0.02 0.00 0.11 0.00 0.00 66.00 65.62 3g1i h PRO 215 Cb 1.21 -0.20 -0.03 0.00 0.11 0.00 0.00 31.00 32.09 3g1i h PRO 215 CO 0.52 0.59 0.32 0.78 -0.21 0.00 0.00 178.00 180.01 3g1i h GLY 216 N 0.93 0.74 1.17 -0.55 0.00 -1.99 0.32 103.07 103.69 3g1i h GLY 216 Ca 0.47 -0.25 -0.03 0.00 0.00 0.00 0.00 47.33 47.52 3g1i h GLY 216 CO -0.27 0.22 0.34 0.83 0.00 0.00 0.00 176.54 177.66 3g1i h GLU 217 N 0.65 1.07 -0.32 4.80 5.08 -1.85 -1.33 114.58 122.68 3g1i h GLU 217 Ca 0.21 -0.16 -0.14 0.00 -1.00 0.00 0.00 59.36 58.27 3g1i h GLU 217 Cb -0.00 -0.19 -0.00 0.00 0.50 0.00 0.00 28.75 29.05 3g1i h GLU 217 CO -0.08 0.84 -0.33 0.82 -1.00 0.00 0.00 179.01 179.26 3g1i h ILE 218 N 1.06 1.29 -0.23 3.13 2.04 -1.04 -1.95 117.51 121.80 3g1i h ILE 218 Ca 0.25 -1.50 0.01 0.00 1.00 0.00 0.00 64.86 64.62 3g1i h ILE 218 Cb 0.14 1.51 -0.02 0.00 -0.74 0.00 0.00 36.82 37.71 3g1i h ILE 218 CO -0.03 0.49 0.13 0.40 0.00 0.00 0.00 178.15 179.14 3g1i h ILE 219 N 0.57 1.02 -0.30 -0.67 2.04 -0.75 -1.45 117.51 117.97 3g1i h ILE 219 Ca 0.05 -0.09 0.05 0.00 1.00 0.00 0.00 64.86 65.87 3g1i h ILE 219 Cb 0.91 0.73 -0.04 0.00 -0.74 0.00 0.00 36.82 37.68 3g1i h ILE 219 CO 0.08 0.05 0.03 0.50 0.00 0.00 0.00 178.15 178.81 3g1i h LYS 220 N 0.27 0.13 -0.50 2.37 3.64 -1.23 -0.67 116.57 120.58 3g1i h LYS 220 Ca 0.09 -0.01 0.06 0.00 -1.27 0.00 0.00 60.65 59.52 3g1i h LYS 220 Cb 0.00 -0.03 -0.05 0.00 -0.41 0.00 0.00 32.23 31.74 3g1i h LYS 220 CO -0.05 0.08 0.21 -0.92 -2.27 0.00 0.00 179.45 176.51 3g1i h TYR 221 N 0.13 0.39 -0.10 1.91 3.20 -0.96 -1.04 116.97 120.48 3g1i h TYR 221 Ca 0.14 0.02 -0.01 0.00 3.14 0.00 0.00 58.73 62.03 3g1i h TYR 221 Cb 0.17 -0.10 -0.00 0.00 1.54 0.00 0.00 36.73 38.34 3g1i h TYR 221 CO -0.20 0.16 0.03 0.28 -1.64 0.00 0.00 178.16 176.79 3g1i h VAL 222 N 0.42 1.19 -0.93 1.81 2.07 -0.96 -2.17 116.25 117.68 3g1i h VAL 222 Ca 0.23 -0.58 -0.00 0.00 0.82 0.00 0.00 66.70 67.17 3g1i h VAL 222 Cb 0.20 1.38 -0.04 0.00 -1.52 0.00 0.00 31.29 31.30 3g1i h VAL 222 CO -0.20 0.17 0.57 -0.07 0.02 0.00 0.00 177.57 178.05 3g1i h LEU 223 N -0.03 1.10 -1.07 2.57 3.38 -0.88 0.13 115.31 120.51 3g1i h LEU 223 Ca 0.03 -0.06 -0.08 0.00 0.09 0.00 0.00 57.88 57.86 3g1i h LEU 223 Cb 0.24 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.70 3g1i h LEU 223 CO -0.00 0.84 -0.38 0.44 0.09 0.00 0.00 178.44 179.43 3g1i h ASP 224 N 1.27 0.00 0.00 -0.43 3.32 -1.12 -3.37 116.42 116.09 3g1i h ASP 224 Ca 0.33 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.38 3g1i h ASP 224 Cb -0.07 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.48 3g1i h ASP 224 CO -0.06 0.38 -0.63 0.54 -1.72 0.00 0.00 179.24 177.75 3g1i n ARG 225 N -3.69 3.00 0.00 3.56 1.74 -0.83 -5.10 116.66 115.34 3g1i n ARG 225 Ca -0.01 -0.01 0.03 0.00 -0.77 0.00 0.00 57.85 57.09 3g1i n ARG 225 Cb 0.48 -0.83 0.19 0.00 -1.02 0.00 0.00 32.46 31.27 3g1i n ARG 225 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11