#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3gdi s SER 169 N 0.00 -0.81 -0.28 1.61 0.15 -1.26 -5.14 113.70 107.97 3gdi s SER 169 Ca 0.00 1.30 0.00 0.00 0.70 0.00 0.00 55.95 57.95 3gdi s SER 169 Cb 0.00 1.33 0.05 0.00 -1.71 0.00 0.00 66.02 65.70 3gdi s SER 169 CO 0.00 -0.21 -0.04 -0.94 1.20 0.00 0.00 173.24 173.25 3gdi s SER 170 N 1.50 4.71 0.00 5.45 1.04 -1.26 -4.40 113.70 120.74 3gdi s SER 170 Ca -0.09 -1.34 0.00 0.00 0.48 0.00 0.00 55.95 55.00 3gdi s SER 170 Cb -0.05 -1.65 0.00 0.00 0.10 0.00 0.00 66.02 64.43 3gdi s SER 170 CO -0.18 -0.23 0.40 -1.22 0.98 0.00 0.00 173.24 172.99 3gdi n TYR 171 N 4.54 0.00 -1.61 5.02 4.01 -1.08 -4.88 117.16 123.15 3gdi n TYR 171 Ca -0.13 0.00 0.04 0.00 -0.16 0.00 0.00 57.90 57.65 3gdi n TYR 171 Cb 0.43 -0.25 -0.01 0.00 -0.31 0.00 0.00 39.34 39.20 3gdi n TYR 171 CO 0.00 0.00 0.00 -1.13 -0.46 0.00 0.00 176.86 175.27 3gdi n SER 172 N -1.24 -3.46 0.00 7.72 3.41 -1.22 -4.53 113.62 114.31 3gdi n SER 172 Ca 0.00 0.34 0.00 0.00 -0.26 0.00 0.00 58.87 58.95 3gdi n SER 172 Cb 0.00 -1.09 0.00 0.00 -0.26 0.00 0.00 64.21 62.86 3gdi n SER 172 CO 0.00 0.00 0.00 0.23 -0.16 0.00 0.00 175.04 175.11 3gdi n MET 173 N -1.58 0.00 0.03 4.33 2.81 -1.26 -1.18 117.12 120.27 3gdi n MET 173 Ca 0.00 0.00 0.11 0.00 -1.81 0.00 0.00 57.70 56.01 3gdi n MET 173 Cb 0.15 0.00 0.05 0.00 -0.71 0.00 0.00 33.22 32.70 3gdi n MET 173 CO 0.00 0.00 0.00 -1.91 1.51 0.00 0.00 175.97 175.57 3gdi n GLU 174 N 14.00 0.28 0.00 0.03 2.13 -1.26 -4.02 120.64 131.80 3gdi n GLU 174 Ca 0.00 0.01 0.01 0.00 0.66 0.00 0.00 57.16 57.84 3gdi n GLU 174 Cb 0.00 -1.60 0.05 0.00 0.27 0.00 0.00 31.44 30.16 3gdi n GLU 174 CO 0.00 0.00 0.00 1.04 -0.41 0.00 0.00 177.13 177.76 3gdi n GLN 175 N -1.96 0.04 -0.07 5.31 6.02 -0.33 -0.76 117.38 125.63 3gdi n GLN 175 Ca 0.02 0.19 0.02 0.00 -0.01 0.00 0.00 57.00 57.22 3gdi n GLN 175 Cb 0.43 -1.50 0.06 0.00 1.02 0.00 0.00 30.24 30.25 3gdi n GLN 175 CO 0.00 0.00 0.00 1.33 -1.01 0.00 0.00 177.06 177.38 3gdi n VAL 176 N -1.20 0.19 -2.75 5.09 0.24 -1.23 -4.81 118.33 113.86 3gdi n VAL 176 Ca 0.01 -0.18 -0.36 0.00 -2.04 0.00 0.00 64.34 61.77 3gdi n VAL 176 Cb 0.01 0.07 -0.06 0.00 -1.47 0.00 0.00 33.84 32.39 3gdi n VAL 176 CO 0.00 0.00 0.00 -1.61 -2.14 0.00 0.00 176.83 173.08 3gdi s GLU 177 N -1.81 4.46 0.00 7.34 0.41 0.06 -4.93 118.70 124.24 3gdi s GLU 177 Ca 0.09 1.33 0.00 0.00 -0.41 0.00 0.00 54.97 55.98 3gdi s GLU 177 Cb 0.05 -2.66 0.00 0.00 -1.78 0.00 0.00 34.13 29.74 3gdi s GLU 177 CO 0.06 0.16 0.00 0.41 -0.49 0.00 0.00 175.26 175.40 3gdi n GLY 178 N 0.33 -1.81 3.65 -1.39 0.00 -1.26 -5.15 105.19 99.56 3gdi n GLY 178 Ca 0.03 0.74 -0.42 0.00 0.00 0.00 0.00 46.02 46.38 3gdi n GLY 178 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 3gdi n ILE 179 N 0.00 2.29 0.19 -0.61 3.06 -1.26 -4.92 119.36 118.11 3gdi n ILE 179 Ca 0.00 -0.50 0.06 0.00 -2.50 0.00 0.00 62.75 59.81 3gdi n ILE 179 Cb 0.00 -1.34 -0.09 0.00 0.54 0.00 0.00 39.64 38.75 3gdi n ILE 179 CO 0.00 0.00 0.00 0.41 -2.50 0.00 0.00 176.55 174.46 3gdi n THR 180 N -0.10 0.00 -0.03 9.51 -1.04 -1.26 -4.54 114.28 116.82 3gdi n THR 180 Ca 0.07 -0.26 -0.08 0.00 -2.04 0.00 0.00 64.05 61.74 3gdi n THR 180 Cb 0.37 0.47 -0.02 0.00 -1.82 0.00 0.00 70.33 69.33 3gdi n THR 180 CO 0.00 0.00 0.00 0.28 -0.64 0.00 0.00 175.07 174.71 3gdi h SER 181 N 0.00 -0.36 -0.98 8.00 0.02 -1.96 -2.90 113.55 115.37 3gdi h SER 181 Ca 0.00 0.08 -0.66 0.00 -0.84 0.00 0.00 61.79 60.37 3gdi h SER 181 Cb 0.49 0.20 -0.30 0.00 0.14 0.00 0.00 62.40 62.92 3gdi h SER 181 CO 0.00 -0.14 0.76 -0.62 -1.14 0.00 0.00 176.83 175.69 3gdi n GLU 182 N -5.27 2.72 -2.51 3.45 1.02 -1.26 -4.92 120.64 113.87 3gdi n GLU 182 Ca -0.02 -3.33 -0.41 0.00 -0.02 0.00 0.00 57.16 53.38 3gdi n GLU 182 Cb 0.19 -2.28 -0.04 0.00 -0.02 0.00 0.00 31.44 29.28 3gdi n GLU 182 CO 0.00 0.00 0.00 -0.80 1.18 0.00 0.00 177.13 177.51 3gdi s ASN 187 N -1.92 7.25 0.00 1.62 -0.87 -1.10 -4.98 114.94 114.94 3gdi s ASN 187 Ca 0.64 2.07 0.31 0.00 -1.57 0.00 0.00 52.86 54.31 3gdi s ASN 187 Cb 0.50 -2.60 1.81 0.00 -0.02 0.00 0.00 41.25 40.94 3gdi s ASN 187 CO -0.00 -0.24 2.17 0.00 -2.57 0.00 0.00 177.10 176.45 3gdi n ALA 188 N 2.54 2.63 0.01 0.60 0.00 -1.26 -3.20 120.51 121.84 3gdi n ALA 188 Ca 0.03 -0.19 0.03 0.00 0.00 0.00 0.00 53.44 53.32 3gdi n ALA 188 Cb 0.46 -1.51 0.07 0.00 0.00 0.00 0.00 19.45 18.47 3gdi n ALA 188 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 3gdi n ASP 189 N -1.05 2.20 -4.90 0.00 8.00 -1.26 -4.76 116.55 114.78 3gdi n ASP 189 Ca 0.22 -1.76 -0.20 0.00 0.71 0.00 0.00 54.79 53.75 3gdi n ASP 189 Cb 0.13 -0.09 -0.02 0.00 -0.02 0.00 0.00 41.12 41.12 3gdi n ASP 189 CO 0.00 0.00 0.00 -0.04 -0.39 0.00 0.00 177.20 176.77 3gdi s MET 190 N -0.85 2.73 -0.09 -1.24 -1.94 -1.19 -1.24 119.30 115.48 3gdi s MET 190 Ca 0.11 -1.33 -0.30 0.00 -1.71 0.00 0.00 55.69 52.46 3gdi s MET 190 Cb 0.06 -2.53 0.12 0.00 2.01 0.00 0.00 34.83 34.49 3gdi s MET 190 CO 0.08 -0.05 0.97 -0.59 -0.01 0.00 0.00 175.02 175.43 3gdi s PHE 191 N -2.35 -0.33 0.18 -0.03 -0.71 -0.33 -4.81 117.98 109.60 3gdi s PHE 191 Ca 0.45 0.38 0.10 0.00 -1.04 0.00 0.00 56.93 56.82 3gdi s PHE 191 Cb -0.06 0.50 -0.04 0.00 -1.21 0.00 0.00 43.02 42.20 3gdi s PHE 191 CO 0.28 -0.42 -0.17 0.00 -1.34 0.00 0.00 175.22 173.58 3gdi s ALA 192 N -2.18 2.74 -0.22 1.99 0.00 -1.26 -1.00 121.76 121.82 3gdi s ALA 192 Ca 0.03 -1.55 -0.17 0.00 0.00 0.00 0.00 51.96 50.26 3gdi s ALA 192 Cb -0.01 -0.54 0.06 0.00 0.00 0.00 0.00 23.12 22.64 3gdi s ALA 192 CO -0.04 0.45 0.58 0.54 0.00 0.00 0.00 175.76 177.29 3gdi s VAL 193 N -1.67 -0.00 -0.17 0.00 0.11 -1.02 0.71 120.40 118.36 3gdi s VAL 193 Ca 0.23 0.02 -0.04 0.00 -2.93 0.00 0.00 61.98 59.26 3gdi s VAL 193 Cb -0.08 -0.82 -0.02 0.00 -1.53 0.00 0.00 36.38 33.92 3gdi s VAL 193 CO 0.12 0.01 -0.04 0.00 -3.33 0.00 0.00 175.10 171.86 3gdi s ALA 194 N 0.84 2.96 -0.13 1.54 0.00 0.16 -1.03 121.76 126.10 3gdi s ALA 194 Ca -0.04 -0.89 0.02 0.00 0.00 0.00 0.00 51.96 51.04 3gdi s ALA 194 Cb -0.05 -1.59 0.01 0.00 0.00 0.00 0.00 23.12 21.50 3gdi s ALA 194 CO -0.07 0.08 -0.17 0.08 0.00 0.00 0.00 175.76 175.68 3gdi s VAL 195 N 0.59 1.69 -0.07 0.00 1.01 -0.10 -0.79 120.40 122.73 3gdi s VAL 195 Ca -0.03 -0.75 -0.36 0.00 0.00 0.00 0.00 61.98 60.84 3gdi s VAL 195 Cb -0.14 -1.53 -0.14 0.00 0.00 0.00 0.00 36.38 34.56 3gdi s VAL 195 CO 0.03 0.48 1.71 -0.24 0.00 0.00 0.00 175.10 177.07 3gdi n SER 196 N 4.28 2.83 0.07 3.32 2.88 -0.34 -2.09 113.62 124.57 3gdi n SER 196 Ca -0.19 1.04 0.10 0.00 -1.33 0.00 0.00 58.87 58.49 3gdi n SER 196 Cb 0.51 -1.29 0.41 0.00 -0.75 0.00 0.00 64.21 63.09 3gdi n SER 196 CO 0.00 0.00 0.00 -0.11 -1.23 0.00 0.00 175.04 173.70 3gdi n LEU 197 N 5.11 0.37 -0.11 2.46 7.94 -1.26 -0.98 117.00 130.53 3gdi n LEU 197 Ca 0.22 0.59 -0.22 0.00 -1.11 0.00 0.00 56.01 55.49 3gdi n LEU 197 Cb 0.23 -0.54 -0.08 0.00 0.53 0.00 0.00 43.42 43.56 3gdi n LEU 197 CO 0.72 -0.42 -1.24 0.52 -1.11 0.00 0.00 177.39 175.85 3gdi n VAL 198 N -1.91 1.20 -0.06 1.96 0.31 -1.26 -4.77 118.33 113.81 3gdi n VAL 198 Ca 0.03 -0.34 -0.14 0.00 -0.01 0.00 0.00 64.34 63.88 3gdi n VAL 198 Cb 0.20 -1.69 -0.13 0.00 -0.91 0.00 0.00 33.84 31.32 3gdi n VAL 198 CO 0.00 0.00 0.00 0.28 -1.32 0.00 0.00 176.83 175.79 3gdi h SER 199 N -0.64 0.02 0.00 4.52 0.02 -1.94 -3.47 113.55 112.06 3gdi h SER 199 Ca -0.54 -0.91 0.00 0.00 -0.84 0.00 0.00 61.79 59.50 3gdi h SER 199 Cb 1.53 -0.01 0.00 0.00 0.14 0.00 0.00 62.40 64.07 3gdi h SER 199 CO -0.29 0.93 0.00 0.61 -1.14 0.00 0.00 176.83 176.94 3gdi n GLY 200 N 1.38 0.42 3.78 -3.77 0.00 -0.15 -4.97 105.19 101.87 3gdi n GLY 200 Ca -0.10 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.55 3gdi n GLY 200 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3gdi s LYS 201 N -0.94 3.89 -0.76 1.61 -0.14 -1.26 -1.36 119.74 120.78 3gdi s LYS 201 Ca 0.00 1.68 -0.26 0.00 -1.36 0.00 0.00 55.97 56.04 3gdi s LYS 201 Cb 0.00 -2.44 0.04 0.00 -1.68 0.00 0.00 37.83 33.75 3gdi s LYS 201 CO 0.00 -0.42 1.24 0.42 -0.76 0.00 0.00 175.35 175.83 3gdi s ILE 202 N -1.59 3.88 -0.00 2.17 1.01 0.12 -1.20 121.20 125.58 3gdi s ILE 202 Ca 0.62 0.09 -0.25 0.00 0.00 0.00 0.00 60.65 61.10 3gdi s ILE 202 Cb -0.26 -4.89 -0.18 0.00 0.01 0.00 0.00 42.46 37.14 3gdi s ILE 202 CO 0.32 -1.79 1.26 -0.07 0.00 0.00 0.00 174.94 174.67 3gdi h LEU 203 N 12.63 -0.13 -8.15 2.97 3.38 -1.30 -3.44 115.31 121.26 3gdi h LEU 203 Ca -0.22 -0.33 -0.48 0.00 0.09 0.00 0.00 57.88 56.95 3gdi h LEU 203 Cb 1.05 0.03 -0.30 0.00 0.09 0.00 0.00 40.66 41.54 3gdi h LEU 203 CO 1.27 0.28 -0.81 -0.47 0.09 0.00 0.00 178.44 178.81 3gdi s TYR 204 N -4.48 1.22 -0.05 1.13 5.04 -1.08 -4.97 117.35 114.15 3gdi s TYR 204 Ca -0.15 -0.26 0.01 0.00 -2.44 0.00 0.00 57.07 54.24 3gdi s TYR 204 Cb 0.02 -0.80 0.02 0.00 0.35 0.00 0.00 41.96 41.55 3gdi s TYR 204 CO 0.61 -0.05 -0.07 -1.50 -1.34 0.00 0.00 175.55 173.20 3gdi s ILE 205 N -0.18 0.73 0.59 3.14 -1.16 -1.26 0.38 121.20 123.43 3gdi s ILE 205 Ca 0.03 -0.22 -0.17 0.00 -0.51 0.00 0.00 60.65 59.77 3gdi s ILE 205 Cb -0.07 -0.72 -0.04 0.00 0.61 0.00 0.00 42.46 42.24 3gdi s ILE 205 CO -0.00 0.27 1.08 -0.55 -2.81 0.00 0.00 174.94 172.93 3gdi s SER 206 N 0.92 5.67 1.19 4.50 0.15 0.22 -4.98 113.70 121.38 3gdi s SER 206 Ca -0.11 1.94 -0.17 0.00 0.70 0.00 0.00 55.95 58.32 3gdi s SER 206 Cb -0.15 -2.55 0.24 0.00 -1.71 0.00 0.00 66.02 61.86 3gdi s SER 206 CO 0.01 -1.24 0.89 0.59 1.20 0.00 0.00 173.24 174.69 3gdi n ASN 207 N -1.85 -1.81 0.00 5.45 3.02 -1.26 -3.89 115.26 114.92 3gdi n ASN 207 Ca 0.10 -1.06 0.00 0.00 -0.03 0.00 0.00 54.58 53.59 3gdi n ASN 207 Cb 0.52 -0.81 0.00 0.00 -0.61 0.00 0.00 39.78 38.88 3gdi n ASN 207 CO 0.00 0.00 0.00 1.67 -2.62 0.00 0.00 177.26 176.31 3gdi n GLN 208 N -4.17 0.00 0.19 3.52 7.27 -1.26 -4.82 117.38 118.11 3gdi n GLN 208 Ca 0.12 0.00 -0.15 0.00 0.07 0.00 0.00 57.00 57.05 3gdi n GLN 208 Cb 0.48 -2.29 -0.08 0.00 2.41 0.00 0.00 30.24 30.76 3gdi n GLN 208 CO 0.00 0.00 0.00 -0.39 0.07 0.00 0.00 177.06 176.74 3gdi h VAL 209 N 0.00 0.71 0.00 1.69 -1.51 -1.88 -1.03 116.25 114.23 3gdi h VAL 209 Ca 0.00 0.00 -0.01 0.00 -1.23 0.00 0.00 66.70 65.46 3gdi h VAL 209 Cb 0.00 0.71 -0.00 0.00 -2.13 0.00 0.00 31.29 29.86 3gdi h VAL 209 CO 0.00 0.00 -0.05 0.00 -1.23 0.00 0.00 177.57 176.29 3gdi h ALA 210 N 0.30 1.49 0.52 5.19 0.00 -1.89 -2.54 119.26 122.34 3gdi h ALA 210 Ca -0.04 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 54.80 3gdi h ALA 210 Cb 0.31 -0.01 0.01 0.00 0.00 0.00 0.00 17.79 18.10 3gdi h ALA 210 CO 0.07 0.06 -0.25 1.03 0.00 0.00 0.00 179.25 180.16 3gdi h SER 211 N 0.00 -0.59 0.00 0.00 0.87 -1.65 -2.56 113.55 109.61 3gdi h SER 211 Ca -0.00 -0.05 0.00 0.00 -1.23 0.00 0.00 61.79 60.51 3gdi h SER 211 Cb 0.12 0.15 0.00 0.00 -0.44 0.00 0.00 62.40 62.23 3gdi h SER 211 CO 0.01 -0.28 0.00 2.30 -0.53 0.00 0.00 176.83 178.32 3gdi n ILE 212 N -5.31 0.00 0.00 2.23 -5.35 -0.50 -5.13 119.36 105.30 3gdi n ILE 212 Ca -0.11 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.37 3gdi n ILE 212 Cb 0.32 -0.19 0.00 0.00 -1.74 0.00 0.00 39.64 38.03 3gdi n ILE 212 CO 0.00 0.00 0.00 0.49 -1.76 0.00 0.00 176.55 175.28 3gdi n PHE 213 N -0.40 0.00 0.00 4.28 3.01 -0.97 -5.08 117.46 118.29 3gdi n PHE 213 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.46 3gdi n PHE 213 Cb 0.02 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.49 3gdi n PHE 213 CO 0.00 0.00 0.00 -1.13 1.01 0.00 0.00 176.76 176.64 3gdi n SER 221 N 0.00 0.00 -2.95 4.37 3.41 -1.26 -4.93 113.62 112.26 3gdi n SER 221 Ca 0.00 0.00 -0.10 0.00 -0.26 0.00 0.00 58.87 58.51 3gdi n SER 221 Cb 0.00 0.00 0.01 0.00 -0.26 0.00 0.00 64.21 63.96 3gdi n SER 221 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 3gdi n ASP 222 N 0.00 -7.68 0.00 4.04 -0.08 -1.26 -5.05 116.55 106.52 3gdi n ASP 222 Ca 0.00 0.37 0.00 0.00 -1.51 0.00 0.00 54.79 53.65 3gdi n ASP 222 Cb 0.00 -5.00 0.00 0.00 2.34 0.00 0.00 41.12 38.46 3gdi n ASP 222 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 3gdi n ALA 223 N -0.52 0.00 -2.70 -1.67 0.00 -1.26 -4.92 120.51 109.44 3gdi n ALA 223 Ca 0.08 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 53.10 3gdi n ALA 223 Cb 0.49 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.91 3gdi n ALA 223 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 3gdi s LYS 224 N 1.58 4.51 0.35 0.00 1.02 -1.26 0.16 119.74 126.11 3gdi s LYS 224 Ca 0.00 1.40 0.04 0.00 0.02 0.00 0.00 55.97 57.43 3gdi s LYS 224 Cb 0.00 -3.49 0.69 0.00 -0.52 0.00 0.00 37.83 34.51 3gdi s LYS 224 CO 0.00 -0.14 1.98 0.35 -0.92 0.00 0.00 175.35 176.61 3gdi h PHE 225 N 6.91 0.79 -0.07 3.18 3.57 -1.52 -2.14 116.94 127.66 3gdi h PHE 225 Ca -0.37 0.02 0.02 0.00 3.53 0.00 0.00 57.97 61.17 3gdi h PHE 225 Cb 1.19 -0.26 -0.00 0.00 2.79 0.00 0.00 35.95 39.67 3gdi h PHE 225 CO 0.69 0.45 0.08 -0.39 -2.23 0.00 0.00 178.31 176.91 3gdi h VAL 226 N 0.81 0.55 0.00 1.41 -1.51 -1.92 -1.85 116.25 113.74 3gdi h VAL 226 Ca 0.28 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.75 3gdi h VAL 226 Cb 0.11 0.94 0.00 0.00 -2.13 0.00 0.00 31.29 30.21 3gdi h VAL 226 CO -0.08 0.00 0.00 -0.33 -1.23 0.00 0.00 177.57 175.93 3gdi h GLU 227 N 0.00 0.00 -0.68 5.19 5.08 -1.77 -1.82 114.58 120.58 3gdi h GLU 227 Ca 0.03 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.39 3gdi h GLU 227 Cb 0.18 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.43 3gdi h GLU 227 CO -0.00 0.00 0.00 1.19 -1.00 0.00 0.00 179.01 179.20 3gdi n PHE 228 N -2.61 1.23 -4.07 4.33 3.01 -0.70 -4.95 117.46 113.71 3gdi n PHE 228 Ca -0.01 -0.56 -0.24 0.00 1.01 0.00 0.00 57.45 57.65 3gdi n PHE 228 Cb 0.14 -0.13 -0.04 0.00 -0.01 0.00 0.00 39.48 39.43 3gdi n PHE 228 CO 0.00 0.00 0.00 -0.51 1.01 0.00 0.00 176.76 177.26 3gdi s LEU 229 N -1.45 3.93 0.37 4.37 1.02 -0.68 -0.09 118.68 126.14 3gdi s LEU 229 Ca 0.50 -0.11 -0.28 0.00 0.02 0.00 0.00 54.13 54.25 3gdi s LEU 229 Cb 0.29 -2.50 -0.11 0.00 0.02 0.00 0.00 46.19 43.89 3gdi s LEU 229 CO 0.28 0.02 1.51 0.00 0.02 0.00 0.00 176.35 178.18 3gdi s ALA 230 N -1.90 3.60 0.52 4.21 0.00 -0.36 -4.84 121.76 122.98 3gdi s ALA 230 Ca 0.32 1.60 0.24 0.00 0.00 0.00 0.00 51.96 54.13 3gdi s ALA 230 Cb -0.09 -3.62 1.36 0.00 0.00 0.00 0.00 23.12 20.76 3gdi s ALA 230 CO 0.25 -1.08 1.98 -1.35 0.00 0.00 0.00 175.76 175.56 3gdi h PRO 231 N 3.13 0.05 0.00 0.00 0.11 -1.92 -0.50 132.00 132.87 3gdi h PRO 231 Ca -0.51 -0.00 -0.06 0.00 0.11 0.00 0.00 66.00 65.54 3gdi h PRO 231 Cb 1.24 -0.01 -0.01 0.00 0.11 0.00 0.00 31.00 32.33 3gdi h PRO 231 CO 0.65 0.03 -0.31 0.45 -0.21 0.00 0.00 178.00 178.62 3gdi h HIS 232 N 0.05 0.00 -0.00 0.65 3.86 -2.00 -3.23 115.15 114.49 3gdi h HIS 232 Ca 0.27 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.48 3gdi h HIS 232 Cb 1.02 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.49 3gdi h HIS 232 CO -0.00 0.31 -0.34 -0.25 0.86 0.00 0.00 177.93 178.50 3gdi n ASP 233 N -3.31 0.42 0.04 2.45 8.00 -0.21 -4.21 116.55 119.74 3gdi n ASP 233 Ca 0.01 -0.14 -0.12 0.00 0.71 0.00 0.00 54.79 55.25 3gdi n ASP 233 Cb 0.55 0.05 -0.06 0.00 -0.02 0.00 0.00 41.12 41.64 3gdi n ASP 233 CO 0.00 0.00 0.00 0.58 -0.39 0.00 0.00 177.20 177.39 3gdi h VAL 234 N 0.12 0.91 -0.52 2.53 2.07 -1.54 0.06 116.25 119.87 3gdi h VAL 234 Ca 0.00 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.53 3gdi h VAL 234 Cb 0.49 0.91 -0.03 0.00 -1.52 0.00 0.00 31.29 31.14 3gdi h VAL 234 CO 0.00 0.00 0.34 0.77 0.02 0.00 0.00 177.57 178.70 3gdi h SER 235 N -0.06 0.56 0.05 0.57 4.64 -1.80 -1.96 113.55 115.56 3gdi h SER 235 Ca 0.02 -0.01 -0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3gdi h SER 235 Cb 0.08 -0.14 0.00 0.00 -0.31 0.00 0.00 62.40 62.03 3gdi h SER 235 CO -0.04 0.40 -0.03 0.58 -0.87 0.00 0.00 176.83 176.88 3gdi h VAL 236 N 0.66 1.09 -0.68 0.95 2.07 -1.60 -2.05 116.25 116.69 3gdi h VAL 236 Ca 0.20 -0.49 0.10 0.00 0.82 0.00 0.00 66.70 67.32 3gdi h VAL 236 Cb -0.02 1.42 -0.07 0.00 -1.52 0.00 0.00 31.29 31.10 3gdi h VAL 236 CO -0.05 0.12 0.31 0.15 0.02 0.00 0.00 177.57 178.13 3gdi h PHE 237 N -0.29 0.56 -0.56 1.57 3.04 -0.36 -1.75 116.94 119.14 3gdi h PHE 237 Ca -0.01 0.03 -0.09 0.00 3.98 0.00 0.00 57.97 61.89 3gdi h PHE 237 Cb 0.26 -0.15 -0.02 0.00 2.56 0.00 0.00 35.95 38.60 3gdi h PHE 237 CO -0.00 0.18 0.02 0.45 -2.02 0.00 0.00 178.31 176.94 3gdi h HIS 238 N 0.53 1.06 -0.42 0.41 3.86 -1.34 -2.09 115.15 117.18 3gdi h HIS 238 Ca 0.34 -0.18 0.02 0.00 -1.16 0.00 0.00 60.37 59.39 3gdi h HIS 238 Cb 0.38 -0.28 -0.03 0.00 1.06 0.00 0.00 27.41 28.55 3gdi h HIS 238 CO -0.13 0.95 0.25 1.03 0.86 0.00 0.00 177.93 180.90 3gdi h SER 239 N 0.87 0.41 0.29 2.45 0.87 -0.60 -1.49 113.55 116.35 3gdi h SER 239 Ca 0.16 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.72 3gdi h SER 239 Cb 0.52 -0.09 0.00 0.00 -0.44 0.00 0.00 62.40 62.39 3gdi h SER 239 CO 0.03 0.29 -0.07 -1.22 -0.53 0.00 0.00 176.83 175.33 3gdi n TYR 240 N -4.84 0.00 -0.03 2.24 4.01 -0.73 -3.26 117.16 114.54 3gdi n TYR 240 Ca 0.01 0.00 0.04 0.00 -0.16 0.00 0.00 57.90 57.79 3gdi n TYR 240 Cb 0.06 -0.15 0.09 0.00 -0.31 0.00 0.00 39.34 39.03 3gdi n TYR 240 CO 0.00 0.00 0.00 0.25 -0.46 0.00 0.00 176.86 176.65 3gdi n THR 241 N -0.90 0.79 -1.72 -0.72 -2.24 -0.79 -4.68 114.28 104.01 3gdi n THR 241 Ca 0.16 -0.89 -0.42 0.00 -2.27 0.00 0.00 64.05 60.63 3gdi n THR 241 Cb 0.25 0.64 -0.03 0.00 -2.10 0.00 0.00 70.33 69.09 3gdi n THR 241 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 3gdi n THR 242 N 0.24 0.12 -0.26 4.28 -1.04 -0.60 -4.93 114.28 112.10 3gdi n THR 242 Ca 0.07 -0.03 -0.10 0.00 -2.04 0.00 0.00 64.05 61.95 3gdi n THR 242 Cb 0.33 -1.99 -0.07 0.00 -1.82 0.00 0.00 70.33 66.79 3gdi n THR 242 CO 0.00 0.00 0.00 -0.65 -0.64 0.00 0.00 175.07 173.78 3gdi h PRO 243 N 6.55 -0.20 0.00 -2.82 0.11 -1.93 -0.40 132.00 133.31 3gdi h PRO 243 Ca -0.44 0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.69 3gdi h PRO 243 Cb 1.20 0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.36 3gdi h PRO 243 CO 0.94 -0.13 0.00 2.48 -0.21 0.00 0.00 178.00 181.08 3gdi n TYR 244 N -5.36 0.00 -3.19 0.65 4.11 -1.26 -4.45 117.16 107.66 3gdi n TYR 244 Ca 0.01 0.00 0.00 0.00 -0.00 0.00 0.00 57.90 57.91 3gdi n TYR 244 Cb 0.33 0.00 0.00 0.00 -0.00 0.00 0.00 39.34 39.67 3gdi n TYR 244 CO 0.00 0.00 0.00 1.63 -0.00 0.00 0.00 176.86 178.49 3gdi n LYS 245 N -0.68 3.39 -1.42 -3.48 5.02 -0.16 -5.09 118.16 115.74 3gdi n LYS 245 Ca 0.00 0.00 0.05 0.00 -2.02 0.00 0.00 58.31 56.34 3gdi n LYS 245 Cb 0.00 0.00 -0.03 0.00 -0.02 0.00 0.00 35.03 34.98 3gdi n LYS 245 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 3gdi n LEU 246 N 0.00 -1.38 -4.49 -0.35 4.77 -1.26 -4.93 117.00 109.36 3gdi n LEU 246 Ca 0.00 2.53 -0.33 0.00 -0.03 0.00 0.00 56.01 58.17 3gdi n LEU 246 Cb 0.00 -2.83 -0.12 0.00 -2.33 0.00 0.00 43.42 38.13 3gdi n LEU 246 CO 0.00 -1.13 -0.39 -2.16 -1.33 0.00 0.00 177.39 172.37 3gdi s PRO 247 N -4.99 3.20 0.36 3.23 0.04 -1.26 -4.89 135.00 130.69 3gdi s PRO 247 Ca 0.00 -0.59 -0.28 0.00 0.04 0.00 0.00 61.00 60.17 3gdi s PRO 247 Cb 0.00 -2.69 -0.12 0.00 0.04 0.00 0.00 34.50 31.73 3gdi s PRO 247 CO 0.00 0.41 1.39 -2.30 0.04 0.00 0.00 177.00 176.53 3gdi n PRO 248 N 2.99 2.40 -1.62 0.56 -0.02 -1.26 -2.94 135.00 135.11 3gdi n PRO 248 Ca -0.18 0.84 -0.38 0.00 -2.02 0.00 0.00 63.50 61.76 3gdi n PRO 248 Cb 0.53 -2.50 -0.03 0.00 -0.02 0.00 0.00 33.50 31.48 3gdi n PRO 248 CO 0.00 0.00 0.00 -0.46 1.98 0.00 0.00 175.50 177.02 3gdi s TRP 249 N -1.09 1.16 -0.87 6.00 -0.11 -1.09 -4.86 118.94 118.08 3gdi s TRP 249 Ca 0.54 1.19 -0.05 0.00 1.22 0.00 0.00 56.10 59.00 3gdi s TRP 249 Cb -0.52 -3.73 -0.00 0.00 -1.50 0.00 0.00 33.47 27.71 3gdi s TRP 249 CO 0.63 -2.98 0.69 0.43 -4.62 0.00 0.00 176.95 171.10 3gdi n SER 250 N 14.31 -6.09 -4.60 5.86 7.64 -1.26 -5.08 113.62 124.39 3gdi n SER 250 Ca 0.33 -0.64 -0.24 0.00 1.01 0.00 0.00 58.87 59.32 3gdi n SER 250 Cb 0.52 -3.48 -0.09 0.00 -1.01 0.00 0.00 64.21 60.15 3gdi n SER 250 CO 0.00 0.00 0.00 -0.70 -3.01 0.00 0.00 175.04 171.33 3gdi s GLU 265 N -4.47 2.03 -0.68 1.43 2.56 -1.26 -5.21 118.70 113.10 3gdi s GLU 265 Ca 0.12 -1.70 -0.03 0.00 0.00 0.00 0.00 54.97 53.36 3gdi s GLU 265 Cb -0.04 -1.93 0.19 0.00 2.00 0.00 0.00 34.13 34.34 3gdi s GLU 265 CO 0.83 0.21 2.43 1.63 -0.56 0.00 0.00 175.26 179.80 3gdi n LYS 266 N -0.88 2.82 -4.42 4.30 5.02 -1.26 -4.93 118.16 118.81 3gdi n LYS 266 Ca -0.05 -2.97 -0.30 0.00 -2.02 0.00 0.00 58.31 52.98 3gdi n LYS 266 Cb 0.61 -2.24 -0.12 0.00 -0.02 0.00 0.00 35.03 33.27 3gdi n LYS 266 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 3gdi s SER 267 N -0.26 3.83 0.36 4.39 0.01 -1.26 -4.26 113.70 116.50 3gdi s SER 267 Ca 0.55 -0.53 0.04 0.00 1.31 0.00 0.00 55.95 57.32 3gdi s SER 267 Cb 0.38 -0.55 -0.05 0.00 0.21 0.00 0.00 66.02 66.02 3gdi s SER 267 CO -0.28 0.20 0.08 0.72 0.41 0.00 0.00 173.24 174.37 3gdi s PHE 268 N -1.07 1.88 0.05 2.43 -0.12 -0.50 -4.94 117.98 115.70 3gdi s PHE 268 Ca 0.17 -1.08 0.08 0.00 -0.05 0.00 0.00 56.93 56.04 3gdi s PHE 268 Cb -0.11 -1.24 -0.03 0.00 -0.63 0.00 0.00 43.02 41.01 3gdi s PHE 268 CO 0.08 -0.10 -0.19 -0.06 -0.05 0.00 0.00 175.22 174.89 3gdi s PHE 269 N -3.26 2.52 -0.03 3.49 0.40 -1.26 -0.62 117.98 119.21 3gdi s PHE 269 Ca 0.30 -0.28 -0.09 0.00 -0.60 0.00 0.00 56.93 56.26 3gdi s PHE 269 Cb 0.06 -1.44 0.01 0.00 0.51 0.00 0.00 43.02 42.16 3gdi s PHE 269 CO 0.14 0.24 0.20 0.00 0.70 0.00 0.00 175.22 176.51 3gdi s ARG 271 N -0.81 4.11 0.07 0.00 0.52 -1.26 -0.09 118.95 121.47 3gdi s ARG 271 Ca -0.09 -0.02 0.07 0.00 -0.52 0.00 0.00 55.73 55.17 3gdi s ARG 271 Cb -0.05 -3.56 -0.04 0.00 0.52 0.00 0.00 34.95 31.83 3gdi s ARG 271 CO 0.02 -0.03 -0.13 0.08 0.02 0.00 0.00 175.30 175.25 3gdi s VAL 272 N 1.32 3.16 -0.15 3.52 1.01 -0.80 -1.23 120.40 127.22 3gdi s VAL 272 Ca 0.14 -1.18 -0.09 0.00 0.00 0.00 0.00 61.98 60.85 3gdi s VAL 272 Cb -0.14 -2.41 0.05 0.00 0.00 0.00 0.00 36.38 33.88 3gdi s VAL 272 CO 0.07 0.24 0.38 -0.55 0.00 0.00 0.00 175.10 175.23 3gdi s SER 273 N -1.79 -0.46 -1.21 3.32 0.15 0.87 -1.90 113.70 112.68 3gdi s SER 273 Ca 0.18 0.81 -0.07 0.00 0.70 0.00 0.00 55.95 57.57 3gdi s SER 273 Cb -0.11 0.70 0.03 0.00 -1.71 0.00 0.00 66.02 64.93 3gdi s SER 273 CO 0.09 -0.18 2.68 0.52 1.20 0.00 0.00 173.24 177.55 3gdi n VAL 274 N 4.14 4.60 -1.95 4.45 0.31 -1.26 -4.60 118.33 124.03 3gdi n VAL 274 Ca -0.23 -3.48 0.12 0.00 -0.01 0.00 0.00 64.34 60.74 3gdi n VAL 274 Cb 0.55 -2.16 -0.03 0.00 -0.91 0.00 0.00 33.84 31.29 3gdi n VAL 274 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3gdi n GLY 275 N 2.19 -1.36 0.00 2.92 0.00 -1.26 -5.10 105.19 102.58 3gdi n GLY 275 Ca 0.64 -0.91 0.00 0.00 0.00 0.00 0.00 46.02 45.75 3gdi n GLY 275 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3gdi n LYS 276 N -3.13 0.00 -0.90 1.61 5.02 -1.26 -4.68 118.16 114.82 3gdi n LYS 276 Ca 0.01 0.00 -0.35 0.00 -2.02 0.00 0.00 58.31 55.95 3gdi n LYS 276 Cb 0.41 0.00 0.08 0.00 -0.02 0.00 0.00 35.03 35.50 3gdi n LYS 276 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 3gdi n GLU 281 N 0.00 -0.15 -2.35 1.97 1.02 -1.26 -5.14 120.64 114.73 3gdi n GLU 281 Ca 0.00 -0.02 -0.36 0.00 -0.02 0.00 0.00 57.16 56.75 3gdi n GLU 281 Cb 0.00 -1.40 -0.02 0.00 -0.02 0.00 0.00 31.44 30.00 3gdi n GLU 281 CO 0.00 0.00 0.00 0.96 1.18 0.00 0.00 177.13 179.27 3gdi s ILE 282 N -2.19 3.32 -0.21 -3.67 -5.25 -1.26 -5.05 121.20 106.89 3gdi s ILE 282 Ca 0.48 0.96 -0.00 0.00 -0.99 0.00 0.00 60.65 61.09 3gdi s ILE 282 Cb -0.19 -3.47 0.02 0.00 2.95 0.00 0.00 42.46 41.77 3gdi s ILE 282 CO 0.75 -0.04 -0.13 -0.13 -1.79 0.00 0.00 174.94 173.61 3gdi s ARG 283 N -2.76 2.92 0.25 0.37 0.52 -1.26 -5.12 118.95 113.87 3gdi s ARG 283 Ca 0.64 -0.90 0.06 0.00 -0.52 0.00 0.00 55.73 55.01 3gdi s ARG 283 Cb -0.25 -2.79 -0.03 0.00 0.52 0.00 0.00 34.95 32.39 3gdi s ARG 283 CO 0.31 -0.30 0.30 0.71 0.02 0.00 0.00 175.30 176.33 3gdi s TYR 284 N 1.31 3.31 -0.05 -0.53 2.02 -1.26 -4.55 117.35 117.59 3gdi s TYR 284 Ca 0.02 -0.06 -0.02 0.00 -0.37 0.00 0.00 57.07 56.64 3gdi s TYR 284 Cb -0.15 -1.51 0.03 0.00 -0.40 0.00 0.00 41.96 39.93 3gdi s TYR 284 CO -0.08 0.46 0.08 -0.65 -1.57 0.00 0.00 175.55 173.79 3gdi s GLN 285 N -3.93 -0.02 0.38 -0.62 -0.21 -0.80 -4.93 119.66 109.53 3gdi s GLN 285 Ca 0.34 0.35 -0.28 0.00 0.02 0.00 0.00 55.36 55.79 3gdi s GLN 285 Cb -0.09 -0.33 -0.11 0.00 1.00 0.00 0.00 33.01 33.49 3gdi s GLN 285 CO 0.27 -0.25 1.45 -1.25 -2.12 0.00 0.00 175.29 173.39 3gdi s PRO 286 N 1.69 4.12 -0.01 2.91 0.04 -1.26 -1.91 135.00 140.57 3gdi s PRO 286 Ca -0.02 2.49 0.01 0.00 0.04 0.00 0.00 61.00 63.52 3gdi s PRO 286 Cb -0.12 -2.96 0.00 0.00 0.04 0.00 0.00 34.50 31.47 3gdi s PRO 286 CO -0.04 -0.50 -0.03 -0.06 0.04 0.00 0.00 177.00 176.41 3gdi s PHE 287 N -1.13 0.39 -0.13 0.56 0.08 0.86 -1.99 117.98 116.62 3gdi s PHE 287 Ca 0.53 -0.07 -0.14 0.00 0.12 0.00 0.00 56.93 57.37 3gdi s PHE 287 Cb -0.45 -0.30 -0.05 0.00 -0.57 0.00 0.00 43.02 41.65 3gdi s PHE 287 CO 0.61 -0.04 0.32 0.50 -0.10 0.00 0.00 175.22 176.51 3gdi s ARG 288 N 0.19 4.18 -0.00 0.44 3.52 0.11 -1.52 118.95 125.86 3gdi s ARG 288 Ca -0.02 0.17 0.04 0.00 -0.13 0.00 0.00 55.73 55.80 3gdi s ARG 288 Cb -0.05 -3.39 -0.01 0.00 -1.56 0.00 0.00 34.95 29.94 3gdi s ARG 288 CO -0.00 0.32 -0.14 -1.64 -0.81 0.00 0.00 175.30 173.02 3gdi s MET 289 N 0.20 1.11 -0.18 5.12 -1.94 0.21 -0.25 119.30 123.57 3gdi s MET 289 Ca 0.19 -0.55 0.00 0.00 -1.71 0.00 0.00 55.69 53.61 3gdi s MET 289 Cb -0.14 -1.09 0.01 0.00 2.01 0.00 0.00 34.83 35.63 3gdi s MET 289 CO 0.06 0.29 -0.17 0.99 -0.01 0.00 0.00 175.02 176.18 3gdi s THR 290 N -0.42 2.35 -0.08 2.05 2.01 -0.57 -1.42 115.64 119.56 3gdi s THR 290 Ca 0.05 -0.85 -0.20 0.00 0.31 0.00 0.00 61.69 61.00 3gdi s THR 290 Cb -0.06 -2.00 -0.04 0.00 0.01 0.00 0.00 72.50 70.41 3gdi s THR 290 CO -0.00 0.52 0.55 -2.16 -0.69 0.00 0.00 174.62 172.83 3gdi s PRO 291 N 1.22 4.33 -0.04 4.92 0.04 -1.26 -1.68 135.00 142.54 3gdi s PRO 291 Ca 0.03 0.60 0.03 0.00 0.04 0.00 0.00 61.00 61.70 3gdi s PRO 291 Cb -0.14 -3.41 0.00 0.00 0.04 0.00 0.00 34.50 31.00 3gdi s PRO 291 CO -0.09 0.21 -0.12 0.71 0.04 0.00 0.00 177.00 177.76 3gdi s TYR 292 N 0.38 1.26 -0.09 0.56 2.02 0.10 -4.24 117.35 117.34 3gdi s TYR 292 Ca 0.29 -0.35 -0.29 0.00 -0.37 0.00 0.00 57.07 56.35 3gdi s TYR 292 Cb -0.16 -0.88 -0.02 0.00 -0.40 0.00 0.00 41.96 40.50 3gdi s TYR 292 CO 0.14 -0.14 0.96 -1.17 -1.57 0.00 0.00 175.55 173.76 3gdi s LEU 293 N 0.21 4.26 -0.10 -1.29 0.20 -1.15 0.18 118.68 120.99 3gdi s LEU 293 Ca -0.05 1.49 -0.09 0.00 0.69 0.00 0.00 54.13 56.17 3gdi s LEU 293 Cb -0.10 -3.49 0.03 0.00 -0.43 0.00 0.00 46.19 42.19 3gdi s LEU 293 CO 0.01 -0.39 0.27 -0.69 -0.29 0.00 0.00 176.35 175.27 3gdi s VAL 294 N 1.79 -0.00 0.27 1.68 1.01 -1.14 -2.69 120.40 121.33 3gdi s VAL 294 Ca 0.47 0.01 -0.14 0.00 0.00 0.00 0.00 61.98 62.32 3gdi s VAL 294 Cb -0.18 -0.39 -0.08 0.00 0.00 0.00 0.00 36.38 35.72 3gdi s VAL 294 CO 0.19 0.00 0.67 -0.54 0.00 0.00 0.00 175.10 175.42 3gdi s LYS 295 N 0.22 3.98 0.00 2.72 1.02 -1.26 0.51 119.74 126.92 3gdi s LYS 295 Ca -0.01 0.58 0.00 0.00 0.02 0.00 0.00 55.97 56.56 3gdi s LYS 295 Cb -0.02 -2.58 0.00 0.00 -0.52 0.00 0.00 37.83 34.71 3gdi s LYS 295 CO -0.00 0.25 0.00 0.28 -0.92 0.00 0.00 175.35 174.96 3gdi n VAL 296 N -0.08 0.00 -1.51 3.17 0.31 -1.26 -2.65 118.33 116.32 3gdi n VAL 296 Ca 0.01 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.34 3gdi n VAL 296 Cb 0.53 -0.52 0.00 0.00 -0.91 0.00 0.00 33.84 32.93 3gdi n VAL 296 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3gdi n GLN 305 N -2.06 -2.38 -3.49 5.55 10.64 -1.26 -4.96 117.38 119.42 3gdi n GLN 305 Ca 0.00 1.75 -0.38 0.00 -1.83 0.00 0.00 57.00 56.53 3gdi n GLN 305 Cb 0.39 -2.22 -0.10 0.00 -0.86 0.00 0.00 30.24 27.45 3gdi n GLN 305 CO 0.00 0.00 0.00 -0.48 -1.83 0.00 0.00 177.06 174.75 3gdi s LEU 306 N -2.44 4.05 0.00 2.61 2.34 -1.26 -5.04 118.68 118.93 3gdi s LEU 306 Ca 0.00 0.19 0.00 0.00 0.06 0.00 0.00 54.13 54.38 3gdi s LEU 306 Cb 0.00 -2.29 0.00 0.00 -0.56 0.00 0.00 46.19 43.34 3gdi s LEU 306 CO 0.00 -0.10 0.00 0.00 -1.06 0.00 0.00 176.35 175.19 3gdi s LEU 309 N 2.64 4.23 -0.08 0.00 0.20 0.13 -0.93 118.68 124.87 3gdi s LEU 309 Ca 0.01 0.42 -0.05 0.00 0.69 0.00 0.00 54.13 55.19 3gdi s LEU 309 Cb -0.13 -3.18 0.03 0.00 -0.43 0.00 0.00 46.19 42.48 3gdi s LEU 309 CO -0.14 -0.02 0.20 -0.76 -0.29 0.00 0.00 176.35 175.33 3gdi s LEU 310 N -3.22 0.90 -0.29 -0.68 1.02 -0.20 0.03 118.68 116.25 3gdi s LEU 310 Ca 0.39 0.41 -0.14 0.00 0.02 0.00 0.00 54.13 54.81 3gdi s LEU 310 Cb -0.11 0.63 -0.03 0.00 0.02 0.00 0.00 46.19 46.69 3gdi s LEU 310 CO 0.28 -0.11 0.33 -0.76 0.02 0.00 0.00 176.35 176.11 3gdi s LEU 311 N 0.66 4.12 -0.16 1.79 1.43 -0.68 -2.44 118.68 123.41 3gdi s LEU 311 Ca -0.05 0.11 -0.02 0.00 -1.03 0.00 0.00 54.13 53.14 3gdi s LEU 311 Cb -0.06 -2.34 -0.01 0.00 0.03 0.00 0.00 46.19 43.80 3gdi s LEU 311 CO -0.04 -0.19 -0.09 0.00 0.23 0.00 0.00 176.35 176.26 3gdi s ALA 312 N 1.99 2.74 -0.13 4.21 0.00 -0.17 -1.52 121.76 128.89 3gdi s ALA 312 Ca 0.13 -0.97 0.03 0.00 0.00 0.00 0.00 51.96 51.14 3gdi s ALA 312 Cb -0.16 -1.43 0.01 0.00 0.00 0.00 0.00 23.12 21.54 3gdi s ALA 312 CO 0.11 0.01 -0.22 -2.00 0.00 0.00 0.00 175.76 173.65 3gdi s GLU 313 N 0.74 2.98 0.25 0.00 2.12 0.65 -1.19 118.70 124.26 3gdi s GLU 313 Ca -0.04 -0.85 -0.30 0.00 0.36 0.00 0.00 54.97 54.14 3gdi s GLU 313 Cb -0.15 -2.36 -0.10 0.00 0.26 0.00 0.00 34.13 31.78 3gdi s GLU 313 CO 0.02 0.04 1.47 0.50 -0.54 0.00 0.00 175.26 176.75 3gdi s ARG 314 N 0.67 4.24 -0.13 4.30 3.00 -0.37 0.06 118.95 130.73 3gdi s ARG 314 Ca -0.11 2.34 -0.09 0.00 -1.00 0.00 0.00 55.73 56.88 3gdi s ARG 314 Cb -0.16 -3.10 -0.04 0.00 0.00 0.00 0.00 34.95 31.64 3gdi s ARG 314 CO 0.01 -0.46 0.18 0.08 0.00 0.00 0.00 175.30 175.11 3gdi s VAL 315 N 0.06 5.43 -0.03 7.11 1.01 -0.84 -4.86 120.40 128.28 3gdi s VAL 315 Ca 0.61 0.29 0.04 0.00 0.00 0.00 0.00 61.98 62.92 3gdi s VAL 315 Cb -0.43 -3.46 -0.03 0.00 0.00 0.00 0.00 36.38 32.46 3gdi s VAL 315 CO 0.43 0.56 -0.14 -1.00 0.00 0.00 0.00 175.10 174.95 3gdi s HIS 316 N -0.64 2.70 0.04 5.22 3.76 -1.26 -4.75 115.29 120.36 3gdi s HIS 316 Ca 0.15 -0.16 -0.34 0.00 -0.15 0.00 0.00 55.06 54.55 3gdi s HIS 316 Cb -0.12 -1.60 -0.13 0.00 1.11 0.00 0.00 32.58 31.84 3gdi s HIS 316 CO 0.04 0.22 1.71 0.45 -0.85 0.00 0.00 174.74 176.31 3gdi n SER 317 N 2.10 3.23 0.00 1.40 2.88 -1.26 -4.77 113.62 117.19 3gdi n SER 317 Ca -0.17 1.03 0.05 0.00 -1.33 0.00 0.00 58.87 58.45 3gdi n SER 317 Cb 0.52 -1.39 0.30 0.00 -0.75 0.00 0.00 64.21 62.88 3gdi n SER 317 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3gdi n GLY 318 N 3.86 -0.35 1.29 0.46 0.00 -0.74 -2.19 105.19 107.52 3gdi n GLY 318 Ca 0.20 -0.06 0.09 0.00 0.00 0.00 0.00 46.02 46.24 3gdi n GLY 318 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3gdi n TYR 319 N -0.95 1.15 -3.82 1.61 4.02 -1.26 -1.31 117.16 116.61 3gdi n TYR 319 Ca 0.07 -0.61 -0.13 0.00 -0.01 0.00 0.00 57.90 57.23 3gdi n TYR 319 Cb 0.03 -0.18 -0.13 0.00 -0.02 0.00 0.00 39.34 39.04 3gdi n TYR 319 CO 0.00 0.00 0.00 -1.83 -1.01 0.00 0.00 176.86 174.02 3gdi s GLU 320 N -1.69 0.11 -0.26 -0.72 -1.05 -0.93 -4.77 118.70 109.38 3gdi s GLU 320 Ca 0.44 0.18 -0.25 0.00 -0.15 0.00 0.00 54.97 55.20 3gdi s GLU 320 Cb 0.28 0.01 -0.10 0.00 -0.44 0.00 0.00 34.13 33.88 3gdi s GLU 320 CO 0.22 -0.04 0.86 0.00 0.95 0.00 0.00 175.26 177.25 3gdi n ALA 321 N 3.24 -0.64 -2.51 -0.84 0.00 -1.26 -3.16 120.51 115.33 3gdi n ALA 321 Ca -0.15 0.25 -0.43 0.00 0.00 0.00 0.00 53.44 53.11 3gdi n ALA 321 Cb 0.58 -1.02 -0.02 0.00 0.00 0.00 0.00 19.45 18.99 3gdi n ALA 321 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 3gdi s PRO 322 N 1.71 3.75 0.07 0.00 0.02 -1.26 -5.06 135.00 134.23 3gdi s PRO 322 Ca 0.56 0.83 -0.31 0.00 0.02 0.00 0.00 61.00 62.10 3gdi s PRO 322 Cb -0.79 -3.91 -0.07 0.00 0.02 0.00 0.00 34.50 29.75 3gdi s PRO 322 CO 0.42 -1.34 1.36 1.03 -0.33 0.00 0.00 177.00 178.15 3gdi s ARG 323 N 4.45 4.33 0.08 5.54 0.52 -1.19 -4.85 118.95 127.83 3gdi s ARG 323 Ca 0.52 1.98 -0.31 0.00 -0.52 0.00 0.00 55.73 57.41 3gdi s ARG 323 Cb -0.11 -3.38 -0.09 0.00 0.52 0.00 0.00 34.95 31.89 3gdi s ARG 323 CO 0.29 -0.45 1.77 0.42 0.02 0.00 0.00 175.30 177.34 3gdi s ILE 324 N 1.53 2.83 0.16 1.52 1.01 -0.43 -4.90 121.20 122.94 3gdi s ILE 324 Ca 0.63 0.25 -0.34 0.00 0.00 0.00 0.00 60.65 61.19 3gdi s ILE 324 Cb -0.34 -3.16 -0.15 0.00 0.01 0.00 0.00 42.46 38.83 3gdi s ILE 324 CO 0.29 -0.00 1.40 -2.65 0.00 0.00 0.00 174.94 173.97 3gdi n PRO 325 N 5.93 1.67 -0.26 2.79 -0.02 -1.26 -4.80 135.00 139.05 3gdi n PRO 325 Ca 0.17 0.60 0.29 0.00 -2.02 0.00 0.00 63.50 62.54 3gdi n PRO 325 Cb 0.40 -2.26 0.67 0.00 -0.02 0.00 0.00 33.50 32.28 3gdi n PRO 325 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 3gdi h PRO 326 N 4.68 0.12 0.00 0.52 0.11 -1.94 0.23 132.00 135.72 3gdi h PRO 326 Ca -0.45 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.65 3gdi h PRO 326 Cb 1.30 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.38 3gdi h PRO 326 CO 0.79 0.08 0.00 0.39 -0.21 0.00 0.00 178.00 179.05 3gdi n GLU 327 N -4.34 0.29 -0.05 1.05 4.71 -1.26 -2.97 120.64 118.07 3gdi n GLU 327 Ca 0.22 0.07 0.03 0.00 -0.01 0.00 0.00 57.16 57.47 3gdi n GLU 327 Cb 1.01 -1.50 0.04 0.00 -1.01 0.00 0.00 31.44 29.98 3gdi n GLU 327 CO 0.00 0.00 0.00 1.63 0.09 0.00 0.00 177.13 178.85 3gdi n LYS 328 N -1.31 2.02 -2.31 3.49 5.02 0.79 -4.84 118.16 121.02 3gdi n LYS 328 Ca 0.10 -1.69 -0.43 0.00 -2.02 0.00 0.00 58.31 54.28 3gdi n LYS 328 Cb 0.19 -1.07 0.00 0.00 -0.02 0.00 0.00 35.03 34.14 3gdi n LYS 328 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 3gdi n ARG 329 N -0.70 3.44 -5.12 1.97 1.74 -1.11 -4.90 116.66 111.99 3gdi n ARG 329 Ca 0.05 -3.40 -0.31 0.00 -0.77 0.00 0.00 57.85 53.42 3gdi n ARG 329 Cb 0.42 -3.02 -0.17 0.00 -1.02 0.00 0.00 32.46 28.66 3gdi n ARG 329 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 3gdi s ILE 330 N 1.15 1.91 0.06 0.55 1.01 -1.26 -1.78 121.20 122.83 3gdi s ILE 330 Ca 0.42 -0.93 -0.03 0.00 0.00 0.00 0.00 60.65 60.11 3gdi s ILE 330 Cb 0.09 -1.65 -0.03 0.00 0.01 0.00 0.00 42.46 40.87 3gdi s ILE 330 CO -0.01 0.53 0.02 0.72 0.00 0.00 0.00 174.94 176.20 3gdi s PHE 331 N 0.37 0.41 0.21 3.97 -0.71 -0.54 -4.74 117.98 116.95 3gdi s PHE 331 Ca -0.18 -0.90 0.10 0.00 -1.04 0.00 0.00 56.93 54.92 3gdi s PHE 331 Cb -0.17 -0.29 -0.05 0.00 -1.21 0.00 0.00 43.02 41.30 3gdi s PHE 331 CO 0.08 -0.40 -0.20 0.95 -1.34 0.00 0.00 175.22 174.30 3gdi s THR 332 N -3.68 2.16 0.04 -4.49 -4.23 -1.26 0.25 115.64 104.43 3gdi s THR 332 Ca 0.04 -2.11 0.03 0.00 -1.18 0.00 0.00 61.69 58.47 3gdi s THR 332 Cb 0.06 -2.07 -0.02 0.00 1.34 0.00 0.00 72.50 71.80 3gdi s THR 332 CO -0.09 -0.30 -0.09 0.42 -0.54 0.00 0.00 174.62 174.02 3gdi s THR 333 N -2.13 0.64 -0.01 3.99 -4.23 -0.49 -2.08 115.64 111.32 3gdi s THR 333 Ca 0.22 -1.04 0.04 0.00 -1.18 0.00 0.00 61.69 59.72 3gdi s THR 333 Cb -0.06 -0.67 -0.01 0.00 1.34 0.00 0.00 72.50 73.10 3gdi s THR 333 CO 0.10 -0.30 -0.13 -0.89 -0.54 0.00 0.00 174.62 172.86 3gdi s THR 334 N -1.24 1.02 0.02 3.99 2.01 -0.67 -0.64 115.64 120.12 3gdi s THR 334 Ca -0.07 -0.54 -0.07 0.00 0.31 0.00 0.00 61.69 61.32 3gdi s THR 334 Cb -0.09 -0.86 -0.00 0.00 0.01 0.00 0.00 72.50 71.56 3gdi s THR 334 CO 0.01 0.29 0.13 -1.38 -0.69 0.00 0.00 174.62 172.98 3gdi s HIS 335 N -0.21 0.09 0.78 4.92 -3.43 -0.11 0.15 115.29 117.48 3gdi s HIS 335 Ca 0.03 -0.26 -0.11 0.00 -0.80 0.00 0.00 55.06 53.92 3gdi s HIS 335 Cb -0.06 -0.07 0.07 0.00 -1.43 0.00 0.00 32.58 31.09 3gdi s HIS 335 CO -0.00 -0.32 1.14 0.95 -2.00 0.00 0.00 174.74 174.51 3gdi s THR 336 N -1.84 2.20 0.46 -5.38 -4.23 -1.08 -0.28 115.64 105.48 3gdi s THR 336 Ca -0.11 -0.01 0.16 0.00 -1.18 0.00 0.00 61.69 60.55 3gdi s THR 336 Cb -0.05 -3.05 0.33 0.00 1.34 0.00 0.00 72.50 71.07 3gdi s THR 336 CO -0.01 -0.06 2.02 -0.65 -0.54 0.00 0.00 174.62 175.38 3gdi h PRO 337 N -0.93 0.28 0.00 3.99 0.11 -1.87 0.14 132.00 133.72 3gdi h PRO 337 Ca -0.46 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.64 3gdi h PRO 337 Cb 1.32 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.37 3gdi h PRO 337 CO 0.65 0.18 0.00 0.27 -0.21 0.00 0.00 178.00 178.89 3gdi n ASN 338 N -4.46 0.00 -1.65 -2.05 0.23 -1.26 -3.96 115.26 102.10 3gdi n ASN 338 Ca 0.07 -0.71 -0.15 0.00 -0.53 0.00 0.00 54.58 53.26 3gdi n ASN 338 Cb 0.34 0.00 -0.01 0.00 -2.08 0.00 0.00 39.78 38.03 3gdi n ASN 338 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 3gdi s LEU 340 N -4.21 3.65 0.54 0.00 1.02 -1.26 -1.05 118.68 117.37 3gdi s LEU 340 Ca 0.00 0.11 -0.20 0.00 0.02 0.00 0.00 54.13 54.06 3gdi s LEU 340 Cb 0.00 -1.87 -0.08 0.00 0.02 0.00 0.00 46.19 44.26 3gdi s LEU 340 CO 0.00 0.30 0.82 0.49 0.02 0.00 0.00 176.35 177.98 3gdi n PHE 341 N 2.70 0.39 -0.03 0.29 3.72 -0.76 -2.63 117.46 121.14 3gdi n PHE 341 Ca -0.18 0.47 -0.03 0.00 -0.05 0.00 0.00 57.45 57.66 3gdi n PHE 341 Cb 0.53 -2.10 -0.05 0.00 -0.94 0.00 0.00 39.48 36.92 3gdi n PHE 341 CO 0.00 0.00 0.00 0.94 -0.05 0.00 0.00 176.76 177.65 3gdi n GLN 342 N -0.38 2.81 -3.52 -1.08 0.00 0.12 -1.81 117.38 113.51 3gdi n GLN 342 Ca 0.12 -0.00 -0.09 0.00 -0.00 0.00 0.00 57.00 57.03 3gdi n GLN 342 Cb 0.45 -1.17 -0.03 0.00 0.00 0.00 0.00 30.24 29.50 3gdi n GLN 342 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 3gdi s ALA 343 N -2.16 -1.86 -0.03 1.69 0.00 -1.17 -4.89 121.76 113.35 3gdi s ALA 343 Ca -0.04 1.18 0.01 0.00 0.00 0.00 0.00 51.96 53.11 3gdi s ALA 343 Cb 0.02 0.14 0.02 0.00 0.00 0.00 0.00 23.12 23.30 3gdi s ALA 343 CO 0.26 -0.60 -0.03 0.08 0.00 0.00 0.00 175.76 175.47 3gdi s VAL 344 N -2.63 0.36 0.56 0.00 1.01 -1.26 -1.68 120.40 116.77 3gdi s VAL 344 Ca 0.04 -0.08 -0.14 0.00 0.00 0.00 0.00 61.98 61.80 3gdi s VAL 344 Cb -0.01 -0.39 -0.06 0.00 0.00 0.00 0.00 36.38 35.92 3gdi s VAL 344 CO -0.06 0.16 1.01 1.51 0.00 0.00 0.00 175.10 177.71 3gdi s ASP 345 N 0.62 6.44 0.51 3.32 -4.77 -0.88 -4.88 116.67 117.02 3gdi s ASP 345 Ca -0.07 1.50 0.29 0.00 -3.30 0.00 0.00 52.55 50.98 3gdi s ASP 345 Cb -0.10 -2.49 1.41 0.00 -1.09 0.00 0.00 42.92 40.65 3gdi s ASP 345 CO -0.01 -0.72 1.87 -0.33 0.70 0.00 0.00 175.17 176.69 3gdi h GLU 346 N 0.36 0.08 0.00 2.11 5.08 -1.98 0.01 114.58 120.23 3gdi h GLU 346 Ca -0.46 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.90 3gdi h GLU 346 Cb 1.19 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.42 3gdi h GLU 346 CO 0.62 0.05 0.00 0.00 -1.00 0.00 0.00 179.01 178.68 3gdi h ARG 347 N 0.08 0.00 -0.01 2.33 3.08 -1.92 -2.85 114.38 115.09 3gdi h ARG 347 Ca 0.45 0.00 -0.21 0.00 0.07 0.00 0.00 59.98 60.30 3gdi h ARG 347 Cb 1.67 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 31.71 3gdi h ARG 347 CO -0.05 0.00 -0.88 0.00 -1.07 0.00 0.00 179.97 177.97 3gdi h ALA 348 N 2.12 0.47 -0.23 0.04 0.00 -1.27 -3.30 119.26 117.08 3gdi h ALA 348 Ca 0.00 -0.70 0.06 0.00 0.00 0.00 0.00 54.91 54.27 3gdi h ALA 348 Cb 0.27 -0.05 -0.06 0.00 0.00 0.00 0.00 17.79 17.95 3gdi h ALA 348 CO 0.00 0.85 -0.20 0.28 0.00 0.00 0.00 179.25 180.18 3gdi h VAL 349 N 0.18 0.47 0.00 0.00 2.07 -1.65 0.22 116.25 117.54 3gdi h VAL 349 Ca -0.06 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.45 3gdi h VAL 349 Cb 1.50 0.47 -0.00 0.00 -1.52 0.00 0.00 31.29 31.74 3gdi h VAL 349 CO 0.14 0.00 -0.09 -0.65 0.02 0.00 0.00 177.57 177.00 3gdi h PRO 350 N -0.21 0.00 0.00 1.57 0.11 -1.75 -0.69 132.00 131.03 3gdi h PRO 350 Ca 0.13 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.24 3gdi h PRO 350 Cb 0.41 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.52 3gdi h PRO 350 CO -0.35 0.09 -0.94 1.28 -0.21 0.00 0.00 178.00 177.86 3gdi n LEU 351 N -3.37 0.72 -0.01 2.35 4.77 -0.39 -1.79 117.00 119.28 3gdi n LEU 351 Ca -0.01 -0.22 -0.01 0.00 -0.03 0.00 0.00 56.01 55.74 3gdi n LEU 351 Cb 0.26 -0.09 -0.01 0.00 -2.33 0.00 0.00 43.42 41.25 3gdi n LEU 351 CO 0.28 0.15 -0.55 0.18 -1.33 0.00 0.00 177.39 176.12 3gdi n LEU 352 N -1.67 0.24 0.00 2.23 4.77 0.64 -5.01 117.00 118.21 3gdi n LEU 352 Ca 0.03 -0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.01 3gdi n LEU 352 Cb 0.37 0.03 0.00 0.00 -2.33 0.00 0.00 43.42 41.49 3gdi n LEU 352 CO 0.40 0.08 0.00 0.61 -1.33 0.00 0.00 177.39 177.15 3gdi n GLY 353 N 2.94 2.91 3.89 -0.72 0.00 -0.28 -0.70 105.19 113.23 3gdi n GLY 353 Ca -0.03 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.70 3gdi n GLY 353 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3gdi s TYR 354 N -2.67 3.47 0.12 1.61 1.51 -1.26 -4.67 117.35 115.45 3gdi s TYR 354 Ca 0.00 0.75 -0.05 0.00 -1.01 0.00 0.00 57.07 56.76 3gdi s TYR 354 Cb 0.00 -2.18 -0.05 0.00 -0.11 0.00 0.00 41.96 39.61 3gdi s TYR 354 CO 0.00 0.15 0.35 -0.51 -1.11 0.00 0.00 175.55 174.43 3gdi s LEU 355 N -3.44 4.29 0.31 -1.29 1.43 -1.26 -4.31 118.68 114.40 3gdi s LEU 355 Ca 0.46 0.58 0.08 0.00 -1.03 0.00 0.00 54.13 54.22 3gdi s LEU 355 Cb -0.11 -3.19 0.90 0.00 0.03 0.00 0.00 46.19 43.82 3gdi s LEU 355 CO 0.28 0.09 1.45 -2.65 0.23 0.00 0.00 176.35 175.76 3gdi n PRO 356 N 0.27 -0.07 0.17 1.29 -0.02 -1.26 -0.09 135.00 135.30 3gdi n PRO 356 Ca -0.04 1.34 0.13 0.00 -2.02 0.00 0.00 63.50 62.91 3gdi n PRO 356 Cb 0.52 -2.23 0.59 0.00 -0.02 0.00 0.00 33.50 32.35 3gdi n PRO 356 CO 0.00 0.00 0.00 -0.56 1.98 0.00 0.00 175.50 176.92 3gdi h GLN 357 N 0.00 0.00 0.00 -0.52 -0.00 -1.94 -2.17 115.11 110.48 3gdi h GLN 357 Ca 0.64 0.00 -0.14 0.00 -0.00 0.00 0.00 58.65 59.15 3gdi h GLN 357 Cb 1.49 0.00 -0.02 0.00 -0.00 0.00 0.00 27.48 28.95 3gdi h GLN 357 CO -0.81 0.00 -0.69 -0.44 -0.00 0.00 0.00 178.83 176.89 3gdi h ASP 358 N 0.00 0.00 0.00 0.06 3.32 -0.88 -3.35 116.42 115.57 3gdi h ASP 358 Ca 0.00 0.00 -0.13 0.00 0.02 0.00 0.00 57.03 56.92 3gdi h ASP 358 Cb 0.27 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.79 3gdi h ASP 358 CO 0.00 0.69 -2.03 0.18 -1.72 0.00 0.00 179.24 176.36 3gdi n LEU 359 N -3.40 0.00 -4.71 1.55 4.77 -1.00 -4.87 117.00 109.34 3gdi n LEU 359 Ca 0.00 0.00 -0.42 0.00 -0.03 0.00 0.00 56.01 55.56 3gdi n LEU 359 Cb 0.76 0.17 -0.03 0.00 -2.33 0.00 0.00 43.42 41.99 3gdi n LEU 359 CO 0.43 0.17 1.34 -0.63 -1.33 0.00 0.00 177.39 177.36 3gdi s ILE 360 N -3.01 2.50 -0.10 -0.08 1.01 -0.85 -2.22 121.20 118.46 3gdi s ILE 360 Ca -0.08 0.25 0.00 0.00 0.00 0.00 0.00 60.65 60.82 3gdi s ILE 360 Cb 0.10 -3.16 0.00 0.00 0.01 0.00 0.00 42.46 39.41 3gdi s ILE 360 CO 0.79 0.01 0.00 -0.62 0.00 0.00 0.00 174.94 175.12 3gdi n GLU 361 N 4.59 -0.16 -4.25 2.79 -0.58 -0.75 -4.94 120.64 117.34 3gdi n GLU 361 Ca 0.16 0.29 -0.25 0.00 -0.42 0.00 0.00 57.16 56.94 3gdi n GLU 361 Cb 0.38 -3.63 -0.08 0.00 -0.57 0.00 0.00 31.44 27.54 3gdi n GLU 361 CO 0.00 0.00 0.00 0.95 -0.48 0.00 0.00 177.13 177.60 3gdi s THR 362 N -1.98 3.56 0.19 2.62 -4.23 -0.94 -4.81 115.64 110.04 3gdi s THR 362 Ca 0.00 -1.67 -0.32 0.00 -1.18 0.00 0.00 61.69 58.52 3gdi s THR 362 Cb 0.00 -2.84 -0.12 0.00 1.34 0.00 0.00 72.50 70.88 3gdi s THR 362 CO 0.00 -0.24 1.74 -2.65 -0.54 0.00 0.00 174.62 172.93 3gdi n PRO 363 N -0.49 2.74 -0.09 3.99 -0.02 -1.26 -1.82 135.00 138.05 3gdi n PRO 363 Ca -0.08 0.99 -0.09 0.00 -2.02 0.00 0.00 63.50 62.29 3gdi n PRO 363 Cb 0.57 -2.84 -0.02 0.00 -0.02 0.00 0.00 33.50 31.19 3gdi n PRO 363 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 3gdi h VAL 364 N 3.98 1.12 -0.12 -1.45 2.07 -1.45 -2.91 116.25 117.50 3gdi h VAL 364 Ca -0.44 -0.32 0.04 0.00 0.82 0.00 0.00 66.70 66.80 3gdi h VAL 364 Cb 1.21 0.78 -0.00 0.00 -1.52 0.00 0.00 31.29 31.76 3gdi h VAL 364 CO 0.95 0.13 0.12 -0.07 0.02 0.00 0.00 177.57 178.72 3gdi h LEU 365 N 0.38 0.00 -0.86 2.57 4.07 -1.90 -2.36 115.31 117.20 3gdi h LEU 365 Ca 0.11 0.00 -0.05 0.00 0.08 0.00 0.00 57.88 58.02 3gdi h LEU 365 Cb 0.05 0.00 -0.03 0.00 1.08 0.00 0.00 40.66 41.76 3gdi h LEU 365 CO -0.02 0.00 0.26 0.58 -1.08 0.00 0.00 178.44 178.18 3gdi h VAL 366 N 0.00 1.25 0.00 1.22 2.07 -1.90 -2.49 116.25 116.40 3gdi h VAL 366 Ca 0.06 -0.83 0.00 0.00 0.82 0.00 0.00 66.70 66.75 3gdi h VAL 366 Cb 0.30 0.42 0.00 0.00 -1.52 0.00 0.00 31.29 30.49 3gdi h VAL 366 CO -0.00 0.33 0.00 0.00 0.02 0.00 0.00 177.57 177.92 3gdi n GLN 367 N -4.27 0.23 -2.96 1.57 1.13 -0.89 -4.80 117.38 107.39 3gdi n GLN 367 Ca 0.06 0.37 -0.32 0.00 -1.94 0.00 0.00 57.00 55.17 3gdi n GLN 367 Cb 0.20 -1.87 -0.05 0.00 0.11 0.00 0.00 30.24 28.63 3gdi n GLN 367 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 3gdi s LEU 368 N -4.57 3.95 0.38 1.08 1.02 -0.94 0.22 118.68 119.82 3gdi s LEU 368 Ca 0.06 1.33 -0.28 0.00 0.02 0.00 0.00 54.13 55.26 3gdi s LEU 368 Cb 0.10 -4.17 -0.10 0.00 0.02 0.00 0.00 46.19 42.04 3gdi s LEU 368 CO 0.46 -0.31 1.44 -2.28 0.02 0.00 0.00 176.35 175.68 3gdi s HIS 369 N -2.16 2.66 0.63 0.29 5.65 -0.82 -4.85 115.29 116.69 3gdi s HIS 369 Ca 0.55 1.24 0.28 0.00 0.25 0.00 0.00 55.06 57.38 3gdi s HIS 369 Cb -0.10 -3.93 1.51 0.00 -1.18 0.00 0.00 32.58 28.87 3gdi s HIS 369 CO 0.21 -2.75 1.88 -1.00 -0.65 0.00 0.00 174.74 172.44 3gdi h PRO 370 N 2.95 0.00 -0.01 2.88 0.13 -1.93 0.72 132.00 136.74 3gdi h PRO 370 Ca -0.50 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.63 3gdi h PRO 370 Cb 1.24 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.37 3gdi h PRO 370 CO 0.64 0.00 -0.30 0.43 -0.23 0.00 0.00 178.00 178.54 3gdi n SER 371 N -3.27 1.05 -0.48 1.44 7.64 -1.26 -3.81 113.62 114.93 3gdi n SER 371 Ca 0.03 -0.88 0.04 0.00 1.01 0.00 0.00 58.87 59.07 3gdi n SER 371 Cb 0.53 0.18 0.11 0.00 -1.01 0.00 0.00 64.21 64.02 3gdi n SER 371 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 3gdi n ASP 372 N -0.68 2.61 -0.04 6.43 10.43 0.23 -4.64 116.55 130.88 3gdi n ASP 372 Ca 0.11 -1.93 -0.14 0.00 2.57 0.00 0.00 54.79 55.40 3gdi n ASP 372 Cb 0.35 -0.16 -0.12 0.00 1.84 0.00 0.00 41.12 43.04 3gdi n ASP 372 CO 0.00 0.00 0.00 0.03 -1.07 0.00 0.00 177.20 176.16 3gdi h ARG 373 N 1.57 0.05 -0.19 -1.24 3.08 -1.62 -3.23 114.38 112.81 3gdi h ARG 373 Ca 0.00 -0.05 0.05 0.00 0.07 0.00 0.00 59.98 60.05 3gdi h ARG 373 Cb 0.64 0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.70 3gdi h ARG 373 CO 0.00 0.87 0.17 -1.35 -1.07 0.00 0.00 179.97 178.59 3gdi h PRO 374 N -0.76 0.00 -0.32 0.04 0.11 -1.82 0.12 132.00 129.36 3gdi h PRO 374 Ca -0.01 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 66.10 3gdi h PRO 374 Cb 0.90 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.00 3gdi h PRO 374 CO 0.01 0.00 0.18 -0.07 -0.21 0.00 0.00 178.00 177.92 3gdi h LEU 375 N 0.00 0.38 -1.84 2.35 4.07 -1.84 -1.91 115.31 116.52 3gdi h LEU 375 Ca 0.09 -0.02 0.09 0.00 0.08 0.00 0.00 57.88 58.12 3gdi h LEU 375 Cb 0.42 -0.10 -0.02 0.00 1.08 0.00 0.00 40.66 42.05 3gdi h LEU 375 CO -0.00 0.30 0.30 0.24 -1.08 0.00 0.00 178.44 178.20 3gdi h MET 376 N 0.44 0.18 -0.54 1.13 2.86 -0.83 -1.07 114.93 117.11 3gdi h MET 376 Ca 0.12 -0.01 -0.03 0.00 -2.06 0.00 0.00 59.70 57.72 3gdi h MET 376 Cb 0.00 -0.04 -0.02 0.00 0.06 0.00 0.00 31.60 31.60 3gdi h MET 376 CO -0.02 0.12 0.22 1.25 1.06 0.00 0.00 176.91 179.54 3gdi h LEU 377 N 0.19 0.73 -0.58 1.22 5.85 -1.45 -1.34 115.31 119.93 3gdi h LEU 377 Ca 0.20 -0.16 -0.16 0.00 0.84 0.00 0.00 57.88 58.61 3gdi h LEU 377 Cb 0.56 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 41.38 3gdi h LEU 377 CO -0.03 0.69 -0.67 0.00 -0.34 0.00 0.00 178.44 178.08 3gdi h ALA 378 N 1.07 0.79 -0.42 1.25 0.00 -1.40 -2.76 119.26 117.79 3gdi h ALA 378 Ca 0.18 -0.59 -0.06 0.00 0.00 0.00 0.00 54.91 54.44 3gdi h ALA 378 Cb 0.18 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 3gdi h ALA 378 CO -0.02 0.79 0.04 0.82 0.00 0.00 0.00 179.25 180.88 3gdi h ILE 379 N 0.12 1.25 -0.26 0.00 2.04 -0.89 -2.15 117.51 117.62 3gdi h ILE 379 Ca -0.01 -0.95 -0.11 0.00 1.00 0.00 0.00 64.86 64.79 3gdi h ILE 379 Cb 1.21 1.04 -0.01 0.00 -0.74 0.00 0.00 36.82 38.31 3gdi h ILE 379 CO 0.10 0.33 -0.29 0.45 0.00 0.00 0.00 178.15 178.74 3gdi h HIS 380 N 0.57 0.59 -0.78 1.37 3.86 -1.21 -0.81 115.15 118.75 3gdi h HIS 380 Ca 0.12 -0.14 0.02 0.00 -1.16 0.00 0.00 60.37 59.22 3gdi h HIS 380 Cb 0.43 -0.14 -0.04 0.00 1.06 0.00 0.00 27.41 28.72 3gdi h HIS 380 CO 0.03 0.76 0.50 0.87 0.86 0.00 0.00 177.93 180.95 3gdi h LYS 381 N 0.45 0.98 -0.13 2.45 1.57 -1.28 -1.37 116.57 119.23 3gdi h LYS 381 Ca 0.06 -0.06 -0.14 0.00 -1.87 0.00 0.00 60.65 58.64 3gdi h LYS 381 Cb 0.73 -0.22 -0.01 0.00 0.08 0.00 0.00 32.23 32.81 3gdi h LYS 381 CO 0.06 0.65 -0.53 0.87 -0.57 0.00 0.00 179.45 179.93 3gdi h LYS 382 N 1.01 0.38 -0.07 3.15 1.57 -1.07 -2.38 116.57 119.16 3gdi h LYS 382 Ca 0.30 -0.23 -0.00 0.00 -1.87 0.00 0.00 60.65 58.84 3gdi h LYS 382 Cb -0.06 0.02 -0.00 0.00 0.08 0.00 0.00 32.23 32.27 3gdi h LYS 382 CO -0.09 0.82 0.04 0.82 -0.57 0.00 0.00 179.45 180.47 3gdi h ILE 383 N 0.30 1.04 0.00 1.86 2.04 -0.09 0.73 117.51 123.39 3gdi h ILE 383 Ca 0.01 -0.11 -0.06 0.00 1.00 0.00 0.00 64.86 65.70 3gdi h ILE 383 Cb 1.03 1.00 -0.01 0.00 -0.74 0.00 0.00 36.82 38.10 3gdi h ILE 383 CO 0.09 0.04 -0.28 0.17 0.00 0.00 0.00 178.15 178.17 3gdi h LEU 384 N 0.06 0.00 -0.42 1.44 -0.00 -1.41 -2.78 115.31 112.19 3gdi h LEU 384 Ca 0.02 0.00 -0.17 0.00 -0.00 0.00 0.00 57.88 57.74 3gdi h LEU 384 Cb 0.03 0.00 -0.00 0.00 -0.00 0.00 0.00 40.66 40.68 3gdi h LEU 384 CO -0.00 0.28 -0.50 -0.61 -0.00 0.00 0.00 178.44 177.60 3gdi h GLN 385 N 0.00 0.76 0.00 0.17 4.15 -0.91 -2.55 115.11 116.73 3gdi h GLN 385 Ca -0.00 -0.45 0.00 0.00 0.77 0.00 0.00 58.65 58.96 3gdi h GLN 385 Cb 1.02 0.04 0.00 0.00 0.21 0.00 0.00 27.48 28.75 3gdi h GLN 385 CO 0.04 1.08 0.00 0.00 -1.93 0.00 0.00 178.83 178.02 3gdi n ALA 386 N -2.54 1.84 -2.33 3.38 0.00 0.25 -4.89 120.51 116.23 3gdi n ALA 386 Ca -0.03 -0.07 -0.07 0.00 0.00 0.00 0.00 53.44 53.27 3gdi n ALA 386 Cb 0.60 -1.28 -0.01 0.00 0.00 0.00 0.00 19.45 18.76 3gdi n ALA 386 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3gdi n GLY 387 N 0.23 -0.37 0.00 0.00 0.00 -0.96 -1.61 105.19 102.48 3gdi n GLY 387 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.08 3gdi n GLY 387 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3gdi n GLY 388 N -0.62 2.04 3.65 -0.02 0.00 -1.26 -5.01 105.19 103.98 3gdi n GLY 388 Ca -0.09 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.51 3gdi n GLY 388 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3gdi s GLN 389 N -0.15 4.09 0.65 1.61 2.00 -0.63 -4.50 119.66 122.73 3gdi s GLN 389 Ca 0.00 1.64 -0.17 0.00 -2.00 0.00 0.00 55.36 54.83 3gdi s GLN 389 Cb 0.00 -3.86 -0.02 0.00 0.80 0.00 0.00 33.01 29.93 3gdi s GLN 389 CO 0.00 -0.90 1.03 -2.30 -0.50 0.00 0.00 175.29 172.62 3gdi n PRO 390 N 6.99 0.82 -3.73 1.67 -0.02 -1.26 -4.86 135.00 134.61 3gdi n PRO 390 Ca 0.15 0.33 -0.14 0.00 -2.02 0.00 0.00 63.50 61.83 3gdi n PRO 390 Cb 0.45 -2.26 -0.08 0.00 -0.02 0.00 0.00 33.50 31.58 3gdi n PRO 390 CO 0.00 0.00 0.00 -0.59 1.98 0.00 0.00 175.50 176.89 3gdi s PHE 391 N -1.57 -0.25 0.23 6.00 -0.12 -0.88 -4.94 117.98 116.46 3gdi s PHE 391 Ca 0.77 0.41 -0.11 0.00 -0.05 0.00 0.00 56.93 57.95 3gdi s PHE 391 Cb -0.39 0.13 -0.07 0.00 -0.63 0.00 0.00 43.02 42.06 3gdi s PHE 391 CO 0.46 -0.40 0.58 -0.51 -0.05 0.00 0.00 175.22 175.30 3gdi s ASP 392 N -1.20 6.68 -0.21 1.98 -0.00 -1.26 -0.64 116.67 122.02 3gdi s ASP 392 Ca -0.12 1.01 -0.14 0.00 -0.00 0.00 0.00 52.55 53.30 3gdi s ASP 392 Cb -0.04 -2.26 0.06 0.00 -0.00 0.00 0.00 42.92 40.68 3gdi s ASP 392 CO 0.05 -0.07 0.53 -0.47 -0.00 0.00 0.00 175.17 175.21 3gdi s TYR 393 N -1.79 -0.75 -0.04 4.23 5.04 0.55 -4.97 117.35 119.62 3gdi s TYR 393 Ca 0.47 1.60 -0.29 0.00 -2.44 0.00 0.00 57.07 56.41 3gdi s TYR 393 Cb -0.12 0.37 0.10 0.00 0.35 0.00 0.00 41.96 42.66 3gdi s TYR 393 CO 0.20 -0.39 0.83 -1.54 -1.34 0.00 0.00 175.55 173.32 3gdi s SER 394 N 1.19 -0.46 0.25 4.32 1.04 -1.26 -1.14 113.70 117.63 3gdi s SER 394 Ca -0.07 0.28 0.03 0.00 0.48 0.00 0.00 55.95 56.67 3gdi s SER 394 Cb -0.06 0.42 -0.03 0.00 0.10 0.00 0.00 66.02 66.45 3gdi s SER 394 CO -0.12 -0.58 0.39 -2.16 0.98 0.00 0.00 173.24 171.75 3gdi s PRO 395 N -2.16 3.46 -0.01 4.02 0.04 -1.26 -5.06 135.00 134.03 3gdi s PRO 395 Ca -0.01 -0.60 0.03 0.00 0.04 0.00 0.00 61.00 60.46 3gdi s PRO 395 Cb -0.01 -2.85 -0.01 0.00 0.04 0.00 0.00 34.50 31.68 3gdi s PRO 395 CO -0.02 0.38 -0.11 0.42 0.04 0.00 0.00 177.00 177.71 3gdi s ILE 396 N -2.01 0.90 -0.18 0.56 -1.09 -0.90 -4.96 121.20 113.52 3gdi s ILE 396 Ca 0.36 -0.48 -0.08 0.00 -2.23 0.00 0.00 60.65 58.22 3gdi s ILE 396 Cb -0.10 -0.76 -0.04 0.00 -1.58 0.00 0.00 42.46 39.98 3gdi s ILE 396 CO 0.30 0.26 0.07 -0.13 -1.23 0.00 0.00 174.94 174.21 3gdi s ARG 397 N -0.20 4.01 -0.10 2.79 0.52 -1.26 -0.14 118.95 124.57 3gdi s ARG 397 Ca 0.03 -0.32 0.03 0.00 -0.52 0.00 0.00 55.73 54.95 3gdi s ARG 397 Cb -0.05 -3.24 -0.00 0.00 0.52 0.00 0.00 34.95 32.17 3gdi s ARG 397 CO -0.00 0.28 -0.22 0.12 0.02 0.00 0.00 175.30 175.50 3gdi s PHE 398 N 0.35 2.60 0.18 -0.53 5.36 -0.67 -1.94 117.98 123.34 3gdi s PHE 398 Ca 0.04 -0.91 -0.30 0.00 -0.96 0.00 0.00 56.93 54.80 3gdi s PHE 398 Cb -0.12 -1.72 -0.07 0.00 -0.34 0.00 0.00 43.02 40.76 3gdi s PHE 398 CO -0.00 -0.34 1.03 0.50 -1.46 0.00 0.00 175.22 174.95 3gdi s ARG 399 N 0.27 4.67 0.60 10.12 3.52 0.13 -1.45 118.95 136.81 3gdi s ARG 399 Ca -0.15 1.61 0.09 0.00 -0.13 0.00 0.00 55.73 57.15 3gdi s ARG 399 Cb -0.17 -3.30 0.10 0.00 -1.56 0.00 0.00 34.95 30.02 3gdi s ARG 399 CO 0.08 0.20 0.83 0.95 -0.81 0.00 0.00 175.30 176.54 3gdi s THR 400 N -0.39 2.08 0.39 4.11 -4.23 0.79 -4.97 115.64 113.41 3gdi s THR 400 Ca 0.47 -0.97 0.07 0.00 -1.18 0.00 0.00 61.69 60.08 3gdi s THR 400 Cb -0.27 -2.11 0.29 0.00 1.34 0.00 0.00 72.50 71.75 3gdi s THR 400 CO 0.33 0.00 2.00 -0.09 -0.54 0.00 0.00 174.62 176.32 3gdi h ARG 401 N 0.09 0.63 -0.53 3.99 9.65 -1.05 -1.87 114.38 125.29 3gdi h ARG 401 Ca -0.29 -0.04 0.00 0.00 -1.10 0.00 0.00 59.98 58.55 3gdi h ARG 401 Cb 1.29 -0.14 0.00 0.00 -1.39 0.00 0.00 29.97 29.73 3gdi h ARG 401 CO 0.40 0.42 0.00 0.27 2.80 0.00 0.00 179.97 183.86 3gdi n ASN 402 N -4.47 1.89 0.00 -3.80 2.04 -1.23 -3.85 115.26 105.85 3gdi n ASN 402 Ca 0.08 -2.14 0.00 0.00 -0.44 0.00 0.00 54.58 52.07 3gdi n ASN 402 Cb 0.18 -0.35 0.00 0.00 -2.53 0.00 0.00 39.78 37.08 3gdi n ASN 402 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 3gdi n GLY 403 N 0.57 1.81 3.87 4.83 0.00 -0.70 -4.30 105.19 111.27 3gdi n GLY 403 Ca 0.09 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.78 3gdi n GLY 403 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3gdi s GLU 404 N -0.01 3.79 -0.00 1.61 2.12 -1.26 -4.76 118.70 120.18 3gdi s GLU 404 Ca 0.00 0.22 -0.07 0.00 0.36 0.00 0.00 54.97 55.48 3gdi s GLU 404 Cb 0.00 -2.82 -0.05 0.00 0.26 0.00 0.00 34.13 31.52 3gdi s GLU 404 CO 0.00 0.43 0.28 0.71 -0.54 0.00 0.00 175.26 176.14 3gdi s TYR 405 N -1.62 3.59 0.09 5.30 2.02 -1.26 -0.15 117.35 125.31 3gdi s TYR 405 Ca 0.41 0.62 0.08 0.00 -0.37 0.00 0.00 57.07 57.81 3gdi s TYR 405 Cb -0.13 -2.02 -0.04 0.00 -0.40 0.00 0.00 41.96 39.38 3gdi s TYR 405 CO 0.21 0.62 -0.19 0.96 -1.57 0.00 0.00 175.55 175.58 3gdi s ILE 406 N -1.26 2.76 -0.22 2.71 -4.36 -0.53 -4.34 121.20 115.96 3gdi s ILE 406 Ca 0.26 -1.39 -0.16 0.00 -0.26 0.00 0.00 60.65 59.10 3gdi s ILE 406 Cb -0.13 -2.22 -0.04 0.00 1.25 0.00 0.00 42.46 41.32 3gdi s ILE 406 CO 0.15 0.20 0.40 -0.89 0.24 0.00 0.00 174.94 175.04 3gdi s THR 407 N -1.04 5.19 0.09 8.37 2.01 -0.21 -1.67 115.64 128.38 3gdi s THR 407 Ca 0.16 0.69 0.04 0.00 0.31 0.00 0.00 61.69 62.89 3gdi s THR 407 Cb -0.10 -3.73 -0.04 0.00 0.01 0.00 0.00 72.50 68.64 3gdi s THR 407 CO 0.08 0.23 0.06 -0.76 -0.69 0.00 0.00 174.62 173.53 3gdi s LEU 408 N 1.50 3.67 -0.25 4.42 1.02 0.81 -0.72 118.68 129.14 3gdi s LEU 408 Ca 0.18 -0.09 -0.02 0.00 0.02 0.00 0.00 54.13 54.23 3gdi s LEU 408 Cb -0.15 -2.37 0.02 0.00 0.02 0.00 0.00 46.19 43.72 3gdi s LEU 408 CO 0.08 0.16 -0.06 -1.81 0.02 0.00 0.00 176.35 174.75 3gdi s ASP 409 N -2.45 4.32 0.11 2.29 -0.00 0.13 -2.11 116.67 118.95 3gdi s ASP 409 Ca 0.28 -0.82 0.10 0.00 -0.00 0.00 0.00 52.55 52.11 3gdi s ASP 409 Cb -0.12 -1.67 -0.04 0.00 -0.00 0.00 0.00 42.92 41.09 3gdi s ASP 409 CO 0.21 -0.12 -0.22 -0.89 -0.00 0.00 0.00 175.17 174.15 3gdi s THR 410 N 1.34 2.55 -0.15 -1.27 2.01 -0.29 -1.34 115.64 118.49 3gdi s THR 410 Ca 0.01 -1.58 0.01 0.00 0.31 0.00 0.00 61.69 60.45 3gdi s THR 410 Cb -0.16 -2.13 0.01 0.00 0.01 0.00 0.00 72.50 70.22 3gdi s THR 410 CO -0.04 0.13 -0.19 -0.55 -0.69 0.00 0.00 174.62 173.28 3gdi s SER 411 N -1.99 3.31 -0.01 3.53 0.15 -0.96 -0.33 113.70 117.41 3gdi s SER 411 Ca 0.16 -0.56 0.02 0.00 0.70 0.00 0.00 55.95 56.26 3gdi s SER 411 Cb -0.10 -1.49 -0.03 0.00 -1.71 0.00 0.00 66.02 62.68 3gdi s SER 411 CO 0.07 0.07 -0.03 0.26 1.20 0.00 0.00 173.24 174.81 3gdi s TRP 412 N 0.90 2.99 0.31 3.44 0.52 0.19 -1.66 118.94 125.64 3gdi s TRP 412 Ca -0.04 0.03 -0.10 0.00 0.02 0.00 0.00 56.10 56.01 3gdi s TRP 412 Cb -0.15 -1.65 0.01 0.00 -1.15 0.00 0.00 33.47 30.53 3gdi s TRP 412 CO -0.03 0.42 0.54 0.45 0.02 0.00 0.00 176.95 178.35 3gdi s SER 413 N -1.41 0.30 0.05 2.95 0.15 -0.28 -2.08 113.70 113.38 3gdi s SER 413 Ca 0.18 -1.17 -0.07 0.00 0.70 0.00 0.00 55.95 55.58 3gdi s SER 413 Cb -0.11 0.67 -0.01 0.00 -1.71 0.00 0.00 66.02 64.86 3gdi s SER 413 CO 0.08 -1.31 0.13 -0.94 1.20 0.00 0.00 173.24 172.40 3gdi s SER 414 N -3.11 0.15 -0.25 5.45 1.04 -1.26 -0.71 113.70 115.01 3gdi s SER 414 Ca 0.24 -0.54 -0.08 0.00 0.48 0.00 0.00 55.95 56.05 3gdi s SER 414 Cb -0.02 0.27 -0.03 0.00 0.10 0.00 0.00 66.02 66.34 3gdi s SER 414 CO 0.14 -0.57 0.08 -0.36 0.98 0.00 0.00 173.24 173.50 3gdi s PHE 415 N -2.94 3.11 -0.23 5.02 0.08 -0.45 -4.68 117.98 117.89 3gdi s PHE 415 Ca -0.02 -0.34 -0.07 0.00 0.12 0.00 0.00 56.93 56.62 3gdi s PHE 415 Cb 0.01 -2.24 -0.03 0.00 -0.57 0.00 0.00 43.02 40.18 3gdi s PHE 415 CO -0.06 -0.31 0.06 0.42 -0.10 0.00 0.00 175.22 175.23 3gdi s ILE 416 N 1.56 4.36 -0.09 0.64 1.01 -1.26 -1.03 121.20 126.38 3gdi s ILE 416 Ca 0.06 -0.16 -0.31 0.00 0.00 0.00 0.00 60.65 60.24 3gdi s ILE 416 Cb -0.15 -3.02 -0.09 0.00 0.01 0.00 0.00 42.46 39.21 3gdi s ILE 416 CO 0.04 0.37 2.03 -3.20 0.00 0.00 0.00 174.94 174.19 3gdi n ASN 417 N 4.54 3.59 0.07 3.58 2.85 -0.27 -4.85 115.26 124.78 3gdi n ASN 417 Ca -0.16 0.71 0.03 0.00 -0.11 0.00 0.00 54.58 55.05 3gdi n ASN 417 Cb 0.52 -1.47 0.43 0.00 1.24 0.00 0.00 39.78 40.49 3gdi n ASN 417 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 3gdi h PRO 418 N 11.51 0.37 0.19 1.20 0.13 -1.95 0.42 132.00 143.88 3gdi h PRO 418 Ca -0.46 -0.05 -0.31 0.00 -0.87 0.00 0.00 66.00 64.32 3gdi h PRO 418 Cb 1.26 -0.07 0.02 0.00 0.13 0.00 0.00 31.00 32.34 3gdi h PRO 418 CO 0.95 0.34 -1.36 -1.49 -0.23 0.00 0.00 178.00 176.21 3gdi h TRP 419 N 0.37 0.74 0.00 1.56 6.55 -1.97 -3.35 115.95 119.85 3gdi h TRP 419 Ca 0.09 -0.54 0.00 0.00 0.95 0.00 0.00 58.89 59.39 3gdi h TRP 419 Cb 0.13 -0.03 0.00 0.00 -0.86 0.00 0.00 29.16 28.40 3gdi h TRP 419 CO 0.00 1.42 -1.85 -1.13 -1.05 0.00 0.00 178.44 175.84 3gdi n SER 420 N -3.62 0.13 0.00 -3.49 3.41 -1.21 -4.97 113.62 103.88 3gdi n SER 420 Ca -0.13 -0.02 0.00 0.00 -0.26 0.00 0.00 58.87 58.47 3gdi n SER 420 Cb 1.07 1.80 0.00 0.00 -0.26 0.00 0.00 64.21 66.81 3gdi n SER 420 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 3gdi n ARG 421 N -2.26 -0.49 -3.62 4.33 5.12 0.15 -4.82 116.66 115.08 3gdi n ARG 421 Ca -0.03 0.12 -0.35 0.00 -1.93 0.00 0.00 57.85 55.66 3gdi n ARG 421 Cb 0.56 -3.55 -0.05 0.00 -1.16 0.00 0.00 32.46 28.25 3gdi n ARG 421 CO 0.00 0.00 0.00 0.15 -1.93 0.00 0.00 177.63 175.85 3gdi s LYS 422 N -0.59 3.73 0.13 5.56 1.02 -1.25 0.03 119.74 128.36 3gdi s LYS 422 Ca 0.00 0.13 -0.31 0.00 0.02 0.00 0.00 55.97 55.81 3gdi s LYS 422 Cb 0.00 -3.04 -0.09 0.00 -0.52 0.00 0.00 37.83 34.18 3gdi s LYS 422 CO 0.00 0.60 1.47 0.42 -0.92 0.00 0.00 175.35 176.91 3gdi s ILE 423 N -1.34 3.06 -0.23 2.17 1.01 -1.26 -1.11 121.20 123.50 3gdi s ILE 423 Ca 0.31 0.74 0.10 0.00 0.00 0.00 0.00 60.65 61.80 3gdi s ILE 423 Cb -0.14 -3.48 -0.21 0.00 0.01 0.00 0.00 42.46 38.65 3gdi s ILE 423 CO 0.17 0.05 -0.07 -1.20 0.00 0.00 0.00 174.94 173.89 3gdi n SER 424 N 4.09 0.99 -3.90 3.58 7.64 -0.20 -4.78 113.62 121.04 3gdi n SER 424 Ca 0.13 -0.07 -0.10 0.00 1.01 0.00 0.00 58.87 59.85 3gdi n SER 424 Cb 0.41 0.33 -0.09 0.00 -1.01 0.00 0.00 64.21 63.85 3gdi n SER 424 CO 0.00 0.00 0.00 -0.36 -3.01 0.00 0.00 175.04 171.67 3gdi s PHE 425 N -2.50 0.16 -0.14 1.43 0.40 -1.20 -4.27 117.98 111.87 3gdi s PHE 425 Ca -0.22 -0.47 0.02 0.00 -0.60 0.00 0.00 56.93 55.66 3gdi s PHE 425 Cb 0.07 -0.11 0.00 0.00 0.51 0.00 0.00 43.02 43.50 3gdi s PHE 425 CO 0.71 -0.41 -0.19 0.42 0.70 0.00 0.00 175.22 176.45 3gdi s ILE 426 N -2.79 2.32 -0.06 0.64 -1.09 0.61 -1.34 121.20 119.48 3gdi s ILE 426 Ca -0.03 -0.89 0.04 0.00 -2.23 0.00 0.00 60.65 57.54 3gdi s ILE 426 Cb -0.00 -1.95 -0.02 0.00 -1.58 0.00 0.00 42.46 38.92 3gdi s ILE 426 CO -0.05 0.54 -0.19 0.27 -1.23 0.00 0.00 174.94 174.27 3gdi s ILE 427 N 0.79 2.58 0.00 2.92 -4.36 0.11 -0.93 121.20 122.30 3gdi s ILE 427 Ca -0.07 -0.88 0.06 0.00 -0.26 0.00 0.00 60.65 59.50 3gdi s ILE 427 Cb -0.16 -1.99 -0.02 0.00 1.25 0.00 0.00 42.46 41.55 3gdi s ILE 427 CO -0.01 0.57 -0.19 -0.83 0.24 0.00 0.00 174.94 174.73 3gdi s GLY 428 N -0.32 0.95 -0.28 6.27 0.00 0.19 -1.13 107.32 112.99 3gdi s GLY 428 Ca 0.02 -0.86 0.00 0.00 0.00 0.00 0.00 44.72 43.88 3gdi s GLY 428 CO 0.02 -0.74 -0.05 -1.60 0.00 0.00 0.00 173.10 170.73 3gdi s ARG 429 N -0.63 2.41 -0.01 2.90 3.52 -0.66 -1.40 118.95 125.08 3gdi s ARG 429 Ca 0.07 -1.26 -0.01 0.00 -0.13 0.00 0.00 55.73 54.40 3gdi s ARG 429 Cb -0.08 -3.03 -0.04 0.00 -1.56 0.00 0.00 34.95 30.24 3gdi s ARG 429 CO -0.00 -0.57 0.11 -1.01 -0.81 0.00 0.00 175.30 173.02 3gdi s HIS 430 N 1.20 3.36 -0.16 5.12 3.76 0.14 -2.26 115.29 126.45 3gdi s HIS 430 Ca -0.06 0.25 0.00 0.00 -0.15 0.00 0.00 55.06 55.10 3gdi s HIS 430 Cb -0.19 -1.76 0.03 0.00 1.11 0.00 0.00 32.58 31.77 3gdi s HIS 430 CO -0.03 0.58 -0.10 0.21 -0.85 0.00 0.00 174.74 174.55 3gdi s LYS 431 N -1.79 1.91 -0.47 1.40 2.36 -0.45 -1.47 119.74 121.22 3gdi s LYS 431 Ca 0.24 -0.61 -0.28 0.00 -2.55 0.00 0.00 55.97 52.77 3gdi s LYS 431 Cb -0.12 -2.12 0.03 0.00 -1.05 0.00 0.00 37.83 34.57 3gdi s LYS 431 CO 0.15 -0.35 1.10 0.54 1.55 0.00 0.00 175.35 178.34 3gdi s VAL 432 N 1.52 4.26 0.02 4.02 0.11 -0.74 -0.70 120.40 128.90 3gdi s VAL 432 Ca 0.02 1.17 0.10 0.00 -2.93 0.00 0.00 61.98 60.34 3gdi s VAL 432 Cb -0.14 -4.57 -0.19 0.00 -1.53 0.00 0.00 36.38 29.94 3gdi s VAL 432 CO -0.09 -0.97 1.04 -0.09 -3.33 0.00 0.00 175.10 171.67 3gdi h ARG 433 N 9.17 0.00 -3.31 1.54 2.43 -1.27 -3.44 114.38 119.50 3gdi h ARG 433 Ca -0.23 0.00 -0.48 0.00 -0.81 0.00 0.00 59.98 58.46 3gdi h ARG 433 Cb 1.06 0.00 -0.40 0.00 -0.42 0.00 0.00 29.97 30.21 3gdi h ARG 433 CO 1.11 0.73 -0.76 0.08 -1.51 0.00 0.00 179.97 179.62 3gdi s VAL 434 N -2.71 0.21 1.18 0.20 1.01 -1.10 -4.99 120.40 114.20 3gdi s VAL 434 Ca -0.01 -0.32 -0.20 0.00 0.00 0.00 0.00 61.98 61.46 3gdi s VAL 434 Cb 0.09 -0.77 0.29 0.00 0.00 0.00 0.00 36.38 35.99 3gdi s VAL 434 CO 0.81 -0.21 1.02 0.61 0.00 0.00 0.00 175.10 177.33 3gdi n GLY 435 N 5.17 -2.82 3.80 4.51 0.00 -1.26 -1.04 105.19 113.54 3gdi n GLY 435 Ca -0.08 -1.48 -0.29 0.00 0.00 0.00 0.00 46.02 44.17 3gdi n GLY 435 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3gdi s PRO 436 N -5.33 1.37 0.16 1.61 0.04 -1.26 -4.74 135.00 126.86 3gdi s PRO 436 Ca 0.67 0.33 -0.04 0.00 0.04 0.00 0.00 61.00 62.00 3gdi s PRO 436 Cb -0.07 -1.86 -0.01 0.00 0.04 0.00 0.00 34.50 32.60 3gdi s PRO 436 CO 0.52 -2.04 1.39 1.25 0.04 0.00 0.00 177.00 178.15 3gdi h LEU 437 N -1.39 0.56 -8.66 -3.56 5.85 -1.96 -3.41 115.31 102.74 3gdi h LEU 437 Ca -0.50 -0.38 -0.67 0.00 0.84 0.00 0.00 57.88 57.17 3gdi h LEU 437 Cb 1.32 -0.17 -0.20 0.00 0.37 0.00 0.00 40.66 41.98 3gdi h LEU 437 CO 0.62 1.14 -0.52 0.21 -0.34 0.00 0.00 178.44 179.56 3gdi s ASN 438 N -7.02 5.83 0.55 1.25 3.04 -1.26 -5.00 114.94 112.33 3gdi s ASN 438 Ca -0.06 -0.44 0.25 0.00 0.04 0.00 0.00 52.86 52.65 3gdi s ASN 438 Cb 0.10 -2.08 1.57 0.00 -1.54 0.00 0.00 41.25 39.30 3gdi s ASN 438 CO 0.85 -0.21 2.17 -0.33 -3.04 0.00 0.00 177.10 176.55 3gdi h GLU 439 N 8.42 0.00 -5.74 0.43 5.08 -1.86 -3.38 114.58 117.53 3gdi h GLU 439 Ca -0.32 0.00 -0.61 0.00 -1.00 0.00 0.00 59.36 57.43 3gdi h GLU 439 Cb 1.15 0.00 -0.12 0.00 0.50 0.00 0.00 28.75 30.28 3gdi h GLU 439 CO 0.62 0.05 0.87 0.34 -1.00 0.00 0.00 179.01 179.89 3gdi s ASP 440 N -6.40 6.29 0.03 1.42 -1.08 -1.26 -4.39 116.67 111.27 3gdi s ASP 440 Ca -0.04 -1.06 0.23 0.00 -0.52 0.00 0.00 52.55 51.15 3gdi s ASP 440 Cb 0.15 -2.48 0.96 0.00 -1.46 0.00 0.00 42.92 40.09 3gdi s ASP 440 CO 0.59 -1.51 1.73 0.55 0.52 0.00 0.00 175.17 177.05 3gdi n VAL 441 N 6.13 0.47 0.54 1.11 3.14 -1.26 -3.10 118.33 125.36 3gdi n VAL 441 Ca 0.08 0.09 0.12 0.00 -2.96 0.00 0.00 64.34 61.67 3gdi n VAL 441 Cb 0.48 -0.74 0.15 0.00 -1.06 0.00 0.00 33.84 32.67 3gdi n VAL 441 CO 0.00 0.00 0.00 -0.26 -6.46 0.00 0.00 176.83 170.11 3gdi h PHE 442 N 0.00 0.00 -2.60 1.45 0.04 -1.88 -3.25 116.94 110.70 3gdi h PHE 442 Ca 0.00 0.00 -0.40 0.00 2.80 0.00 0.00 57.97 60.37 3gdi h PHE 442 Cb 0.41 0.00 0.21 0.00 2.20 0.00 0.00 35.95 38.77 3gdi h PHE 442 CO 0.00 0.00 -0.50 0.00 -0.60 0.00 0.00 178.31 177.21 3gdi n ALA 443 N -1.85 -3.54 -2.90 2.45 0.00 -1.18 -4.86 120.51 108.62 3gdi n ALA 443 Ca 0.03 -1.37 -0.26 0.00 0.00 0.00 0.00 53.44 51.84 3gdi n ALA 443 Cb 0.45 -1.57 -0.03 0.00 0.00 0.00 0.00 19.45 18.29 3gdi n ALA 443 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3gdi s ALA 444 N -2.23 3.93 0.12 0.00 0.00 -1.26 -3.75 121.76 118.56 3gdi s ALA 444 Ca 0.59 -1.00 -0.22 0.00 0.00 0.00 0.00 51.96 51.32 3gdi s ALA 444 Cb -0.15 -1.83 -0.07 0.00 0.00 0.00 0.00 23.12 21.06 3gdi s ALA 444 CO 0.60 0.47 0.68 -1.25 0.00 0.00 0.00 175.76 176.26 3gdi s PRO 445 N -3.35 4.40 0.00 0.00 0.04 -1.25 -4.81 135.00 130.02 3gdi s PRO 445 Ca 0.36 0.96 0.00 0.00 0.04 0.00 0.00 61.00 62.35 3gdi s PRO 445 Cb -0.11 -3.26 0.00 0.00 0.04 0.00 0.00 34.50 31.18 3gdi s PRO 445 CO 0.29 0.59 0.77 -2.30 0.04 0.00 0.00 177.00 176.38 3gdi n PRO 446 N 1.72 0.79 -5.25 0.56 -0.02 -1.26 -4.72 135.00 126.82 3gdi n PRO 446 Ca -0.08 0.00 -0.31 0.00 -2.02 0.00 0.00 63.50 61.09 3gdi n PRO 446 Cb 0.50 -1.12 -0.16 0.00 -0.02 0.00 0.00 33.50 32.69 3gdi n PRO 446 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3gdi n PRO 448 N 2.99 0.01 0.00 0.00 -0.02 -1.26 -4.77 135.00 131.94 3gdi n PRO 448 Ca -0.18 -0.61 0.00 0.00 -2.02 0.00 0.00 63.50 60.70 3gdi n PRO 448 Cb 0.52 -1.95 0.00 0.00 -0.02 0.00 0.00 33.50 32.05 3gdi n PRO 448 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 3gdi n GLU 449 N 6.00 0.00 0.00 -0.52 1.02 -1.26 -4.78 120.64 121.10 3gdi n GLU 449 Ca 0.24 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.38 3gdi n GLU 449 Cb 0.37 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.79 3gdi n GLU 449 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 3gdi n GLU 450 N 0.00 2.58 0.00 3.49 -0.58 -1.26 -5.13 120.64 119.74 3gdi n GLU 450 Ca 0.00 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.74 3gdi n GLU 450 Cb 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 30.87 3gdi n GLU 450 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 3gdi n LYS 451 N 0.00 0.00 0.00 3.49 4.76 -1.26 -5.10 118.16 120.05 3gdi n LYS 451 Ca 0.00 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.44 3gdi n LYS 451 Cb 0.00 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.19 3gdi n LYS 451 CO 0.00 0.00 0.00 2.41 -1.37 0.00 0.00 177.40 178.44 3gdi n THR 452 N 0.00 0.00 0.00 -0.18 -1.04 -1.26 -5.04 114.28 106.76 3gdi n THR 452 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 3gdi n THR 452 Cb 0.00 -0.01 0.00 0.00 -1.82 0.00 0.00 70.33 68.50 3gdi n THR 452 CO 0.00 0.00 0.00 -2.65 -0.64 0.00 0.00 175.07 171.78 3gdi n PRO 453 N -1.61 0.00 -3.52 -2.82 -0.02 -1.26 -4.87 135.00 120.91 3gdi n PRO 453 Ca 0.00 0.49 -0.21 0.00 -2.02 0.00 0.00 63.50 61.76 3gdi n PRO 453 Cb 0.00 -0.98 0.06 0.00 -0.02 0.00 0.00 33.50 32.55 3gdi n PRO 453 CO 0.00 0.00 0.00 0.72 1.98 0.00 0.00 175.50 178.20 3gdi n HIS 454 N -0.98 -2.12 -0.12 6.00 8.25 -1.26 -4.80 115.22 120.19 3gdi n HIS 454 Ca 0.00 0.79 -0.05 0.00 -0.26 0.00 0.00 57.72 58.20 3gdi n HIS 454 Cb 0.00 -4.28 -0.04 0.00 1.12 0.00 0.00 29.99 26.79 3gdi n HIS 454 CO 0.00 0.00 0.00 -1.35 0.64 0.00 0.00 176.34 175.63 3gdi h PRO 455 N -1.65 -0.08 -0.00 -0.41 0.11 -2.02 -1.82 132.00 126.12 3gdi h PRO 455 Ca -0.62 0.01 -0.14 0.00 0.11 0.00 0.00 66.00 65.36 3gdi h PRO 455 Cb 1.34 0.02 -0.02 0.00 0.11 0.00 0.00 31.00 32.45 3gdi h PRO 455 CO 0.50 -0.06 -0.65 0.77 -0.21 0.00 0.00 178.00 178.36 3gdi h SER 456 N -0.09 0.00 -0.34 -2.05 0.02 -2.00 -3.27 113.55 105.83 3gdi h SER 456 Ca 0.05 -0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 61.00 3gdi h SER 456 Cb 0.22 -0.00 -0.02 0.00 0.14 0.00 0.00 62.40 62.74 3gdi h SER 456 CO -0.33 0.65 0.21 0.58 -1.14 0.00 0.00 176.83 176.80 3gdi h VAL 457 N 0.00 1.11 -0.16 2.27 2.07 -1.81 -0.16 116.25 119.57 3gdi h VAL 457 Ca -0.01 -0.23 0.03 0.00 0.82 0.00 0.00 66.70 67.31 3gdi h VAL 457 Cb 1.14 0.65 -0.03 0.00 -1.52 0.00 0.00 31.29 31.54 3gdi h VAL 457 CO 0.08 0.10 -0.04 1.56 0.02 0.00 0.00 177.57 179.30 3gdi h GLN 458 N 0.44 -0.01 -0.01 1.57 4.20 -1.40 0.99 115.11 120.90 3gdi h GLN 458 Ca 0.12 0.00 0.03 0.00 0.06 0.00 0.00 58.65 58.86 3gdi h GLN 458 Cb -0.01 0.00 -0.04 0.00 0.30 0.00 0.00 27.48 27.73 3gdi h GLN 458 CO -0.02 -0.00 -0.22 1.49 -0.67 0.00 0.00 178.83 179.40 3gdi h GLU 459 N -0.01 -0.33 -0.26 1.46 4.81 -1.53 -1.60 114.58 117.13 3gdi h GLU 459 Ca 0.08 0.02 -0.07 0.00 -0.13 0.00 0.00 59.36 59.26 3gdi h GLU 459 Cb 0.12 0.07 -0.01 0.00 0.63 0.00 0.00 28.75 29.56 3gdi h GLU 459 CO -0.17 -0.22 -0.14 1.25 -0.73 0.00 0.00 179.01 179.01 3gdi h LEU 460 N -0.34 0.42 0.71 1.64 7.12 -0.83 -2.53 115.31 121.49 3gdi h LEU 460 Ca 0.06 -0.11 -0.03 0.00 0.13 0.00 0.00 57.88 57.93 3gdi h LEU 460 Cb 0.43 -0.11 0.01 0.00 -0.53 0.00 0.00 40.66 40.45 3gdi h LEU 460 CO -0.21 0.59 -0.34 0.74 -0.13 0.00 0.00 178.44 179.10 3gdi h THR 461 N 0.40 0.16 -0.02 1.05 2.02 -0.38 -1.79 112.91 114.36 3gdi h THR 461 Ca 0.08 -0.23 0.01 0.00 0.77 0.00 0.00 66.41 67.03 3gdi h THR 461 Cb 0.49 0.21 -0.00 0.00 -1.74 0.00 0.00 68.15 67.10 3gdi h THR 461 CO 0.03 0.02 0.02 -0.08 0.37 0.00 0.00 175.52 175.88 3gdi h GLU 462 N -1.14 0.00 -0.44 6.66 4.81 -1.30 -0.30 114.58 122.86 3gdi h GLU 462 Ca -0.10 0.00 -0.12 0.00 -0.13 0.00 0.00 59.36 59.01 3gdi h GLU 462 Cb 0.76 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.12 3gdi h GLU 462 CO 0.16 0.00 -0.22 0.37 -0.73 0.00 0.00 179.01 178.59 3gdi h GLN 463 N 0.00 0.88 -0.02 1.92 4.15 -1.25 -1.40 115.11 119.40 3gdi h GLN 463 Ca 0.01 -0.37 -0.09 0.00 0.77 0.00 0.00 58.65 58.97 3gdi h GLN 463 Cb 0.05 -0.04 0.01 0.00 0.21 0.00 0.00 27.48 27.71 3gdi h GLN 463 CO -0.00 1.01 -0.34 0.82 -1.93 0.00 0.00 178.83 178.39 3gdi h ILE 464 N 0.77 1.49 -0.73 2.39 2.04 -0.22 -2.95 117.51 120.29 3gdi h ILE 464 Ca 0.10 -1.92 0.10 0.00 1.00 0.00 0.00 64.86 64.14 3gdi h ILE 464 Cb 0.76 2.62 -0.07 0.00 -0.74 0.00 0.00 36.82 39.39 3gdi h ILE 464 CO 0.06 0.54 0.37 -0.74 0.00 0.00 0.00 178.15 178.38 3gdi h HIS 465 N -0.34 0.66 -0.33 1.37 2.76 -1.13 0.23 115.15 118.37 3gdi h HIS 465 Ca -0.04 0.03 0.06 0.00 -2.20 0.00 0.00 60.37 58.22 3gdi h HIS 465 Cb 1.06 -0.19 -0.05 0.00 1.55 0.00 0.00 27.41 29.78 3gdi h HIS 465 CO 0.16 0.24 0.00 -0.09 -1.30 0.00 0.00 177.93 176.94 3gdi h ARG 466 N 0.62 0.10 -0.42 5.26 2.43 -1.29 -2.29 114.38 118.79 3gdi h ARG 466 Ca 0.36 -0.01 0.06 0.00 -0.81 0.00 0.00 59.98 59.58 3gdi h ARG 466 Cb 0.38 -0.02 -0.05 0.00 -0.42 0.00 0.00 29.97 29.86 3gdi h ARG 466 CO -0.27 0.06 0.13 1.25 -1.51 0.00 0.00 179.97 179.63 3gdi h LEU 467 N 0.10 0.11 0.00 3.80 5.85 -0.83 -2.21 115.31 122.13 3gdi h LEU 467 Ca 0.16 0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.94 3gdi h LEU 467 Cb 0.22 0.05 0.00 0.00 0.37 0.00 0.00 40.66 41.30 3gdi h LEU 467 CO -0.27 0.10 0.00 0.18 -0.34 0.00 0.00 178.44 178.11 3gdi n LEU 468 N -5.04 0.00 0.07 2.25 7.99 -0.42 -2.77 117.00 119.08 3gdi n LEU 468 Ca 0.03 0.02 0.13 0.00 -0.01 0.00 0.00 56.01 56.18 3gdi n LEU 468 Cb 0.17 -0.02 0.37 0.00 -0.11 0.00 0.00 43.42 43.83 3gdi n LEU 468 CO 0.25 -0.01 0.73 0.23 -1.51 0.00 0.00 177.39 177.08 3gdi n MET 469 N -1.02 0.20 -2.80 3.23 2.81 -0.83 -4.35 117.12 114.36 3gdi n MET 469 Ca 0.13 0.13 -0.40 0.00 -1.81 0.00 0.00 57.70 55.75 3gdi n MET 469 Cb 0.07 -1.70 -0.05 0.00 -0.71 0.00 0.00 33.22 30.83 3gdi n MET 469 CO 0.00 0.00 0.00 -0.65 1.51 0.00 0.00 175.97 176.83 3gdi s GLN 470 N -3.09 4.69 0.35 0.03 -1.52 -1.12 -4.99 119.66 114.01 3gdi s GLN 470 Ca 0.10 1.37 -0.28 0.00 -1.95 0.00 0.00 55.36 54.59 3gdi s GLN 470 Cb 0.14 -3.34 -0.11 0.00 -0.22 0.00 0.00 33.01 29.48 3gdi s GLN 470 CO 0.62 0.32 1.45 -2.14 -0.25 0.00 0.00 175.29 175.30 3gdi s PRO 471 N -0.37 4.18 -0.95 2.91 0.02 -1.26 -4.66 135.00 134.87 3gdi s PRO 471 Ca 0.43 2.47 -0.15 0.00 0.02 0.00 0.00 61.00 63.77 3gdi s PRO 471 Cb -0.23 -3.00 0.19 0.00 0.02 0.00 0.00 34.50 31.47 3gdi s PRO 471 CO 0.29 -0.45 1.03 0.08 -0.33 0.00 0.00 177.00 177.62 3gdi s VAL 472 N -0.98 5.26 -2.00 3.83 1.01 0.10 -4.97 120.40 122.66 3gdi s VAL 472 Ca 0.53 -2.28 0.13 0.00 0.00 0.00 0.00 61.98 60.36 3gdi s VAL 472 Cb -0.45 -4.66 0.37 0.00 0.00 0.00 0.00 36.38 31.64 3gdi s VAL 472 CO 0.58 -1.30 1.20 -0.81 0.00 0.00 0.00 175.10 174.77