#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3kqg n ASN 168 N 0.00 0.00 0.10 1.96 4.13 -1.26 0.77 115.26 120.96 3kqg n ASN 168 Ca 0.00 0.00 -0.04 0.00 1.68 0.00 0.00 54.58 56.22 3kqg n ASN 168 Cb 0.00 0.00 0.13 0.00 -1.54 0.00 0.00 39.78 38.37 3kqg n ASN 168 CO 0.00 0.00 0.00 0.71 0.28 0.00 0.00 177.26 178.25 3kqg h THR 169 N 0.00 1.41 0.57 3.41 1.35 -2.07 -2.84 112.91 114.74 3kqg h THR 169 Ca 0.00 -2.04 -0.03 0.00 -0.55 0.00 0.00 66.41 63.79 3kqg h THR 169 Cb 0.00 2.06 0.01 0.00 -1.73 0.00 0.00 68.15 68.48 3kqg h THR 169 CO 0.00 0.60 -0.27 0.11 -0.25 0.00 0.00 175.52 175.71 3kqg h LYS 170 N 0.13 -0.73 -0.96 4.72 1.57 -0.10 -3.26 116.57 117.94 3kqg h LYS 170 Ca -0.01 0.05 0.16 0.00 -1.87 0.00 0.00 60.65 58.98 3kqg h LYS 170 Cb 1.12 0.17 -0.08 0.00 0.08 0.00 0.00 32.23 33.51 3kqg h LYS 170 CO 0.09 -0.44 0.61 0.82 -0.57 0.00 0.00 179.45 179.96 3kqg h ILE 171 N -1.12 0.81 0.00 1.86 5.03 -1.71 0.43 117.51 122.81 3kqg h ILE 171 Ca -0.08 -0.27 0.00 0.00 -0.12 0.00 0.00 64.86 64.40 3kqg h ILE 171 Cb 0.63 -0.04 0.00 0.00 -3.03 0.00 0.00 36.82 34.38 3kqg h ILE 171 CO 0.13 0.14 0.03 -0.09 -0.68 0.00 0.00 178.15 177.68 3kqg h ARG 172 N 0.78 0.00 0.00 2.37 2.43 -1.54 -1.93 114.38 116.50 3kqg h ARG 172 Ca 0.50 0.00 -0.33 0.00 -0.81 0.00 0.00 59.98 59.35 3kqg h ARG 172 Cb 0.75 0.00 -0.06 0.00 -0.42 0.00 0.00 29.97 30.24 3kqg h ARG 172 CO -0.27 0.00 -2.02 0.00 -1.51 0.00 0.00 179.97 176.17 3kqg n ALA 173 N -2.05 1.49 -0.13 2.80 0.00 0.13 -3.96 120.51 118.78 3kqg n ALA 173 Ca -0.03 -1.02 -0.10 0.00 0.00 0.00 0.00 53.44 52.30 3kqg n ALA 173 Cb 0.10 -0.55 -0.01 0.00 0.00 0.00 0.00 19.45 18.99 3kqg n ALA 173 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 3kqg h LEU 174 N 0.00 0.62 -1.47 0.00 3.38 -1.23 -1.06 115.31 115.55 3kqg h LEU 174 Ca -0.41 -0.26 0.21 0.00 0.09 0.00 0.00 57.88 57.52 3kqg h LEU 174 Cb 2.12 -0.16 -0.07 0.00 0.09 0.00 0.00 40.66 42.63 3kqg h LEU 174 CO 0.06 0.71 0.61 1.56 0.09 0.00 0.00 178.44 181.47 3kqg h GLN 175 N 0.49 0.41 0.10 1.13 4.20 -1.67 -1.58 115.11 118.19 3kqg h GLN 175 Ca 0.12 -0.02 -0.00 0.00 0.06 0.00 0.00 58.65 58.80 3kqg h GLN 175 Cb 0.36 -0.09 0.00 0.00 0.30 0.00 0.00 27.48 28.04 3kqg h GLN 175 CO 0.01 0.27 -0.05 0.78 -0.67 0.00 0.00 178.83 179.17 3kqg h GLY 176 N 0.43 -0.14 0.99 3.46 0.00 -1.54 -3.04 103.07 103.24 3kqg h GLY 176 Ca 0.49 0.05 0.00 0.00 0.00 0.00 0.00 47.33 47.87 3kqg h GLY 176 CO -0.20 -0.05 0.00 -1.14 0.00 0.00 0.00 176.54 175.15 3kqg n SER 177 N -4.83 0.00 -0.11 0.19 3.41 -0.46 -1.72 113.62 110.10 3kqg n SER 177 Ca -0.06 -0.40 -0.23 0.00 -0.26 0.00 0.00 58.87 57.92 3kqg n SER 177 Cb 0.24 0.00 -0.10 0.00 -0.26 0.00 0.00 64.21 64.10 3kqg n SER 177 CO 0.00 0.00 0.00 -0.11 -0.16 0.00 0.00 175.04 174.77 3kqg n LEU 178 N -1.00 1.90 0.00 1.04 7.94 -0.61 -3.57 117.00 122.70 3kqg n LEU 178 Ca 0.09 0.40 0.06 0.00 -1.11 0.00 0.00 56.01 55.46 3kqg n LEU 178 Cb 0.04 -0.89 0.29 0.00 0.53 0.00 0.00 43.42 43.40 3kqg n LEU 178 CO 0.07 0.30 0.70 -1.84 -1.11 0.00 0.00 177.39 175.50 3kqg n GLU 179 N -4.38 0.05 0.09 1.96 0.28 -1.13 -0.64 120.64 116.88 3kqg n GLU 179 Ca -0.38 0.24 -0.13 0.00 -0.16 0.00 0.00 57.16 56.74 3kqg n GLU 179 Cb 0.72 -1.50 -0.08 0.00 1.43 0.00 0.00 31.44 32.00 3kqg n GLU 179 CO 0.00 0.00 0.00 -0.91 -0.16 0.00 0.00 177.13 176.06 3kqg h ASN 180 N 0.00 -0.19 0.28 -1.84 2.35 -1.46 -2.95 115.58 111.77 3kqg h ASN 180 Ca 0.00 -0.21 -0.16 0.00 -0.55 0.00 0.00 56.30 55.37 3kqg h ASN 180 Cb 0.20 0.05 -0.01 0.00 0.05 0.00 0.00 38.32 38.61 3kqg h ASN 180 CO 0.00 0.12 -0.64 0.24 -1.65 0.00 0.00 177.43 175.50 3kqg h MET 181 N -0.50 0.35 -0.53 0.81 2.86 -1.18 -2.69 114.93 114.04 3kqg h MET 181 Ca -0.02 -0.25 0.03 0.00 -2.06 0.00 0.00 59.70 57.39 3kqg h MET 181 Cb 0.39 0.04 -0.04 0.00 0.06 0.00 0.00 31.60 32.06 3kqg h MET 181 CO 0.04 0.87 0.32 1.03 1.06 0.00 0.00 176.91 180.23 3kqg h SER 182 N 0.25 0.51 -0.51 1.22 0.87 -0.96 0.32 113.55 115.24 3kqg h SER 182 Ca -0.01 0.01 -0.11 0.00 -1.23 0.00 0.00 61.79 60.44 3kqg h SER 182 Cb 1.18 -0.10 -0.02 0.00 -0.44 0.00 0.00 62.40 63.02 3kqg h SER 182 CO 0.11 0.36 -0.12 0.11 -0.53 0.00 0.00 176.83 176.76 3kqg h LYS 183 N 0.63 1.00 -0.56 2.24 1.57 -1.51 -2.02 116.57 117.91 3kqg h LYS 183 Ca 0.21 -0.37 -0.07 0.00 -1.87 0.00 0.00 60.65 58.55 3kqg h LYS 183 Cb 0.03 -0.06 -0.02 0.00 0.08 0.00 0.00 32.23 32.25 3kqg h LYS 183 CO -0.10 1.05 0.07 -0.07 -0.57 0.00 0.00 179.45 179.84 3kqg h LEU 184 N 0.89 0.86 -0.35 2.94 3.38 -1.08 -1.73 115.31 120.22 3kqg h LEU 184 Ca 0.14 -0.19 -0.13 0.00 0.09 0.00 0.00 57.88 57.78 3kqg h LEU 184 Cb 0.68 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 41.20 3kqg h LEU 184 CO 0.05 0.88 -0.30 0.25 0.09 0.00 0.00 178.44 179.41 3kqg h LEU 185 N 0.85 0.87 -0.50 1.67 5.85 -0.23 -1.96 115.31 121.87 3kqg h LEU 185 Ca 0.17 -0.45 -0.03 0.00 0.84 0.00 0.00 57.88 58.41 3kqg h LEU 185 Cb 0.40 -0.24 -0.02 0.00 0.37 0.00 0.00 40.66 41.16 3kqg h LEU 185 CO 0.01 1.14 0.18 0.11 -0.34 0.00 0.00 178.44 179.54 3kqg h LYS 186 N 0.61 0.76 -0.28 1.25 1.57 -1.28 0.44 116.57 119.64 3kqg h LYS 186 Ca 0.06 -0.15 0.06 0.00 -1.87 0.00 0.00 60.65 58.76 3kqg h LYS 186 Cb 0.88 -0.12 -0.08 0.00 0.08 0.00 0.00 32.23 32.99 3kqg h LYS 186 CO 0.08 0.69 -0.34 -0.09 -0.57 0.00 0.00 179.45 179.21 3kqg h ARG 187 N 0.67 -0.32 -0.87 3.15 2.43 -1.23 0.29 114.38 118.51 3kqg h ARG 187 Ca 0.16 0.02 -0.02 0.00 -0.81 0.00 0.00 59.98 59.33 3kqg h ARG 187 Cb 0.23 0.07 -0.04 0.00 -0.42 0.00 0.00 29.97 29.81 3kqg h ARG 187 CO -0.01 -0.21 0.44 1.96 -1.51 0.00 0.00 179.97 180.64 3kqg h GLN 188 N -0.33 1.23 -0.21 0.20 4.20 -1.03 -0.36 115.11 118.80 3kqg h GLN 188 Ca 0.13 -0.16 -0.01 0.00 0.06 0.00 0.00 58.65 58.67 3kqg h GLN 188 Cb 0.55 -0.23 -0.01 0.00 0.30 0.00 0.00 27.48 28.09 3kqg h GLN 188 CO -0.47 0.92 0.08 -0.97 -0.67 0.00 0.00 178.83 177.72 3kqg h ASN 189 N 1.22 0.30 -0.17 1.46 -1.24 -0.42 0.21 115.58 116.94 3kqg h ASN 189 Ca 0.30 -0.17 0.05 0.00 0.71 0.00 0.00 56.30 57.19 3kqg h ASN 189 Cb 0.07 -0.08 -0.06 0.00 0.73 0.00 0.00 38.32 38.99 3kqg h ASN 189 CO -0.04 0.39 -0.24 0.44 -1.29 0.00 0.00 177.43 176.68 3kqg h ASP 190 N 0.19 -0.76 -0.77 1.15 3.32 0.05 -0.65 116.42 118.94 3kqg h ASP 190 Ca 0.07 0.13 -0.03 0.00 0.02 0.00 0.00 57.03 57.22 3kqg h ASP 190 Cb 0.19 0.34 -0.04 0.00 0.22 0.00 0.00 39.33 40.05 3kqg h ASP 190 CO -0.01 -0.29 0.37 0.40 -1.72 0.00 0.00 179.24 178.00 3kqg h ILE 191 N -0.29 1.24 -0.60 0.35 2.04 -0.92 -3.05 117.51 116.29 3kqg h ILE 191 Ca 0.11 -0.68 -0.09 0.00 1.00 0.00 0.00 64.86 65.20 3kqg h ILE 191 Cb 0.46 0.27 -0.02 0.00 -0.74 0.00 0.00 36.82 36.79 3kqg h ILE 191 CO -0.33 0.29 0.02 0.25 0.00 0.00 0.00 178.15 178.38 3kqg h LEU 192 N 1.08 1.00 -1.03 1.44 5.85 -0.07 -2.01 115.31 121.57 3kqg h LEU 192 Ca 0.27 -0.27 0.06 0.00 0.84 0.00 0.00 57.88 58.78 3kqg h LEU 192 Cb 0.11 -0.27 -0.06 0.00 0.37 0.00 0.00 40.66 40.81 3kqg h LEU 192 CO -0.03 1.04 0.64 1.56 -0.34 0.00 0.00 178.44 181.31 3kqg h GLN 193 N 0.95 1.14 0.02 1.25 4.20 -1.02 0.18 115.11 121.83 3kqg h GLN 193 Ca 0.17 -0.07 -0.26 0.00 0.06 0.00 0.00 58.65 58.56 3kqg h GLN 193 Cb 0.52 -0.26 -0.03 0.00 0.30 0.00 0.00 27.48 28.01 3kqg h GLN 193 CO 0.03 0.76 -1.36 0.28 -0.67 0.00 0.00 178.83 177.86 3kqg h VAL 194 N 1.18 1.29 -0.37 -0.54 2.07 -1.53 -3.06 116.25 115.29 3kqg h VAL 194 Ca 0.42 -3.04 -0.07 0.00 0.82 0.00 0.00 66.70 64.83 3kqg h VAL 194 Cb 0.14 2.67 -0.02 0.00 -1.52 0.00 0.00 31.29 32.57 3kqg h VAL 194 CO -0.16 0.77 -0.08 0.58 0.02 0.00 0.00 177.57 178.70 3kqg h VAL 195 N 0.01 1.24 0.00 2.57 2.07 -1.08 -1.88 116.25 119.18 3kqg h VAL 195 Ca -0.16 -1.03 0.00 0.00 0.82 0.00 0.00 66.70 66.33 3kqg h VAL 195 Cb 1.91 1.05 0.00 0.00 -1.52 0.00 0.00 31.29 32.72 3kqg h VAL 195 CO 0.12 0.35 0.00 -1.20 0.02 0.00 0.00 177.57 176.85 3kqg n SER 196 N -4.20 0.14 -1.08 0.57 7.64 0.59 -2.09 113.62 115.18 3kqg n SER 196 Ca 0.01 0.53 0.10 0.00 1.01 0.00 0.00 58.87 60.53 3kqg n SER 196 Cb 0.32 -0.56 0.24 0.00 -1.01 0.00 0.00 64.21 63.20 3kqg n SER 196 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3kqg n GLN 197 N -1.65 2.61 -0.08 1.43 6.02 -0.77 -4.95 117.38 119.99 3kqg n GLN 197 Ca 0.03 -2.35 0.00 0.00 -0.01 0.00 0.00 57.00 54.67 3kqg n GLN 197 Cb 0.18 -1.46 0.00 0.00 1.02 0.00 0.00 30.24 29.97 3kqg n GLN 197 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3kqg n GLY 198 N 1.28 0.59 3.96 1.08 0.00 -0.89 -5.08 105.19 106.13 3kqg n GLY 198 Ca 0.19 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.98 3kqg n GLY 198 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3kqg s TRP 199 N -2.15 2.65 0.26 1.61 0.52 -0.84 -4.77 118.94 116.22 3kqg s TRP 199 Ca 0.00 0.13 0.11 0.00 0.02 0.00 0.00 56.10 56.36 3kqg s TRP 199 Cb 0.00 -3.00 -0.05 0.00 -1.15 0.00 0.00 33.47 29.27 3kqg s TRP 199 CO 0.00 -1.26 -0.15 0.15 0.02 0.00 0.00 176.95 175.71 3kqg s LYS 200 N -5.04 1.82 0.03 4.98 -0.14 0.74 -4.20 119.74 117.92 3kqg s LYS 200 Ca 0.60 -1.64 0.07 0.00 -1.36 0.00 0.00 55.97 53.64 3kqg s LYS 200 Cb -0.10 -1.89 -0.02 0.00 -1.68 0.00 0.00 37.83 34.14 3kqg s LYS 200 CO 0.42 0.35 -0.20 -0.47 -0.76 0.00 0.00 175.35 174.69 3kqg s TYR 201 N -2.33 1.75 -0.30 3.18 5.04 -1.26 -0.51 117.35 122.92 3kqg s TYR 201 Ca 0.29 -0.36 -0.07 0.00 -2.44 0.00 0.00 57.07 54.49 3kqg s TYR 201 Cb -0.06 -1.07 0.16 0.00 0.35 0.00 0.00 41.96 41.35 3kqg s TYR 201 CO 0.16 0.05 0.69 0.12 -1.34 0.00 0.00 175.55 175.22 3kqg s PHE 202 N -0.70 -1.35 -0.72 4.97 5.36 -0.47 -4.99 117.98 120.08 3kqg s PHE 202 Ca 0.07 1.84 -0.11 0.00 -0.96 0.00 0.00 56.93 57.77 3kqg s PHE 202 Cb -0.08 0.63 0.02 0.00 -0.34 0.00 0.00 43.02 43.24 3kqg s PHE 202 CO 0.01 -0.71 0.62 1.63 -1.46 0.00 0.00 175.22 175.31 3kqg n LYS 203 N 5.40 -1.66 -0.30 10.12 5.02 -1.26 -2.45 118.16 133.04 3kqg n LYS 203 Ca -0.07 0.94 0.00 0.00 -2.02 0.00 0.00 58.31 57.16 3kqg n LYS 203 Cb 0.51 -2.19 0.00 0.00 -0.02 0.00 0.00 35.03 33.32 3kqg n LYS 203 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3kqg n GLY 204 N -1.24 1.93 3.19 0.72 0.00 -1.26 -5.00 105.19 103.54 3kqg n GLY 204 Ca -0.26 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.56 3kqg n GLY 204 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3kqg s ASN 205 N -3.43 1.91 -0.11 1.61 0.01 -1.02 -0.00 114.94 113.90 3kqg s ASN 205 Ca 0.00 -0.57 -0.09 0.00 -0.71 0.00 0.00 52.86 51.49 3kqg s ASN 205 Cb 0.00 -0.10 -0.04 0.00 0.41 0.00 0.00 41.25 41.52 3kqg s ASN 205 CO 0.00 0.00 0.18 -0.36 -1.51 0.00 0.00 177.10 175.42 3kqg s PHE 206 N -1.08 3.60 0.06 2.20 0.08 0.58 -1.37 117.98 122.06 3kqg s PHE 206 Ca 0.02 0.59 0.07 0.00 0.12 0.00 0.00 56.93 57.73 3kqg s PHE 206 Cb -0.09 -2.02 -0.03 0.00 -0.57 0.00 0.00 43.02 40.31 3kqg s PHE 206 CO 0.02 0.68 -0.20 0.71 -0.10 0.00 0.00 175.22 176.33 3kqg s TYR 207 N -0.90 1.73 -0.22 0.36 2.02 0.33 -1.30 117.35 119.37 3kqg s TYR 207 Ca 0.16 -0.39 0.01 0.00 -0.37 0.00 0.00 57.07 56.48 3kqg s TYR 207 Cb -0.13 -1.00 0.05 0.00 -0.40 0.00 0.00 41.96 40.49 3kqg s TYR 207 CO 0.05 0.12 -0.10 -0.47 -1.57 0.00 0.00 175.55 173.59 3kqg s TYR 208 N -0.94 2.64 -0.37 2.71 5.04 -0.19 -0.19 117.35 126.05 3kqg s TYR 208 Ca 0.06 -1.82 -0.17 0.00 -2.44 0.00 0.00 57.07 52.70 3kqg s TYR 208 Cb -0.09 -1.71 0.00 0.00 0.35 0.00 0.00 41.96 40.51 3kqg s TYR 208 CO 0.03 -0.79 0.45 -0.06 -1.34 0.00 0.00 175.55 173.83 3kqg s PHE 209 N 1.32 3.18 0.84 4.97 0.08 -1.26 -0.86 117.98 126.24 3kqg s PHE 209 Ca -0.04 -0.08 -0.11 0.00 0.12 0.00 0.00 56.93 56.82 3kqg s PHE 209 Cb -0.18 -2.86 0.10 0.00 -0.57 0.00 0.00 43.02 39.51 3kqg s PHE 209 CO -0.07 -0.57 1.09 -1.54 -0.10 0.00 0.00 175.22 174.03 3kqg s SER 210 N 1.78 3.97 -0.00 1.36 1.04 -0.43 -4.97 113.70 116.45 3kqg s SER 210 Ca 0.15 1.50 0.07 0.00 0.48 0.00 0.00 55.95 58.14 3kqg s SER 210 Cb -0.16 -2.21 -0.08 0.00 0.10 0.00 0.00 66.02 63.67 3kqg s SER 210 CO 0.13 -2.33 0.24 0.18 0.98 0.00 0.00 173.24 172.44 3kqg n LEU 211 N -3.68 0.21 -4.50 2.42 4.77 -1.26 -4.71 117.00 110.25 3kqg n LEU 211 Ca 0.07 -0.34 -0.34 0.00 -0.03 0.00 0.00 56.01 55.38 3kqg n LEU 211 Cb 0.55 0.00 -0.12 0.00 -2.33 0.00 0.00 43.42 41.52 3kqg n LEU 211 CO 0.55 0.05 -0.38 -0.51 -1.33 0.00 0.00 177.39 175.77 3kqg s ILE 212 N -1.89 3.63 0.34 -0.08 2.07 -1.26 -5.04 121.20 118.96 3kqg s ILE 212 Ca 0.01 -0.47 -0.22 0.00 -1.41 0.00 0.00 60.65 58.56 3kqg s ILE 212 Cb 0.05 -2.54 -0.10 0.00 0.13 0.00 0.00 42.46 40.00 3kqg s ILE 212 CO 0.27 0.54 0.88 -2.84 -1.91 0.00 0.00 174.94 171.88 3kqg s PRO 213 N -0.06 4.32 0.18 3.50 0.02 -1.26 -4.51 135.00 137.20 3kqg s PRO 213 Ca 0.00 1.09 -0.10 0.00 0.02 0.00 0.00 61.00 62.01 3kqg s PRO 213 Cb -0.13 -2.54 -0.01 0.00 0.02 0.00 0.00 34.50 31.84 3kqg s PRO 213 CO 0.03 0.17 0.34 0.15 -0.33 0.00 0.00 177.00 177.36 3kqg s LYS 214 N -2.57 1.25 0.83 5.54 1.02 -0.01 -4.79 119.74 121.01 3kqg s LYS 214 Ca 0.54 -1.17 -0.11 0.00 0.02 0.00 0.00 55.97 55.25 3kqg s LYS 214 Cb -0.14 0.40 0.09 0.00 -0.52 0.00 0.00 37.83 37.67 3kqg s LYS 214 CO 0.19 -0.48 1.10 0.95 -0.92 0.00 0.00 175.35 176.19 3kqg s THR 215 N -3.98 2.94 0.17 2.17 -4.23 -1.25 -1.30 115.64 110.17 3kqg s THR 215 Ca 0.18 0.31 -0.17 0.00 -1.18 0.00 0.00 61.69 60.83 3kqg s THR 215 Cb 0.02 -2.68 0.10 0.00 1.34 0.00 0.00 72.50 71.29 3kqg s THR 215 CO 0.02 -0.40 1.66 -0.25 -0.54 0.00 0.00 174.62 175.11 3kqg h TRP 216 N -1.37 -0.25 -0.24 3.99 7.01 -1.53 -0.88 115.95 122.68 3kqg h TRP 216 Ca -0.44 0.04 -0.20 0.00 2.11 0.00 0.00 58.89 60.40 3kqg h TRP 216 Cb 1.25 0.18 0.00 0.00 -2.10 0.00 0.00 29.16 28.49 3kqg h TRP 216 CO 0.54 -0.19 -0.62 -0.92 -2.79 0.00 0.00 178.44 174.46 3kqg h TYR 217 N -0.02 1.08 -0.77 2.65 3.20 -1.92 -1.63 116.97 119.56 3kqg h TYR 217 Ca 0.20 -0.42 0.00 0.00 3.14 0.00 0.00 58.73 61.66 3kqg h TYR 217 Cb 0.32 -0.19 -0.04 0.00 1.54 0.00 0.00 36.73 38.36 3kqg h TYR 217 CO -0.37 1.25 0.50 0.77 -1.64 0.00 0.00 178.16 178.66 3kqg h SER 218 N 0.60 0.90 -0.47 -2.11 0.02 -1.87 -1.47 113.55 109.15 3kqg h SER 218 Ca -0.01 -0.03 0.05 0.00 -0.84 0.00 0.00 61.79 60.96 3kqg h SER 218 Cb 1.23 -0.23 -0.05 0.00 0.14 0.00 0.00 62.40 63.50 3kqg h SER 218 CO 0.13 0.66 0.20 0.00 -1.14 0.00 0.00 176.83 176.69 3kqg h ALA 219 N 1.27 0.58 -0.65 3.77 0.00 -1.04 -1.30 119.26 121.91 3kqg h ALA 219 Ca 0.28 0.04 0.03 0.00 0.00 0.00 0.00 54.91 55.26 3kqg h ALA 219 Cb -0.10 -0.02 -0.04 0.00 0.00 0.00 0.00 17.79 17.64 3kqg h ALA 219 CO -0.06 -0.17 0.43 1.49 0.00 0.00 0.00 179.25 180.94 3kqg h GLU 220 N 0.41 0.75 -0.27 0.00 4.57 -0.45 -0.19 114.58 119.40 3kqg h GLU 220 Ca 0.21 -0.05 -0.14 0.00 -1.18 0.00 0.00 59.36 58.21 3kqg h GLU 220 Cb 0.17 -0.17 -0.00 0.00 -0.16 0.00 0.00 28.75 28.59 3kqg h GLU 220 CO -0.18 0.50 -0.38 1.96 -1.18 0.00 0.00 179.01 179.72 3kqg h GLN 221 N 0.78 0.74 -0.59 1.92 4.20 -0.76 -0.47 115.11 120.92 3kqg h GLN 221 Ca 0.26 -0.43 0.06 0.00 0.06 0.00 0.00 58.65 58.60 3kqg h GLN 221 Cb 0.06 0.04 -0.06 0.00 0.30 0.00 0.00 27.48 27.82 3kqg h GLN 221 CO -0.07 1.05 0.29 0.35 -0.67 0.00 0.00 178.83 179.78 3kqg h PHE 222 N 0.48 0.52 0.09 2.96 3.57 -0.36 0.22 116.94 124.42 3kqg h PHE 222 Ca 0.03 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.55 3kqg h PHE 222 Cb 0.97 -0.15 -0.01 0.00 2.79 0.00 0.00 35.95 39.56 3kqg h PHE 222 CO 0.08 0.23 -0.07 0.00 -2.23 0.00 0.00 178.31 176.31 3kqg h VAL 224 N -0.17 0.89 0.00 0.00 2.07 -0.26 0.48 116.25 119.25 3kqg h VAL 224 Ca -0.00 -0.21 0.00 0.00 0.82 0.00 0.00 66.70 67.31 3kqg h VAL 224 Cb 0.16 0.23 0.00 0.00 -1.52 0.00 0.00 31.29 30.16 3kqg h VAL 224 CO -0.01 0.11 0.00 -1.54 0.02 0.00 0.00 177.57 176.15 3kqg n SER 225 N -4.50 0.00 -1.05 0.57 3.41 0.70 -2.26 113.62 110.49 3kqg n SER 225 Ca 0.14 0.38 0.02 0.00 -0.26 0.00 0.00 58.87 59.14 3kqg n SER 225 Cb 0.40 -0.45 0.23 0.00 -0.26 0.00 0.00 64.21 64.13 3kqg n SER 225 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 3kqg n ARG 226 N -1.45 2.42 -2.88 4.33 5.12 0.16 -4.96 116.66 119.40 3kqg n ARG 226 Ca 0.06 -2.99 -0.20 0.00 -1.93 0.00 0.00 57.85 52.80 3kqg n ARG 226 Cb 0.23 -1.84 0.03 0.00 -1.16 0.00 0.00 32.46 29.71 3kqg n ARG 226 CO 0.00 0.00 0.00 -1.71 -1.93 0.00 0.00 177.63 173.99 3kqg n ASN 227 N -0.81 -5.59 -2.16 0.55 2.85 -0.96 -4.97 115.26 104.17 3kqg n ASN 227 Ca 0.28 -0.24 -0.09 0.00 -0.11 0.00 0.00 54.58 54.43 3kqg n ASN 227 Cb 0.98 -4.44 -0.02 0.00 1.24 0.00 0.00 39.78 37.54 3kqg n ASN 227 CO 0.00 0.00 0.00 -1.54 -2.11 0.00 0.00 177.26 173.61 3kqg n SER 228 N -1.97 -0.78 -4.33 1.20 3.41 -0.65 -4.80 113.62 105.70 3kqg n SER 228 Ca -0.11 -2.10 -0.17 0.00 -0.26 0.00 0.00 58.87 56.23 3kqg n SER 228 Cb 0.61 1.45 -0.10 0.00 -0.26 0.00 0.00 64.21 65.91 3kqg n SER 228 CO 0.00 0.00 0.00 -1.00 -0.16 0.00 0.00 175.04 173.88 3kqg s HIS 229 N -3.77 1.55 0.25 7.33 3.76 -1.10 -2.00 115.29 121.31 3kqg s HIS 229 Ca 0.17 -0.91 -0.31 0.00 -0.15 0.00 0.00 55.06 53.86 3kqg s HIS 229 Cb -0.01 -0.89 -0.13 0.00 1.11 0.00 0.00 32.58 32.66 3kqg s HIS 229 CO 0.12 -0.03 1.41 1.28 -0.85 0.00 0.00 174.74 176.67 3kqg n LEU 230 N -0.41 3.21 -4.76 0.89 4.77 -1.26 -0.23 117.00 119.21 3kqg n LEU 230 Ca -0.05 1.15 -0.39 0.00 -0.03 0.00 0.00 56.01 56.68 3kqg n LEU 230 Cb 0.64 -1.44 0.03 0.00 -2.33 0.00 0.00 43.42 40.31 3kqg n LEU 230 CO 0.36 -0.45 1.01 0.28 -1.33 0.00 0.00 177.39 177.26 3kqg s THR 231 N -0.13 2.14 0.55 -5.08 -1.32 0.50 -4.02 115.64 108.29 3kqg s THR 231 Ca 0.67 0.12 0.04 0.00 -1.21 0.00 0.00 61.69 61.31 3kqg s THR 231 Cb -0.63 -3.06 0.05 0.00 -1.51 0.00 0.00 72.50 67.34 3kqg s THR 231 CO 0.50 0.01 0.76 -0.94 -2.21 0.00 0.00 174.62 172.74 3kqg s SER 232 N -0.78 5.20 -0.08 8.08 1.04 -1.26 -0.13 113.70 125.77 3kqg s SER 232 Ca 0.66 -0.34 0.01 0.00 0.48 0.00 0.00 55.95 56.77 3kqg s SER 232 Cb -0.41 -0.46 0.02 0.00 0.10 0.00 0.00 66.02 65.27 3kqg s SER 232 CO 0.51 -1.19 -0.11 -0.69 0.98 0.00 0.00 173.24 172.74 3kqg s VAL 233 N -2.69 1.09 0.00 5.02 1.01 -1.26 -4.97 120.40 118.60 3kqg s VAL 233 Ca 0.59 -0.42 0.00 0.00 0.00 0.00 0.00 61.98 62.15 3kqg s VAL 233 Cb -0.09 -1.03 0.00 0.00 0.00 0.00 0.00 36.38 35.26 3kqg s VAL 233 CO 0.38 0.36 0.56 0.35 0.00 0.00 0.00 175.10 176.75 3kqg n THR 234 N 4.14 0.29 -3.60 3.92 -2.24 -1.26 -4.96 114.28 110.58 3kqg n THR 234 Ca -0.20 -0.50 -0.03 0.00 -2.27 0.00 0.00 64.05 61.04 3kqg n THR 234 Cb 0.51 1.02 -0.02 0.00 -2.10 0.00 0.00 70.33 69.75 3kqg n THR 234 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 3kqg s SER 235 N -0.29 -0.14 0.26 3.42 1.04 -1.26 -5.02 113.70 111.72 3kqg s SER 235 Ca 0.00 -0.03 -0.04 0.00 0.48 0.00 0.00 55.95 56.35 3kqg s SER 235 Cb 0.00 0.17 0.33 0.00 0.10 0.00 0.00 66.02 66.62 3kqg s SER 235 CO 0.00 -0.28 1.93 -0.33 0.98 0.00 0.00 173.24 175.54 3kqg h GLU 236 N 2.00 1.24 -0.44 4.02 5.08 -1.98 -0.73 114.58 123.77 3kqg h GLU 236 Ca -0.14 -0.07 -0.05 0.00 -1.00 0.00 0.00 59.36 58.09 3kqg h GLU 236 Cb 1.18 -0.28 -0.02 0.00 0.50 0.00 0.00 28.75 30.13 3kqg h GLU 236 CO 0.24 0.82 0.06 0.66 -1.00 0.00 0.00 179.01 179.79 3kqg h SER 237 N 1.27 0.71 -0.41 1.42 4.64 -1.98 0.68 113.55 119.88 3kqg h SER 237 Ca 0.37 -0.27 -0.03 0.00 -0.47 0.00 0.00 61.79 61.39 3kqg h SER 237 Cb -0.08 -0.19 -0.02 0.00 -0.31 0.00 0.00 62.40 61.80 3kqg h SER 237 CO -0.10 0.80 0.14 -0.08 -0.87 0.00 0.00 176.83 176.72 3kqg h GLU 238 N 0.59 0.63 -0.82 4.77 4.81 -1.92 0.80 114.58 123.44 3kqg h GLU 238 Ca 0.13 -0.13 0.03 0.00 -0.13 0.00 0.00 59.36 59.27 3kqg h GLU 238 Cb 0.40 -0.09 -0.05 0.00 0.63 0.00 0.00 28.75 29.63 3kqg h GLU 238 CO 0.01 0.61 0.52 0.37 -0.73 0.00 0.00 179.01 179.79 3kqg h GLN 239 N 0.52 0.99 -0.08 1.92 5.75 -0.79 0.38 115.11 123.79 3kqg h GLN 239 Ca 0.13 -0.06 -0.01 0.00 -0.15 0.00 0.00 58.65 58.57 3kqg h GLN 239 Cb 0.23 -0.22 -0.00 0.00 1.07 0.00 0.00 27.48 28.56 3kqg h GLN 239 CO -0.01 0.65 0.02 1.49 -2.65 0.00 0.00 178.83 178.34 3kqg h GLU 240 N 1.02 0.12 -0.24 1.69 4.81 0.71 -1.53 114.58 121.16 3kqg h GLU 240 Ca 0.33 -0.03 0.06 0.00 -0.13 0.00 0.00 59.36 59.59 3kqg h GLU 240 Cb 0.01 -0.02 -0.06 0.00 0.63 0.00 0.00 28.75 29.31 3kqg h GLU 240 CO -0.11 0.30 -0.16 0.35 -0.73 0.00 0.00 179.01 178.65 3kqg h PHE 241 N -0.08 -0.41 0.15 0.92 3.57 -0.58 -1.04 116.94 119.47 3kqg h PHE 241 Ca 0.02 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.56 3kqg h PHE 241 Cb 0.23 0.22 -0.01 0.00 2.79 0.00 0.00 35.95 39.18 3kqg h PHE 241 CO 0.00 -0.24 -0.14 -0.07 -2.23 0.00 0.00 178.31 175.64 3kqg h LEU 242 N -0.15 -0.36 -0.64 0.59 3.38 -0.82 0.12 115.31 117.43 3kqg h LEU 242 Ca 0.13 0.03 -0.11 0.00 0.09 0.00 0.00 57.88 58.03 3kqg h LEU 242 Cb 0.35 0.12 -0.02 0.00 0.09 0.00 0.00 40.66 41.21 3kqg h LEU 242 CO -0.33 -0.21 -0.09 0.10 0.09 0.00 0.00 178.44 178.00 3kqg h TYR 243 N -0.31 1.08 -0.32 1.13 -0.00 -1.16 0.19 116.97 117.58 3kqg h TYR 243 Ca 0.00 -0.21 -0.04 0.00 0.00 0.00 0.00 58.73 58.48 3kqg h TYR 243 Cb 0.29 -0.27 -0.01 0.00 0.00 0.00 0.00 36.73 36.73 3kqg h TYR 243 CO -0.12 1.00 0.05 0.87 -0.00 0.00 0.00 178.16 179.97 3kqg h LYS 244 N 0.88 0.53 -0.03 0.10 1.57 -1.07 -2.89 116.57 115.66 3kqg h LYS 244 Ca 0.14 -0.14 -0.10 0.00 -1.87 0.00 0.00 60.65 58.68 3kqg h LYS 244 Cb 0.63 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.87 3kqg h LYS 244 CO 0.04 0.62 -0.45 1.15 -0.57 0.00 0.00 179.45 180.24 3kqg h THR 245 N 0.36 1.33 -0.05 -0.16 2.02 -0.57 -2.35 112.91 113.49 3kqg h THR 245 Ca 0.10 -1.59 0.02 0.00 0.77 0.00 0.00 66.41 65.71 3kqg h THR 245 Cb 0.34 1.81 -0.00 0.00 -1.74 0.00 0.00 68.15 68.57 3kqg h THR 245 CO 0.01 0.46 0.05 0.00 0.37 0.00 0.00 175.52 176.40 3kqg h ALA 246 N 1.48 1.86 -3.38 6.16 0.00 -0.43 -3.46 119.26 121.49 3kqg h ALA 246 Ca 0.00 -0.00 -0.38 0.00 0.00 0.00 0.00 54.91 54.53 3kqg h ALA 246 Cb 0.83 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.61 3kqg h ALA 246 CO 0.06 -0.07 -0.50 0.41 0.00 0.00 0.00 179.25 179.15 3kqg n GLY 247 N -1.46 -0.50 0.96 0.00 0.00 -0.88 -2.11 105.19 101.20 3kqg n GLY 247 Ca -0.02 0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.02 3kqg n GLY 247 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3kqg n GLY 248 N -1.03 0.69 3.95 -0.02 0.00 -1.26 -5.06 105.19 102.45 3kqg n GLY 248 Ca -0.21 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.58 3kqg n GLY 248 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3kqg s LEU 249 N 0.00 4.10 -0.22 0.99 1.43 -0.90 -5.03 118.68 119.06 3kqg s LEU 249 Ca 0.00 0.37 -0.14 0.00 -1.03 0.00 0.00 54.13 53.32 3kqg s LEU 249 Cb 0.00 -3.21 -0.04 0.00 0.03 0.00 0.00 46.19 42.97 3kqg s LEU 249 CO 0.00 -0.23 0.32 -0.63 0.23 0.00 0.00 176.35 176.04 3kqg s ILE 250 N -2.21 5.25 -0.08 -0.59 1.01 -1.26 -4.69 121.20 118.63 3kqg s ILE 250 Ca 0.39 0.53 0.04 0.00 0.00 0.00 0.00 60.65 61.61 3kqg s ILE 250 Cb -0.10 -3.65 0.00 0.00 0.01 0.00 0.00 42.46 38.72 3kqg s ILE 250 CO 0.34 0.28 -0.21 -0.31 0.00 0.00 0.00 174.94 175.04 3kqg s TYR 251 N 1.25 2.16 0.37 3.97 2.02 -0.63 -3.24 117.35 123.24 3kqg s TYR 251 Ca 0.15 -0.79 -0.28 0.00 -0.37 0.00 0.00 57.07 55.78 3kqg s TYR 251 Cb -0.14 -1.46 -0.11 0.00 -0.40 0.00 0.00 41.96 39.85 3kqg s TYR 251 CO 0.07 -0.31 1.48 -1.58 -1.57 0.00 0.00 175.55 173.64 3kqg s TRP 252 N 0.27 2.63 0.02 2.71 0.23 0.10 0.48 118.94 125.38 3kqg s TRP 252 Ca -0.13 1.15 0.00 0.00 -2.03 0.00 0.00 56.10 55.10 3kqg s TRP 252 Cb -0.16 -4.01 -0.00 0.00 0.03 0.00 0.00 33.47 29.34 3kqg s TRP 252 CO 0.06 -2.97 0.00 0.44 0.96 0.00 0.00 176.95 175.44 3kqg n ILE 253 N 0.61 0.00 1.41 2.03 -5.35 -0.97 -1.86 119.36 115.22 3kqg n ILE 253 Ca 0.01 -0.12 0.05 0.00 -0.27 0.00 0.00 62.75 62.42 3kqg n ILE 253 Cb 0.39 0.03 0.29 0.00 -1.74 0.00 0.00 39.64 38.61 3kqg n ILE 253 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3kqg n GLY 254 N 4.38 -0.70 3.68 3.28 0.00 0.82 -4.71 105.19 111.94 3kqg n GLY 254 Ca -0.01 -0.06 -0.42 0.00 0.00 0.00 0.00 46.02 45.53 3kqg n GLY 254 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3kqg s LEU 255 N -1.44 4.33 -0.05 0.99 1.43 -1.26 -1.41 118.68 121.27 3kqg s LEU 255 Ca 0.15 2.22 -0.03 0.00 -1.03 0.00 0.00 54.13 55.44 3kqg s LEU 255 Cb 0.07 -3.56 0.02 0.00 0.03 0.00 0.00 46.19 42.75 3kqg s LEU 255 CO 0.11 -0.80 0.12 0.28 0.23 0.00 0.00 176.35 176.29 3kqg s THR 256 N 2.70 -0.03 -0.23 5.49 -1.32 -0.58 -1.93 115.64 119.75 3kqg s THR 256 Ca 0.68 0.09 -0.05 0.00 -1.21 0.00 0.00 61.69 61.20 3kqg s THR 256 Cb -0.34 -0.18 -0.01 0.00 -1.51 0.00 0.00 72.50 70.46 3kqg s THR 256 CO 0.28 0.04 -0.01 -0.75 -2.21 0.00 0.00 174.62 171.97 3kqg s LYS 257 N 0.60 3.44 -0.35 7.08 2.20 0.87 -1.20 119.74 132.38 3kqg s LYS 257 Ca -0.05 -0.59 -0.17 0.00 -0.36 0.00 0.00 55.97 54.80 3kqg s LYS 257 Cb -0.06 -3.09 -0.01 0.00 -1.51 0.00 0.00 37.83 33.16 3kqg s LYS 257 CO -0.03 -0.20 0.46 0.00 -0.36 0.00 0.00 175.35 175.22 3kqg s ALA 258 N 1.51 3.48 0.00 3.13 0.00 -1.23 -4.81 121.76 123.84 3kqg s ALA 258 Ca 0.06 -1.10 0.00 0.00 0.00 0.00 0.00 51.96 50.92 3kqg s ALA 258 Cb -0.14 -2.95 0.00 0.00 0.00 0.00 0.00 23.12 20.03 3kqg s ALA 258 CO -0.02 -1.17 0.00 0.41 0.00 0.00 0.00 175.76 174.98 3kqg n GLY 259 N 4.86 -1.87 0.26 0.00 0.00 -1.26 -2.72 105.19 104.46 3kqg n GLY 259 Ca -0.06 -1.49 0.13 0.00 0.00 0.00 0.00 46.02 44.59 3kqg n GLY 259 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 3kqg h MET 260 N 0.00 0.00 0.00 1.61 4.05 -1.96 -2.97 114.93 115.66 3kqg h MET 260 Ca 0.00 0.00 -0.28 0.00 -0.28 0.00 0.00 59.70 59.14 3kqg h MET 260 Cb 0.00 0.00 -0.05 0.00 -0.80 0.00 0.00 31.60 30.75 3kqg h MET 260 CO 0.00 0.11 -2.08 0.39 0.23 0.00 0.00 176.91 175.57 3kqg n GLU 261 N -3.66 1.42 -0.91 0.39 -0.58 -1.26 -5.06 120.64 110.96 3kqg n GLU 261 Ca -0.02 -0.01 -0.36 0.00 -0.42 0.00 0.00 57.16 56.35 3kqg n GLU 261 Cb 0.23 -1.40 0.07 0.00 -0.57 0.00 0.00 31.44 29.77 3kqg n GLU 261 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3kqg n GLY 262 N 2.02 -3.38 3.89 0.62 0.00 -1.10 -4.98 105.19 102.26 3kqg n GLY 262 Ca -0.25 -0.59 -0.29 0.00 0.00 0.00 0.00 46.02 44.89 3kqg n GLY 262 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3kqg s ASP 263 N -1.31 5.73 0.18 1.61 1.01 -1.26 -4.64 116.67 117.98 3kqg s ASP 263 Ca 0.44 1.05 -0.25 0.00 0.71 0.00 0.00 52.55 54.50 3kqg s ASP 263 Cb -0.09 -2.01 -0.08 0.00 1.01 0.00 0.00 42.92 41.75 3kqg s ASP 263 CO 0.73 -1.09 0.79 0.26 0.21 0.00 0.00 175.17 176.07 3kqg s TRP 264 N -3.15 3.90 0.14 4.23 0.52 -1.26 -3.55 118.94 119.76 3kqg s TRP 264 Ca 0.55 1.65 0.00 0.00 0.02 0.00 0.00 56.10 58.32 3kqg s TRP 264 Cb -0.11 -2.78 -0.04 0.00 -1.15 0.00 0.00 33.47 29.39 3kqg s TRP 264 CO 0.50 0.50 0.03 -1.54 0.02 0.00 0.00 176.95 176.45 3kqg s SER 265 N -1.19 0.66 -0.02 2.95 1.04 -0.34 -4.84 113.70 111.96 3kqg s SER 265 Ca 0.37 -1.18 -0.15 0.00 0.48 0.00 0.00 55.95 55.47 3kqg s SER 265 Cb -0.23 0.22 -0.05 0.00 0.10 0.00 0.00 66.02 66.06 3kqg s SER 265 CO 0.26 -0.66 0.41 0.26 0.98 0.00 0.00 173.24 174.49 3kqg s TRP 266 N -3.89 3.70 0.24 5.02 0.52 -1.26 -1.52 118.94 121.75 3kqg s TRP 266 Ca 0.22 0.96 -0.00 0.00 0.02 0.00 0.00 56.10 57.30 3kqg s TRP 266 Cb 0.07 -2.31 0.28 0.00 -1.15 0.00 0.00 33.47 30.36 3kqg s TRP 266 CO 0.01 0.59 1.64 -0.24 0.02 0.00 0.00 176.95 178.98 3kqg h VAL 267 N 3.84 1.28 0.00 4.03 3.04 -1.53 -2.16 116.25 124.75 3kqg h VAL 267 Ca -0.50 -1.43 0.00 0.00 -1.01 0.00 0.00 66.70 63.75 3kqg h VAL 267 Cb 1.21 1.44 0.00 0.00 -2.01 0.00 0.00 31.29 31.93 3kqg h VAL 267 CO 0.63 0.46 0.00 -0.90 -1.01 0.00 0.00 177.57 176.75 3kqg n ASP 268 N -4.07 0.00 -0.04 3.17 5.68 -1.26 -4.83 116.55 115.19 3kqg n ASP 268 Ca -0.01 -0.87 -0.01 0.00 -0.50 0.00 0.00 54.79 53.41 3kqg n ASP 268 Cb 0.46 0.00 -0.00 0.00 -1.14 0.00 0.00 41.12 40.44 3kqg n ASP 268 CO 0.00 0.00 0.00 0.47 -1.33 0.00 0.00 177.20 176.34 3kqg n ASP 269 N -0.83 -4.14 -4.72 -1.12 8.00 -0.81 -5.00 116.55 107.93 3kqg n ASP 269 Ca 0.10 0.01 -0.43 0.00 0.71 0.00 0.00 54.79 55.19 3kqg n ASP 269 Cb 0.05 -1.69 -0.01 0.00 -0.02 0.00 0.00 41.12 39.45 3kqg n ASP 269 CO 0.00 0.00 0.00 0.41 -0.39 0.00 0.00 177.20 177.22 3kqg n THR 270 N -2.63 1.51 -1.72 -3.53 -1.04 -1.26 -4.92 114.28 100.69 3kqg n THR 270 Ca -0.01 -0.38 -0.43 0.00 -2.04 0.00 0.00 64.05 61.20 3kqg n THR 270 Cb 0.20 -1.71 -0.01 0.00 -1.82 0.00 0.00 70.33 66.98 3kqg n THR 270 CO 0.00 0.00 0.00 -2.65 -0.64 0.00 0.00 175.07 171.78 3kqg n PRO 271 N 1.28 2.39 -3.18 -2.82 -0.02 -1.26 -4.16 135.00 127.24 3kqg n PRO 271 Ca 0.07 0.85 -0.43 0.00 -2.02 0.00 0.00 63.50 61.97 3kqg n PRO 271 Cb 0.35 -2.55 -0.07 0.00 -0.02 0.00 0.00 33.50 31.22 3kqg n PRO 271 CO 0.00 0.00 0.00 0.12 1.98 0.00 0.00 175.50 177.60 3kqg s PHE 272 N -0.38 3.11 -0.68 6.00 5.36 -1.26 -4.95 117.98 125.18 3kqg s PHE 272 Ca 0.62 -0.07 -0.27 0.00 -0.96 0.00 0.00 56.93 56.25 3kqg s PHE 272 Cb -0.55 -3.17 0.01 0.00 -0.34 0.00 0.00 43.02 38.97 3kqg s PHE 272 CO 0.53 -0.77 1.49 1.21 -1.46 0.00 0.00 175.22 176.23 3kqg s ASN 273 N 1.91 5.84 0.26 6.13 3.84 -1.26 -4.88 114.94 126.78 3kqg s ASN 273 Ca 0.20 -0.12 -0.03 0.00 0.21 0.00 0.00 52.86 53.11 3kqg s ASN 273 Cb -0.15 -2.55 0.39 0.00 -0.55 0.00 0.00 41.25 38.39 3kqg s ASN 273 CO 0.17 -2.02 1.88 0.50 -2.79 0.00 0.00 177.10 174.83 3kqg h LYS 274 N 11.85 1.13 0.15 0.43 3.64 -1.96 -1.62 116.57 130.20 3kqg h LYS 274 Ca -0.27 -0.07 -0.35 0.00 -1.27 0.00 0.00 60.65 58.69 3kqg h LYS 274 Cb 1.09 -0.26 -0.00 0.00 -0.41 0.00 0.00 32.23 32.65 3kqg h LYS 274 CO 1.25 0.75 -1.81 0.28 -2.27 0.00 0.00 179.45 177.65 3kqg h VAL 275 N 1.17 0.85 -0.70 2.00 2.07 -2.02 -3.29 116.25 116.34 3kqg h VAL 275 Ca 0.43 -2.50 -0.02 0.00 0.82 0.00 0.00 66.70 65.43 3kqg h VAL 275 Cb 0.15 2.67 -0.03 0.00 -1.52 0.00 0.00 31.29 32.56 3kqg h VAL 275 CO -0.17 0.85 0.37 -0.61 0.02 0.00 0.00 177.57 178.03 3kqg h GLN 276 N 0.09 0.98 0.00 1.57 4.15 -1.97 -2.95 115.11 116.98 3kqg h GLN 276 Ca -0.36 -0.12 0.00 0.00 0.77 0.00 0.00 58.65 58.94 3kqg h GLN 276 Cb 2.07 -0.19 0.00 0.00 0.21 0.00 0.00 27.48 29.57 3kqg h GLN 276 CO 0.14 0.75 0.00 0.43 -1.93 0.00 0.00 178.83 178.22 3kqg n SER 277 N -4.48 0.00 0.17 -0.69 7.64 -0.61 -2.96 113.62 112.69 3kqg n SER 277 Ca 0.06 -0.66 0.05 0.00 1.01 0.00 0.00 58.87 59.33 3kqg n SER 277 Cb 0.10 -0.05 0.12 0.00 -1.01 0.00 0.00 64.21 63.37 3kqg n SER 277 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3kqg h ALA 278 N 3.51 0.79 -0.04 -0.43 0.00 -1.58 -3.16 119.26 118.34 3kqg h ALA 278 Ca 0.00 -0.34 0.00 0.00 0.00 0.00 0.00 54.91 54.57 3kqg h ALA 278 Cb 0.04 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.77 3kqg h ALA 278 CO 0.00 0.47 0.00 2.89 0.00 0.00 0.00 179.25 182.61 3kqg n ARG 279 N -3.24 1.56 0.00 0.00 1.85 -1.15 -3.73 116.66 111.95 3kqg n ARG 279 Ca 0.02 -0.82 0.10 0.00 -1.00 0.00 0.00 57.85 56.15 3kqg n ARG 279 Cb 0.65 -1.46 -0.09 0.00 -1.05 0.00 0.00 32.46 30.51 3kqg n ARG 279 CO 0.00 0.00 0.00 1.19 -0.01 0.00 0.00 177.63 178.81 3kqg n PHE 280 N 0.01 0.00 -2.86 2.89 3.72 -1.19 -4.06 117.46 115.96 3kqg n PHE 280 Ca 0.19 0.00 -0.34 0.00 -0.05 0.00 0.00 57.45 57.25 3kqg n PHE 280 Cb 0.31 0.00 -0.07 0.00 -0.94 0.00 0.00 39.48 38.78 3kqg n PHE 280 CO 0.00 0.00 0.00 -1.58 -0.05 0.00 0.00 176.76 175.13 3kqg s TRP 281 N -2.82 3.41 0.24 1.38 0.52 -1.24 -0.83 118.94 119.60 3kqg s TRP 281 Ca 0.11 1.60 -0.31 0.00 0.02 0.00 0.00 56.10 57.51 3kqg s TRP 281 Cb 0.16 -2.82 -0.12 0.00 -1.15 0.00 0.00 33.47 29.54 3kqg s TRP 281 CO 0.77 0.00 1.64 -0.89 0.02 0.00 0.00 176.95 178.50 3kqg n ILE 282 N -0.29 0.46 -1.68 2.03 5.41 -0.26 -4.19 119.36 120.83 3kqg n ILE 282 Ca 0.05 -0.12 -0.56 0.00 1.00 0.00 0.00 62.75 63.13 3kqg n ILE 282 Cb 0.53 -1.91 -0.07 0.00 -0.71 0.00 0.00 39.64 37.48 3kqg n ILE 282 CO 0.00 0.00 0.00 -2.65 0.00 0.00 0.00 176.55 173.90 3kqg n PRO 283 N 3.09 1.21 0.00 0.38 -0.02 -1.26 -0.32 135.00 138.07 3kqg n PRO 283 Ca 0.13 0.44 0.00 0.00 -2.02 0.00 0.00 63.50 62.05 3kqg n PRO 283 Cb 0.35 -2.12 0.00 0.00 -0.02 0.00 0.00 33.50 31.70 3kqg n PRO 283 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3kqg n GLY 284 N 3.82 0.30 3.83 -1.23 0.00 -1.26 -5.08 105.19 105.56 3kqg n GLY 284 Ca 0.24 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.99 3kqg n GLY 284 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3kqg s GLU 285 N -0.92 3.02 0.08 1.61 0.41 0.56 -3.71 118.70 119.75 3kqg s GLU 285 Ca 0.00 -0.77 -0.30 0.00 -0.41 0.00 0.00 54.97 53.49 3kqg s GLU 285 Cb 0.00 -2.74 -0.06 0.00 -1.78 0.00 0.00 34.13 29.56 3kqg s GLU 285 CO 0.00 0.51 1.16 -2.14 -0.49 0.00 0.00 175.26 174.30 3kqg s PRO 286 N -2.97 4.47 0.00 0.39 0.02 -1.26 -4.75 135.00 130.91 3kqg s PRO 286 Ca 0.31 1.73 0.24 0.00 0.02 0.00 0.00 61.00 63.30 3kqg s PRO 286 Cb -0.11 -3.34 0.23 0.00 0.02 0.00 0.00 34.50 31.30 3kqg s PRO 286 CO 0.24 -0.18 1.24 0.27 -0.33 0.00 0.00 177.00 178.24 3kqg n ASN 287 N 3.63 1.70 -4.26 2.53 6.94 -1.24 -4.97 115.26 119.57 3kqg n ASN 287 Ca 0.07 -1.31 -0.34 0.00 -0.02 0.00 0.00 54.58 52.99 3kqg n ASN 287 Cb 0.47 0.38 -0.06 0.00 -2.36 0.00 0.00 39.78 38.21 3kqg n ASN 287 CO 0.00 0.00 0.00 -3.20 -1.03 0.00 0.00 177.26 173.03 3kqg n ASN 288 N -0.24 -1.02 -4.69 0.53 2.85 -1.26 -4.77 115.26 106.65 3kqg n ASN 288 Ca 0.10 -1.14 -0.52 0.00 -0.11 0.00 0.00 54.58 52.90 3kqg n ASN 288 Cb 0.43 -2.23 -0.06 0.00 1.24 0.00 0.00 39.78 39.16 3kqg n ASN 288 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 3kqg n ALA 289 N -4.38 0.33 -0.99 5.20 0.00 -1.26 0.45 120.51 119.86 3kqg n ALA 289 Ca -0.12 0.35 0.00 0.00 0.00 0.00 0.00 53.44 53.67 3kqg n ALA 289 Cb 0.59 -2.35 0.00 0.00 0.00 0.00 0.00 19.45 17.69 3kqg n ALA 289 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3kqg n GLY 290 N 4.16 0.45 2.30 0.00 0.00 -1.26 -3.16 105.19 107.67 3kqg n GLY 290 Ca 0.24 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.15 3kqg n GLY 290 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3kqg n ASN 291 N -0.18 -3.34 -2.10 1.61 3.02 0.17 -4.82 115.26 109.63 3kqg n ASN 291 Ca 0.00 0.24 -0.06 0.00 -0.03 0.00 0.00 54.58 54.73 3kqg n ASN 291 Cb 0.09 -2.93 0.06 0.00 -0.61 0.00 0.00 39.78 36.38 3kqg n ASN 291 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 3kqg n ASN 292 N -1.39 2.55 -3.95 6.41 5.15 -1.19 -4.97 115.26 117.87 3kqg n ASN 292 Ca -0.12 -2.79 -0.30 0.00 -0.60 0.00 0.00 54.58 50.77 3kqg n ASN 292 Cb 0.54 -0.41 -0.14 0.00 -0.53 0.00 0.00 39.78 39.23 3kqg n ASN 292 CO 0.00 0.00 0.00 -1.61 1.40 0.00 0.00 177.26 177.05 3kqg s GLU 293 N -3.07 1.69 -0.06 1.20 2.02 -1.26 -3.58 118.70 115.64 3kqg s GLU 293 Ca 0.37 -2.24 0.09 0.00 0.02 0.00 0.00 54.97 53.22 3kqg s GLU 293 Cb 0.37 -3.15 0.22 0.00 0.10 0.00 0.00 34.13 31.67 3kqg s GLU 293 CO -0.04 -1.05 1.16 0.72 0.02 0.00 0.00 175.26 176.07 3kqg n HIS 294 N 3.63 0.25 -4.15 1.61 8.25 -1.18 -4.63 115.22 119.01 3kqg n HIS 294 Ca 0.05 -0.67 -0.17 0.00 -0.26 0.00 0.00 57.72 56.66 3kqg n HIS 294 Cb 0.36 -0.11 -0.12 0.00 1.12 0.00 0.00 29.99 31.25 3kqg n HIS 294 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3kqg s GLY 296 N -1.82 1.63 0.09 0.00 0.00 -0.81 0.45 107.32 106.85 3kqg s GLY 296 Ca -0.02 -1.42 -0.00 0.00 0.00 0.00 0.00 44.72 43.27 3kqg s GLY 296 CO 0.02 -1.40 -0.01 0.54 0.00 0.00 0.00 173.10 172.24 3kqg s ASN 297 N -2.10 0.64 -0.06 1.64 2.20 0.43 -2.30 114.94 115.39 3kqg s ASN 297 Ca 0.16 -1.07 -0.25 0.00 -0.94 0.00 0.00 52.86 50.76 3kqg s ASN 297 Cb -0.10 0.19 -0.03 0.00 -2.00 0.00 0.00 41.25 39.31 3kqg s ASN 297 CO 0.08 -0.60 0.78 -0.63 -2.94 0.00 0.00 177.10 173.79 3kqg s ILE 298 N -3.87 4.99 0.11 0.54 1.01 0.18 -1.15 121.20 123.01 3kqg s ILE 298 Ca 0.13 1.62 0.00 0.00 0.00 0.00 0.00 60.65 62.40 3kqg s ILE 298 Cb 0.07 -4.12 0.00 0.00 0.01 0.00 0.00 42.46 38.42 3kqg s ILE 298 CO -0.05 0.21 0.00 1.17 0.00 0.00 0.00 174.94 176.27 3kqg n LYS 299 N 3.91 0.00 -3.13 2.79 4.81 0.31 -1.61 118.16 125.25 3kqg n LYS 299 Ca 0.01 0.00 -0.34 0.00 -0.87 0.00 0.00 58.31 57.11 3kqg n LYS 299 Cb 0.51 -0.14 -0.06 0.00 0.02 0.00 0.00 35.03 35.36 3kqg n LYS 299 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 3kqg s ALA 300 N -2.00 3.38 -1.58 3.14 0.00 -0.72 -4.79 121.76 119.20 3kqg s ALA 300 Ca 0.00 0.10 -0.11 0.00 0.00 0.00 0.00 51.96 51.95 3kqg s ALA 300 Cb 0.00 -2.78 -0.05 0.00 0.00 0.00 0.00 23.12 20.29 3kqg s ALA 300 CO 0.00 0.34 2.77 -2.30 0.00 0.00 0.00 175.76 176.56 3kqg n PRO 301 N 0.25 3.55 -3.79 0.00 -0.02 -1.26 -4.51 135.00 129.22 3kqg n PRO 301 Ca 0.00 -2.35 -0.04 0.00 -2.02 0.00 0.00 63.50 59.09 3kqg n PRO 301 Cb 0.52 -2.91 -0.01 0.00 -0.02 0.00 0.00 33.50 31.09 3kqg n PRO 301 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 3kqg s SER 302 N 2.32 -0.14 0.47 2.55 0.15 -1.26 -5.01 113.70 112.79 3kqg s SER 302 Ca 0.64 -0.51 0.14 0.00 0.70 0.00 0.00 55.95 56.92 3kqg s SER 302 Cb 0.17 0.53 1.09 0.00 -1.71 0.00 0.00 66.02 66.10 3kqg s SER 302 CO -0.07 -0.99 2.05 -0.07 1.20 0.00 0.00 173.24 175.36 3kqg h LEU 303 N 2.00 0.03 -7.84 3.45 3.38 -1.91 -3.20 115.31 111.22 3kqg h LEU 303 Ca -0.25 -0.00 -0.71 0.00 0.09 0.00 0.00 57.88 57.01 3kqg h LEU 303 Cb 1.23 -0.01 -0.16 0.00 0.09 0.00 0.00 40.66 41.82 3kqg h LEU 303 CO 0.28 0.13 1.35 -1.10 0.09 0.00 0.00 178.44 179.19 3kqg s GLN 304 N -4.86 3.91 -0.01 1.13 1.11 -1.26 -4.15 119.66 115.53 3kqg s GLN 304 Ca -0.05 -2.17 0.02 0.00 0.01 0.00 0.00 55.36 53.17 3kqg s GLN 304 Cb 0.16 -5.12 -0.02 0.00 -1.01 0.00 0.00 33.01 27.02 3kqg s GLN 304 CO 0.69 -1.87 0.02 0.00 0.01 0.00 0.00 175.29 174.14 3kqg n ALA 305 N 6.53 2.01 -1.76 6.09 0.00 -0.01 -3.98 120.51 129.39 3kqg n ALA 305 Ca 0.35 -0.08 -0.39 0.00 0.00 0.00 0.00 53.44 53.32 3kqg n ALA 305 Cb 0.46 0.09 -0.05 0.00 0.00 0.00 0.00 19.45 19.95 3kqg n ALA 305 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 3kqg s TRP 306 N -2.08 3.57 0.02 0.00 0.51 -0.05 -0.53 118.94 120.39 3kqg s TRP 306 Ca -0.01 1.72 0.04 0.00 -2.12 0.00 0.00 56.10 55.74 3kqg s TRP 306 Cb 0.01 -3.19 -0.02 0.00 -0.81 0.00 0.00 33.47 29.46 3kqg s TRP 306 CO 0.07 -0.39 -0.13 1.21 -0.51 0.00 0.00 176.95 177.20 3kqg s ASN 307 N -1.11 1.49 0.03 2.95 2.47 -0.30 -1.11 114.94 119.37 3kqg s ASN 307 Ca 0.47 -0.35 -0.17 0.00 0.42 0.00 0.00 52.86 53.23 3kqg s ASN 307 Cb -0.28 -0.12 -0.06 0.00 -1.45 0.00 0.00 41.25 39.34 3kqg s ASN 307 CO 0.36 0.07 0.49 1.51 -3.72 0.00 0.00 177.10 175.81 3kqg s ASP 308 N -0.78 6.94 0.08 -4.21 -4.77 -1.26 -0.43 116.67 112.23 3kqg s ASP 308 Ca 0.02 1.11 -0.04 0.00 -3.30 0.00 0.00 52.55 50.35 3kqg s ASP 308 Cb -0.06 -2.30 -0.03 0.00 -1.09 0.00 0.00 42.92 39.43 3kqg s ASP 308 CO 0.00 0.30 0.06 0.00 0.70 0.00 0.00 175.17 176.23 3kqg s ALA 309 N -1.07 0.35 0.17 2.11 0.00 0.17 -4.86 121.76 118.62 3kqg s ALA 309 Ca 0.26 -1.08 -0.32 0.00 0.00 0.00 0.00 51.96 50.83 3kqg s ALA 309 Cb -0.18 0.47 -0.11 0.00 0.00 0.00 0.00 23.12 23.30 3kqg s ALA 309 CO 0.16 -0.44 1.71 -2.14 0.00 0.00 0.00 175.76 175.05 3kqg s PRO 310 N -3.93 4.15 0.52 0.00 0.02 -1.23 -2.54 135.00 131.99 3kqg s PRO 310 Ca 0.10 2.54 0.23 0.00 0.02 0.00 0.00 61.00 63.88 3kqg s PRO 310 Cb 0.07 -3.26 1.23 0.00 0.02 0.00 0.00 34.50 32.56 3kqg s PRO 310 CO -0.08 -0.75 1.65 0.00 -0.33 0.00 0.00 177.00 177.50 3kqg n ASP 312 N -2.53 3.14 -4.75 0.00 5.75 -1.26 -2.03 116.55 114.87 3kqg n ASP 312 Ca -0.02 -1.99 -0.34 0.00 -0.01 0.00 0.00 54.79 52.44 3kqg n ASP 312 Cb 0.35 -0.08 0.07 0.00 -1.03 0.00 0.00 41.12 40.43 3kqg n ASP 312 CO 0.00 0.00 0.00 -0.54 -0.11 0.00 0.00 177.20 176.55 3kqg s LYS 313 N -1.84 2.48 -0.23 0.11 -0.14 0.52 -4.77 119.74 115.87 3kqg s LYS 313 Ca 0.31 1.56 -0.06 0.00 -1.36 0.00 0.00 55.97 56.43 3kqg s LYS 313 Cb 0.21 -1.89 -0.02 0.00 -1.68 0.00 0.00 37.83 34.44 3kqg s LYS 313 CO 0.30 -1.53 0.02 0.95 -0.76 0.00 0.00 175.35 174.33 3kqg s THR 314 N -2.17 3.92 0.10 2.17 -4.23 -1.26 -3.75 115.64 110.41 3kqg s THR 314 Ca 0.70 -0.31 0.02 0.00 -1.18 0.00 0.00 61.69 60.92 3kqg s THR 314 Cb -0.24 -2.81 -0.04 0.00 1.34 0.00 0.00 72.50 70.74 3kqg s THR 314 CO 0.43 0.38 -0.06 -0.36 -0.54 0.00 0.00 174.62 174.47 3kqg s PHE 315 N 1.49 0.88 0.95 3.99 0.08 -0.42 -4.72 117.98 120.22 3kqg s PHE 315 Ca 0.06 -0.93 -0.11 0.00 0.12 0.00 0.00 56.93 56.06 3kqg s PHE 315 Cb -0.15 -0.51 0.13 0.00 -0.57 0.00 0.00 43.02 41.92 3kqg s PHE 315 CO 0.01 -0.17 0.91 1.28 -0.10 0.00 0.00 175.22 177.15 3kqg n LEU 316 N -0.04 1.97 -4.11 -0.37 4.77 -1.20 -0.83 117.00 117.18 3kqg n LEU 316 Ca -0.12 0.35 -0.08 0.00 -0.03 0.00 0.00 56.01 56.13 3kqg n LEU 316 Cb 0.61 -1.38 -0.10 0.00 -2.33 0.00 0.00 43.42 40.22 3kqg n LEU 316 CO 0.30 -2.65 -0.37 0.72 -1.33 0.00 0.00 177.39 174.06 3kqg s PHE 317 N -2.55 0.62 -0.21 -1.77 -0.12 -1.26 0.03 117.98 112.71 3kqg s PHE 317 Ca 0.64 -1.03 0.00 0.00 -0.05 0.00 0.00 56.93 56.50 3kqg s PHE 317 Cb -0.22 -0.43 0.03 0.00 -0.63 0.00 0.00 43.02 41.77 3kqg s PHE 317 CO 0.61 -0.31 -0.14 0.42 -0.05 0.00 0.00 175.22 175.74 3kqg s ILE 318 N -3.84 2.35 0.29 -4.49 1.01 -0.78 -1.31 121.20 114.44 3kqg s ILE 318 Ca 0.08 -1.05 -0.06 0.00 0.00 0.00 0.00 60.65 59.63 3kqg s ILE 318 Cb 0.07 -2.11 -0.05 0.00 0.01 0.00 0.00 42.46 40.37 3kqg s ILE 318 CO -0.09 0.35 0.56 0.00 0.00 0.00 0.00 174.94 175.77 3kqg s LYS 320 N -3.51 0.06 -0.00 0.00 2.20 0.68 -1.02 119.74 118.13 3kqg s LYS 320 Ca 0.45 0.40 0.00 0.00 -0.36 0.00 0.00 55.97 56.45 3kqg s LYS 320 Cb -0.11 -0.22 0.01 0.00 -1.51 0.00 0.00 37.83 36.00 3kqg s LYS 320 CO 0.29 -0.20 0.00 -0.98 -0.36 0.00 0.00 175.35 174.10 3kqg s ARG 321 N 1.44 0.03 0.39 4.03 1.70 -0.42 -2.70 118.95 123.42 3kqg s ARG 321 Ca -0.06 0.02 -0.27 0.00 -0.47 0.00 0.00 55.73 54.95 3kqg s ARG 321 Cb -0.12 -0.09 -0.10 0.00 -0.57 0.00 0.00 34.95 34.07 3kqg s ARG 321 CO -0.06 -0.03 1.41 -2.14 -1.08 0.00 0.00 175.30 173.41 3kqg s PRO 322 N 0.22 4.06 -0.23 3.89 0.02 -1.26 -0.31 135.00 141.39 3kqg s PRO 322 Ca -0.02 2.40 -0.28 0.00 0.02 0.00 0.00 61.00 63.12 3kqg s PRO 322 Cb -0.03 -2.90 0.01 0.00 0.02 0.00 0.00 34.50 31.60 3kqg s PRO 322 CO -0.01 -0.51 0.99 -0.47 -0.33 0.00 0.00 177.00 176.68 3kqg s TYR 323 N -1.16 3.34 -0.13 6.54 5.04 1.00 -4.73 117.35 127.24 3kqg s TYR 323 Ca 0.54 1.40 0.01 0.00 -2.44 0.00 0.00 57.07 56.59 3kqg s TYR 323 Cb -0.43 -3.22 0.02 0.00 0.35 0.00 0.00 41.96 38.68 3kqg s TYR 323 CO 0.57 -0.45 -0.16 0.54 -1.34 0.00 0.00 175.55 174.71 3kqg s VAL 324 N 3.07 1.64 0.30 3.14 0.11 -1.26 -4.88 120.40 122.52 3kqg s VAL 324 Ca 0.42 -0.71 -0.29 0.00 -2.93 0.00 0.00 61.98 58.47 3kqg s VAL 324 Cb -0.15 -1.50 -0.13 0.00 -1.53 0.00 0.00 36.38 33.06 3kqg s VAL 324 CO 0.07 0.47 1.17 -2.65 -3.33 0.00 0.00 175.10 170.82 3kqg n PRO 325 N 4.36 1.71 0.00 1.54 -0.02 -1.26 -5.15 135.00 136.17 3kqg n PRO 325 Ca -0.19 0.60 0.16 0.00 -2.02 0.00 0.00 63.50 62.05 3kqg n PRO 325 Cb 0.51 -2.09 0.93 0.00 -0.02 0.00 0.00 33.50 32.83 3kqg n PRO 325 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35