#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3g4g h GLN 192 N 0.00 1.13 0.14 1.20 4.20 -2.00 0.37 115.11 120.15 3g4g h GLN 192 Ca 0.00 -0.07 -0.01 0.00 0.06 0.00 0.00 58.65 58.63 3g4g h GLN 192 Cb 0.00 -0.26 0.00 0.00 0.30 0.00 0.00 27.48 27.53 3g4g h GLN 192 CO 0.00 0.75 -0.07 0.28 -0.67 0.00 0.00 178.83 179.12 3g4g h VAL 193 N 1.17 0.87 -0.78 -0.54 2.07 -1.97 0.23 116.25 117.30 3g4g h VAL 193 Ca 0.40 -0.06 0.08 0.00 0.82 0.00 0.00 66.70 67.95 3g4g h VAL 193 Cb 0.09 0.91 -0.07 0.00 -1.52 0.00 0.00 31.29 30.70 3g4g h VAL 193 CO -0.15 0.01 0.44 -1.28 0.02 0.00 0.00 177.57 176.62 3g4g h SER 194 N -0.22 0.64 0.28 0.57 0.87 -1.88 -1.17 113.55 112.64 3g4g h SER 194 Ca -0.02 0.04 -0.25 0.00 -1.23 0.00 0.00 61.79 60.34 3g4g h SER 194 Cb 0.17 -0.08 0.01 0.00 -0.44 0.00 0.00 62.40 62.06 3g4g h SER 194 CO 0.03 0.38 -1.02 -0.33 -0.53 0.00 0.00 176.83 175.36 3g4g h GLU 195 N 0.76 0.48 0.44 2.24 5.08 -0.09 0.16 114.58 123.65 3g4g h GLU 195 Ca 0.37 -0.54 -0.02 0.00 -1.00 0.00 0.00 59.36 58.16 3g4g h GLU 195 Cb 0.30 0.16 0.00 0.00 0.50 0.00 0.00 28.75 29.72 3g4g h GLU 195 CO -0.23 1.19 -0.21 0.35 -1.00 0.00 0.00 179.01 179.11 3g4g h PHE 196 N 0.25 -0.55 -0.29 4.33 3.04 -0.29 -0.57 116.94 122.86 3g4g h PHE 196 Ca -0.10 -0.01 0.01 0.00 3.98 0.00 0.00 57.97 61.84 3g4g h PHE 196 Cb 1.67 0.18 -0.02 0.00 2.56 0.00 0.00 35.95 40.34 3g4g h PHE 196 CO 0.07 -0.27 0.18 0.82 -2.02 0.00 0.00 178.31 177.09 3g4g h ILE 197 N -0.72 1.05 -0.76 1.41 2.04 -1.26 -0.90 117.51 118.37 3g4g h ILE 197 Ca -0.06 -0.13 0.13 0.00 1.00 0.00 0.00 64.86 65.81 3g4g h ILE 197 Cb 0.52 0.65 -0.09 0.00 -0.74 0.00 0.00 36.82 37.16 3g4g h ILE 197 CO 0.10 0.07 0.32 -1.28 0.00 0.00 0.00 178.15 177.36 3g4g h SER 198 N 0.37 0.34 -0.27 1.72 0.87 -0.52 -2.58 113.55 113.49 3g4g h SER 198 Ca 0.11 0.10 0.00 0.00 -1.23 0.00 0.00 61.79 60.77 3g4g h SER 198 Cb -0.02 0.06 0.00 0.00 -0.44 0.00 0.00 62.40 62.00 3g4g h SER 198 CO -0.04 0.14 0.00 0.59 -0.53 0.00 0.00 176.83 176.99 3g4g n ASN 199 N -4.96 1.90 -0.01 6.23 3.02 -0.24 -3.89 115.26 117.30 3g4g n ASN 199 Ca 0.14 -1.85 -0.03 0.00 -0.03 0.00 0.00 54.58 52.81 3g4g n ASN 199 Cb 0.39 -0.18 -0.01 0.00 -0.61 0.00 0.00 39.78 39.37 3g4g n ASN 199 CO 0.00 0.00 0.00 0.41 -2.62 0.00 0.00 177.26 175.05 3g4g n THR 200 N 0.50 0.16 -0.52 3.41 -1.04 -0.45 -4.81 114.28 111.53 3g4g n THR 200 Ca 0.15 -0.04 0.09 0.00 -2.04 0.00 0.00 64.05 62.20 3g4g n THR 200 Cb 0.34 -1.38 0.30 0.00 -1.82 0.00 0.00 70.33 67.76 3g4g n THR 200 CO 0.00 0.00 0.00 0.49 -0.64 0.00 0.00 175.07 174.92 3g4g n PHE 201 N -3.04 1.12 -4.35 -1.42 3.01 -1.06 -1.72 117.46 110.00 3g4g n PHE 201 Ca -0.05 -0.59 -0.26 0.00 1.01 0.00 0.00 57.45 57.55 3g4g n PHE 201 Cb 0.54 -0.16 -0.13 0.00 -0.01 0.00 0.00 39.48 39.73 3g4g n PHE 201 CO 0.00 0.00 0.00 -0.51 1.01 0.00 0.00 176.76 177.26 3g4g s LEU 202 N -1.60 2.30 -1.15 4.37 1.43 -1.25 -3.67 118.68 119.12 3g4g s LEU 202 Ca 0.44 -0.71 -0.08 0.00 -1.03 0.00 0.00 54.13 52.76 3g4g s LEU 202 Cb 0.27 -1.03 0.25 0.00 0.03 0.00 0.00 46.19 45.71 3g4g s LEU 202 CO 0.23 0.12 1.46 -0.67 0.23 0.00 0.00 176.35 177.72 3g4g n ASP 203 N 1.05 5.76 -0.09 2.29 2.03 -1.02 -4.65 116.55 121.93 3g4g n ASP 203 Ca -0.19 -3.20 -0.08 0.00 0.52 0.00 0.00 54.79 51.84 3g4g n ASP 203 Cb 0.53 -1.38 -0.03 0.00 -0.72 0.00 0.00 41.12 39.52 3g4g n ASP 203 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 3g4g n GLU 255 N 2.78 0.51 0.06 -0.67 1.02 -1.26 -5.13 120.64 117.95 3g4g n GLU 255 Ca 0.30 0.32 -0.08 0.00 -0.02 0.00 0.00 57.16 57.68 3g4g n GLU 255 Cb 0.37 -1.52 0.07 0.00 -0.02 0.00 0.00 31.44 30.33 3g4g n GLU 255 CO 0.00 0.00 0.00 0.22 1.18 0.00 0.00 177.13 178.53 3g4g h ASP 256 N -1.00 0.40 -0.06 1.62 3.58 -1.99 -2.78 116.42 116.19 3g4g h ASP 256 Ca -0.03 -0.25 -0.03 0.00 0.42 0.00 0.00 57.03 57.15 3g4g h ASP 256 Cb 0.87 -0.12 -0.00 0.00 1.72 0.00 0.00 39.33 41.80 3g4g h ASP 256 CO -0.02 0.95 -0.06 0.58 -2.88 0.00 0.00 179.24 177.81 3g4g h VAL 257 N 0.24 1.38 -0.66 2.25 2.07 -1.99 -2.77 116.25 116.77 3g4g h VAL 257 Ca -0.02 -1.23 0.06 0.00 0.82 0.00 0.00 66.70 66.33 3g4g h VAL 257 Cb 1.21 2.06 -0.05 0.00 -1.52 0.00 0.00 31.29 32.99 3g4g h VAL 257 CO 0.11 0.34 0.36 0.25 0.02 0.00 0.00 177.57 178.65 3g4g h LEU 258 N -0.29 0.54 -0.85 2.57 5.85 -1.87 -0.66 115.31 120.59 3g4g h LEU 258 Ca 0.01 0.03 -0.12 0.00 0.84 0.00 0.00 57.88 58.64 3g4g h LEU 258 Cb 0.57 -0.08 -0.01 0.00 0.37 0.00 0.00 40.66 41.52 3g4g h LEU 258 CO 0.02 0.35 -0.43 0.00 -0.34 0.00 0.00 178.44 178.04 3g4g h ALA 259 N 1.34 1.03 -0.15 1.25 0.00 -1.54 -0.08 119.26 121.11 3g4g h ALA 259 Ca 0.29 -0.43 -0.14 0.00 0.00 0.00 0.00 54.91 54.63 3g4g h ALA 259 Cb 0.18 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 3g4g h ALA 259 CO -0.18 0.62 -0.52 0.87 0.00 0.00 0.00 179.25 180.04 3g4g h LYS 260 N 0.26 0.42 -0.36 0.00 1.57 -1.16 -2.94 116.57 114.35 3g4g h LYS 260 Ca 0.02 -0.25 -0.13 0.00 -1.87 0.00 0.00 60.65 58.42 3g4g h LYS 260 Cb 0.86 0.02 -0.01 0.00 0.08 0.00 0.00 32.23 33.19 3g4g h LYS 260 CO 0.07 0.84 -0.29 0.93 -0.57 0.00 0.00 179.45 180.42 3g4g h GLU 261 N 0.33 0.83 0.00 3.15 4.39 -0.71 -3.07 114.58 119.49 3g4g h GLU 261 Ca 0.01 -0.41 0.00 0.00 0.34 0.00 0.00 59.36 59.30 3g4g h GLU 261 Cb 1.02 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.68 3g4g h GLU 261 CO 0.09 1.05 0.00 1.28 -1.16 0.00 0.00 179.01 180.27 3g4g n LEU 262 N -4.18 0.05 0.00 1.33 4.77 -0.08 -1.20 117.00 117.68 3g4g n LEU 262 Ca -0.03 0.52 0.05 0.00 -0.03 0.00 0.00 56.01 56.52 3g4g n LEU 262 Cb 0.48 -0.52 0.24 0.00 -2.33 0.00 0.00 43.42 41.30 3g4g n LEU 262 CO 0.46 -0.41 0.59 -0.62 -1.33 0.00 0.00 177.39 176.08 3g4g n GLU 263 N -1.56 0.14 -0.69 3.23 1.02 -1.12 -2.18 120.64 119.48 3g4g n GLU 263 Ca 0.02 0.19 0.08 0.00 -0.02 0.00 0.00 57.16 57.43 3g4g n GLU 263 Cb 0.08 -1.50 0.35 0.00 -0.02 0.00 0.00 31.44 30.36 3g4g n GLU 263 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 3g4g n ASP 264 N -1.28 4.96 0.27 1.62 9.92 -0.34 -4.66 116.55 127.03 3g4g n ASP 264 Ca 0.05 -2.72 0.13 0.00 -0.53 0.00 0.00 54.79 51.71 3g4g n ASP 264 Cb 0.08 -0.60 0.77 0.00 -0.64 0.00 0.00 41.12 40.72 3g4g n ASP 264 CO 0.00 0.00 0.00 1.62 0.13 0.00 0.00 177.20 178.95 3g4g h VAL 265 N 3.60 0.62 -0.36 2.53 3.04 -1.66 -1.37 116.25 122.66 3g4g h VAL 265 Ca 0.00 -0.35 0.00 0.00 -1.01 0.00 0.00 66.70 65.34 3g4g h VAL 265 Cb 1.64 1.22 0.00 0.00 -2.01 0.00 0.00 31.29 32.14 3g4g h VAL 265 CO 0.33 0.08 0.00 0.59 -1.01 0.00 0.00 177.57 177.56 3g4g n ASN 266 N -3.80 2.55 -4.48 3.17 3.02 -1.26 -4.79 115.26 109.67 3g4g n ASN 266 Ca -0.02 -1.90 -0.33 0.00 -0.03 0.00 0.00 54.58 52.29 3g4g n ASN 266 Cb 0.18 -0.23 -0.13 0.00 -0.61 0.00 0.00 39.78 38.99 3g4g n ASN 266 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 3g4g s LYS 267 N -1.53 3.41 0.12 3.52 1.02 -0.52 -4.91 119.74 120.86 3g4g s LYS 267 Ca 0.34 -0.57 -0.31 0.00 0.02 0.00 0.00 55.97 55.45 3g4g s LYS 267 Cb 0.19 -2.77 -0.11 0.00 -0.52 0.00 0.00 37.83 34.62 3g4g s LYS 267 CO 0.26 0.32 1.84 1.87 -0.92 0.00 0.00 175.35 178.73 3g4g n TRP 268 N 3.26 2.62 -0.22 3.18 -0.00 -1.26 -2.81 117.44 122.21 3g4g n TRP 268 Ca -0.18 -0.15 0.00 0.00 -0.00 0.00 0.00 57.50 57.17 3g4g n TRP 268 Cb 0.53 -2.73 0.00 0.00 -0.00 0.00 0.00 31.31 29.10 3g4g n TRP 268 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 177.69 178.10 3g4g n GLY 269 N 4.24 0.92 3.56 5.87 0.00 -1.26 -4.96 105.19 113.56 3g4g n GLY 269 Ca 0.18 -0.22 -0.49 0.00 0.00 0.00 0.00 46.02 45.49 3g4g n GLY 269 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 3g4g n LEU 270 N 0.00 1.29 -4.37 0.99 7.94 -1.12 -4.84 117.00 116.88 3g4g n LEU 270 Ca 0.00 1.15 -0.41 0.00 -1.11 0.00 0.00 56.01 55.64 3g4g n LEU 270 Cb 0.01 -1.19 -0.01 0.00 0.53 0.00 0.00 43.42 42.76 3g4g n LEU 270 CO 0.00 -1.45 2.06 1.41 -1.11 0.00 0.00 177.39 178.29 3g4g n HIS 271 N 1.28 4.05 0.18 1.96 8.25 -1.26 -4.75 115.22 124.93 3g4g n HIS 271 Ca 0.15 -2.62 0.03 0.00 -0.26 0.00 0.00 57.72 55.02 3g4g n HIS 271 Cb 0.24 -2.58 0.32 0.00 1.12 0.00 0.00 29.99 29.09 3g4g n HIS 271 CO 0.00 0.00 0.00 -0.24 0.64 0.00 0.00 176.34 176.74 3g4g h VAL 272 N 5.30 1.12 -0.14 1.59 3.04 -1.99 -2.23 116.25 122.94 3g4g h VAL 272 Ca 0.44 -1.58 -0.16 0.00 -1.01 0.00 0.00 66.70 64.39 3g4g h VAL 272 Cb 0.83 1.90 -0.01 0.00 -2.01 0.00 0.00 31.29 32.00 3g4g h VAL 272 CO 1.53 0.42 -0.58 -0.26 -1.01 0.00 0.00 177.57 177.67 3g4g h PHE 273 N 0.00 0.57 -0.19 3.17 0.04 -1.96 -2.40 116.94 116.16 3g4g h PHE 273 Ca -0.00 -0.21 -0.01 0.00 2.80 0.00 0.00 57.97 60.54 3g4g h PHE 273 Cb 0.87 -0.10 -0.01 0.00 2.20 0.00 0.00 35.95 38.90 3g4g h PHE 273 CO 0.00 0.92 0.07 0.00 -0.60 0.00 0.00 178.31 178.70 3g4g h ARG 274 N 0.34 0.29 -0.10 1.51 3.08 -1.85 -2.55 114.38 115.10 3g4g h ARG 274 Ca -0.00 -0.06 0.03 0.00 0.07 0.00 0.00 59.98 60.02 3g4g h ARG 274 Cb 1.12 -0.04 -0.00 0.00 0.08 0.00 0.00 29.97 31.12 3g4g h ARG 274 CO 0.10 0.37 0.08 0.82 -1.07 0.00 0.00 179.97 180.28 3g4g h ILE 275 N 0.14 0.86 -0.17 2.04 2.04 -1.38 0.12 117.51 121.17 3g4g h ILE 275 Ca 0.06 0.00 -0.16 0.00 1.00 0.00 0.00 64.86 65.76 3g4g h ILE 275 Cb 0.20 0.94 0.00 0.00 -0.74 0.00 0.00 36.82 37.23 3g4g h ILE 275 CO -0.00 0.00 -0.53 0.00 0.00 0.00 0.00 178.15 177.61 3g4g h ALA 276 N 1.94 0.30 0.25 1.87 0.00 -1.26 -2.63 119.26 119.73 3g4g h ALA 276 Ca 0.05 -0.51 -0.01 0.00 0.00 0.00 0.00 54.91 54.44 3g4g h ALA 276 Cb 0.20 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.96 3g4g h ALA 276 CO -0.00 0.50 -0.12 0.93 0.00 0.00 0.00 179.25 180.56 3g4g h GLU 277 N 0.35 -0.33 0.00 0.00 5.08 -0.99 0.17 114.58 118.87 3g4g h GLU 277 Ca -0.02 0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3g4g h GLU 277 Cb 1.16 0.07 0.00 0.00 0.50 0.00 0.00 28.75 30.48 3g4g h GLU 277 CO 0.11 -0.03 0.00 1.28 -1.00 0.00 0.00 179.01 179.37 3g4g n LEU 278 N -5.12 0.00 0.00 1.33 4.77 0.38 -2.59 117.00 115.77 3g4g n LEU 278 Ca -0.09 0.35 0.00 0.00 -0.03 0.00 0.00 56.01 56.24 3g4g n LEU 278 Cb 0.24 -0.35 0.00 0.00 -2.33 0.00 0.00 43.42 40.97 3g4g n LEU 278 CO 0.32 -0.24 0.46 -1.54 -1.33 0.00 0.00 177.39 175.06 3g4g n SER 279 N -1.35 1.82 -2.64 -1.43 3.41 -0.99 -4.64 113.62 107.80 3g4g n SER 279 Ca 0.04 -1.86 -0.17 0.00 -0.26 0.00 0.00 58.87 56.62 3g4g n SER 279 Cb 0.09 0.00 0.05 0.00 -0.26 0.00 0.00 64.21 64.09 3g4g n SER 279 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3g4g n GLY 280 N -0.43 -0.13 3.14 5.00 0.00 -1.07 -3.19 105.19 108.51 3g4g n GLY 280 Ca 0.00 -0.03 -0.17 0.00 0.00 0.00 0.00 46.02 45.83 3g4g n GLY 280 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 3g4g n ASN 281 N -1.67 -3.45 -2.56 1.61 5.15 0.61 -4.97 115.26 109.98 3g4g n ASN 281 Ca -0.01 -0.50 -0.22 0.00 -0.60 0.00 0.00 54.58 53.25 3g4g n ASN 281 Cb 0.55 -4.39 0.01 0.00 -0.53 0.00 0.00 39.78 35.42 3g4g n ASN 281 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 3g4g n ARG 282 N -3.91 2.74 0.05 1.20 5.12 -1.19 -4.89 116.66 115.77 3g4g n ARG 282 Ca -0.15 -4.15 -0.07 0.00 -1.93 0.00 0.00 57.85 51.55 3g4g n ARG 282 Cb 0.61 -1.96 0.10 0.00 -1.16 0.00 0.00 32.46 30.06 3g4g n ARG 282 CO 0.00 0.00 0.00 -1.00 -1.93 0.00 0.00 177.63 174.70 3g4g h PRO 283 N 2.72 0.37 0.14 5.56 0.13 -1.86 -2.33 132.00 136.73 3g4g h PRO 283 Ca 0.18 -0.24 -0.01 0.00 -0.87 0.00 0.00 66.00 65.06 3g4g h PRO 283 Cb 0.97 0.03 0.00 0.00 0.13 0.00 0.00 31.00 32.13 3g4g h PRO 283 CO 0.74 0.83 -0.07 1.25 -0.23 0.00 0.00 178.00 180.53 3g4g h LEU 284 N 0.28 -0.16 -0.46 1.56 5.85 -1.91 -0.42 115.31 120.05 3g4g h LEU 284 Ca 0.00 -0.02 0.02 0.00 0.84 0.00 0.00 57.88 58.73 3g4g h LEU 284 Cb 1.07 0.04 -0.03 0.00 0.37 0.00 0.00 40.66 42.11 3g4g h LEU 284 CO 0.09 -0.09 0.27 0.74 -0.34 0.00 0.00 178.44 179.12 3g4g h THR 285 N -0.22 1.05 0.09 1.05 2.02 -1.83 0.20 112.91 115.28 3g4g h THR 285 Ca -0.02 -0.19 -0.28 0.00 0.77 0.00 0.00 66.41 66.69 3g4g h THR 285 Cb 0.17 0.45 0.02 0.00 -1.74 0.00 0.00 68.15 67.05 3g4g h THR 285 CO 0.03 0.10 -1.18 -0.37 0.37 0.00 0.00 175.52 174.47 3g4g h VAL 286 N 0.55 1.33 -0.14 3.16 -1.51 -1.37 -0.86 116.25 117.41 3g4g h VAL 286 Ca 0.18 -2.51 -0.02 0.00 -1.23 0.00 0.00 66.70 63.12 3g4g h VAL 286 Cb 0.00 2.65 -0.01 0.00 -2.13 0.00 0.00 31.29 31.81 3g4g h VAL 286 CO -0.08 0.76 0.01 0.40 -1.23 0.00 0.00 177.57 177.43 3g4g h ILE 287 N 0.26 1.24 0.01 7.19 2.04 -1.03 -1.69 117.51 125.53 3g4g h ILE 287 Ca -0.16 -0.77 0.02 0.00 1.00 0.00 0.00 64.86 64.94 3g4g h ILE 287 Cb 1.85 1.49 -0.02 0.00 -0.74 0.00 0.00 36.82 39.40 3g4g h ILE 287 CO 0.22 0.23 -0.12 0.24 0.00 0.00 0.00 178.15 178.72 3g4g h MET 288 N -0.01 -0.20 -0.82 2.37 2.86 -0.62 -1.85 114.93 116.66 3g4g h MET 288 Ca 0.04 0.01 0.08 0.00 -2.06 0.00 0.00 59.70 57.77 3g4g h MET 288 Cb 0.34 0.05 -0.07 0.00 0.06 0.00 0.00 31.60 31.98 3g4g h MET 288 CO 0.01 -0.13 0.49 1.25 1.06 0.00 0.00 176.91 179.58 3g4g h HIS 289 N -0.21 0.89 -0.55 -0.22 -0.00 -1.14 -1.77 115.15 112.16 3g4g h HIS 289 Ca 0.04 0.03 0.01 0.00 -0.00 0.00 0.00 60.37 60.44 3g4g h HIS 289 Cb 0.25 -0.28 -0.03 0.00 -0.00 0.00 0.00 27.41 27.35 3g4g h HIS 289 CO -0.17 0.41 0.37 1.15 -0.00 0.00 0.00 177.93 179.69 3g4g h THR 290 N 0.86 1.14 -0.39 6.26 2.02 -0.97 -2.21 112.91 119.62 3g4g h THR 290 Ca 0.38 -0.26 -0.04 0.00 0.77 0.00 0.00 66.41 67.25 3g4g h THR 290 Cb 0.26 0.33 -0.02 0.00 -1.74 0.00 0.00 68.15 66.98 3g4g h THR 290 CO -0.21 0.14 0.07 0.40 0.37 0.00 0.00 175.52 176.29 3g4g h ILE 291 N 0.75 1.24 -0.66 3.11 2.04 -0.70 0.71 117.51 124.00 3g4g h ILE 291 Ca 0.20 -0.84 -0.07 0.00 1.00 0.00 0.00 64.86 65.16 3g4g h ILE 291 Cb -0.09 1.03 -0.03 0.00 -0.74 0.00 0.00 36.82 36.99 3g4g h ILE 291 CO -0.04 0.29 0.13 -0.26 0.00 0.00 0.00 178.15 178.26 3g4g h PHE 292 N 0.50 1.11 -0.09 1.37 -1.00 -1.27 0.23 116.94 117.79 3g4g h PHE 292 Ca 0.12 -0.14 -0.01 0.00 2.81 0.00 0.00 57.97 60.76 3g4g h PHE 292 Cb 0.35 -0.31 -0.00 0.00 3.61 0.00 0.00 35.95 39.59 3g4g h PHE 292 CO 0.02 0.92 0.03 1.96 -1.61 0.00 0.00 178.31 179.63 3g4g h GLN 293 N 1.00 0.13 -0.24 1.51 1.08 -1.20 0.27 115.11 117.66 3g4g h GLN 293 Ca 0.20 -0.03 -0.07 0.00 -1.45 0.00 0.00 58.65 57.31 3g4g h GLN 293 Cb 0.39 -0.02 -0.01 0.00 -0.05 0.00 0.00 27.48 27.79 3g4g h GLN 293 CO 0.01 0.29 -0.15 1.49 -0.95 0.00 0.00 178.83 179.51 3g4g h GLU 294 N -0.05 0.41 -0.36 1.46 4.57 -0.29 -2.46 114.58 117.85 3g4g h GLU 294 Ca 0.03 -0.12 0.00 0.00 -1.18 0.00 0.00 59.36 58.09 3g4g h GLU 294 Cb 0.21 -0.04 0.00 0.00 -0.16 0.00 0.00 28.75 28.76 3g4g h GLU 294 CO -0.00 0.56 0.00 0.54 -1.18 0.00 0.00 179.01 178.93 3g4g n ARG 295 N -4.20 2.34 -2.23 1.92 1.74 0.77 -4.95 116.66 112.04 3g4g n ARG 295 Ca 0.00 -2.02 -0.21 0.00 -0.77 0.00 0.00 57.85 54.85 3g4g n ARG 295 Cb 0.32 -1.48 -0.03 0.00 -1.02 0.00 0.00 32.46 30.25 3g4g n ARG 295 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 3g4g n ASP 296 N 1.23 -5.79 0.20 0.55 2.03 -0.27 -4.87 116.55 109.62 3g4g n ASP 296 Ca 0.19 0.10 0.05 0.00 0.52 0.00 0.00 54.79 55.65 3g4g n ASP 296 Cb 0.54 -4.88 0.41 0.00 -0.72 0.00 0.00 41.12 36.46 3g4g n ASP 296 CO 0.00 0.00 0.00 -0.07 -1.92 0.00 0.00 177.20 175.21 3g4g h LEU 297 N 0.00 0.00 -0.37 -2.67 3.38 -1.29 -2.04 115.31 112.31 3g4g h LEU 297 Ca -0.48 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.40 3g4g h LEU 297 Cb 1.36 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.10 3g4g h LEU 297 CO 0.59 0.34 -0.12 -0.07 0.09 0.00 0.00 178.44 179.27 3g4g h LEU 298 N 0.00 0.75 -0.19 1.67 4.07 -1.85 -2.18 115.31 117.58 3g4g h LEU 298 Ca -0.00 -0.38 -0.19 0.00 0.08 0.00 0.00 57.88 57.39 3g4g h LEU 298 Cb 0.70 -0.21 0.01 0.00 1.08 0.00 0.00 40.66 42.24 3g4g h LEU 298 CO 0.04 0.96 -0.63 0.50 -1.08 0.00 0.00 178.44 178.24 3g4g h LYS 299 N 0.53 0.75 -0.43 1.13 3.64 -1.81 0.23 116.57 120.62 3g4g h LYS 299 Ca 0.09 -0.56 -0.12 0.00 -1.27 0.00 0.00 60.65 58.79 3g4g h LYS 299 Cb 0.65 0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 32.56 3g4g h LYS 299 CO 0.04 1.18 -0.20 1.15 -2.27 0.00 0.00 179.45 179.36 3g4g h THR 300 N 0.48 1.27 -0.27 1.00 2.02 -1.38 -3.20 112.91 112.82 3g4g h THR 300 Ca -0.03 -1.32 0.00 0.00 0.77 0.00 0.00 66.41 65.83 3g4g h THR 300 Cb 1.25 1.14 0.00 0.00 -1.74 0.00 0.00 68.15 68.80 3g4g h THR 300 CO 0.13 0.45 0.00 0.49 0.37 0.00 0.00 175.52 176.96 3g4g n PHE 301 N -4.12 0.50 -4.00 3.16 3.72 -0.82 -4.98 117.46 110.92 3g4g n PHE 301 Ca 0.00 -0.60 -0.26 0.00 -0.05 0.00 0.00 57.45 56.54 3g4g n PHE 301 Cb 0.43 -0.10 -0.03 0.00 -0.94 0.00 0.00 39.48 38.84 3g4g n PHE 301 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34 3g4g n LYS 302 N 0.10 -2.92 -2.99 -1.08 5.02 -0.24 -4.49 118.16 111.55 3g4g n LYS 302 Ca 0.13 0.36 -0.42 0.00 -2.02 0.00 0.00 58.31 56.36 3g4g n LYS 302 Cb 0.52 -4.38 -0.05 0.00 -0.02 0.00 0.00 35.03 31.09 3g4g n LYS 302 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 3g4g s ILE 303 N -4.01 4.80 0.18 -0.18 1.01 0.65 -4.72 121.20 118.92 3g4g s ILE 303 Ca 0.01 0.94 -0.32 0.00 0.00 0.00 0.00 60.65 61.29 3g4g s ILE 303 Cb -0.01 -4.15 -0.11 0.00 0.01 0.00 0.00 42.46 38.21 3g4g s ILE 303 CO 0.90 -0.32 1.61 -2.84 0.00 0.00 0.00 174.94 174.29 3g4g s PRO 304 N 2.95 4.19 0.43 2.79 0.02 -1.26 -4.73 135.00 139.39 3g4g s PRO 304 Ca 0.30 2.43 0.14 0.00 0.02 0.00 0.00 61.00 63.89 3g4g s PRO 304 Cb -0.14 -3.13 1.02 0.00 0.02 0.00 0.00 34.50 32.27 3g4g s PRO 304 CO 0.15 -0.65 1.96 -0.24 -0.33 0.00 0.00 177.00 177.89 3g4g h VAL 305 N 3.95 0.87 -0.53 3.83 3.04 -1.95 -0.22 116.25 125.24 3g4g h VAL 305 Ca -0.43 -0.15 -0.11 0.00 -1.01 0.00 0.00 66.70 65.01 3g4g h VAL 305 Cb 1.20 0.41 -0.02 0.00 -2.01 0.00 0.00 31.29 30.87 3g4g h VAL 305 CO 0.93 0.08 -0.09 -2.24 -1.01 0.00 0.00 177.57 175.24 3g4g h ASP 306 N 0.43 0.99 -0.18 3.17 -0.00 -1.97 -0.32 116.42 118.54 3g4g h ASP 306 Ca 0.31 -0.34 -0.00 0.00 -0.00 0.00 0.00 57.03 56.99 3g4g h ASP 306 Cb 0.62 -0.27 -0.01 0.00 -0.00 0.00 0.00 39.33 39.67 3g4g h ASP 306 CO -0.09 1.10 0.11 0.74 -0.00 0.00 0.00 179.24 181.10 3g4g h THR 307 N 0.87 1.08 -0.28 1.15 2.02 -1.31 -1.16 112.91 115.28 3g4g h THR 307 Ca 0.14 -0.21 0.03 0.00 0.77 0.00 0.00 66.41 67.14 3g4g h THR 307 Cb 0.65 0.90 -0.03 0.00 -1.74 0.00 0.00 68.15 67.92 3g4g h THR 307 CO 0.04 0.08 0.11 0.25 0.37 0.00 0.00 175.52 176.37 3g4g h LEU 308 N 0.21 0.13 -0.75 2.58 5.85 -0.95 -1.27 115.31 121.11 3g4g h LEU 308 Ca 0.06 0.02 -0.04 0.00 0.84 0.00 0.00 57.88 58.77 3g4g h LEU 308 Cb 0.03 0.01 -0.03 0.00 0.37 0.00 0.00 40.66 41.04 3g4g h LEU 308 CO -0.01 0.11 0.33 0.40 -0.34 0.00 0.00 178.44 178.92 3g4g h ILE 309 N 0.24 1.25 -0.56 4.05 1.08 -0.99 -1.23 117.51 121.34 3g4g h ILE 309 Ca 0.12 -0.74 -0.09 0.00 -0.39 0.00 0.00 64.86 63.76 3g4g h ILE 309 Cb 0.08 0.35 -0.02 0.00 -3.07 0.00 0.00 36.82 34.15 3g4g h ILE 309 CO -0.11 0.31 0.00 0.74 -0.69 0.00 0.00 178.15 178.40 3g4g h THR 310 N 1.06 1.26 -0.10 -0.27 2.02 -0.91 -0.63 112.91 115.34 3g4g h THR 310 Ca 0.25 -1.12 -0.02 0.00 0.77 0.00 0.00 66.41 66.30 3g4g h THR 310 Cb 0.17 0.87 -0.00 0.00 -1.74 0.00 0.00 68.15 67.44 3g4g h THR 310 CO -0.03 0.40 0.00 0.22 0.37 0.00 0.00 175.52 176.49 3g4g h TYR 311 N 0.88 0.20 -0.61 3.16 3.20 -1.05 -2.50 116.97 120.24 3g4g h TYR 311 Ca 0.16 -0.03 0.01 0.00 3.14 0.00 0.00 58.73 62.01 3g4g h TYR 311 Cb 0.54 -0.05 -0.03 0.00 1.54 0.00 0.00 36.73 38.73 3g4g h TYR 311 CO 0.04 0.42 0.40 -0.07 -1.64 0.00 0.00 178.16 177.31 3g4g h LEU 312 N -0.08 0.68 -1.16 2.82 3.38 -1.14 0.74 115.31 120.55 3g4g h LEU 312 Ca 0.03 -0.01 -0.03 0.00 0.09 0.00 0.00 57.88 57.96 3g4g h LEU 312 Cb 0.34 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 40.90 3g4g h LEU 312 CO 0.00 0.49 0.23 0.24 0.09 0.00 0.00 178.44 179.49 3g4g h MET 313 N 0.81 0.82 -0.20 1.13 2.86 -1.14 -0.40 114.93 118.81 3g4g h MET 313 Ca 0.23 -0.12 -0.19 0.00 -2.06 0.00 0.00 59.70 57.56 3g4g h MET 313 Cb -0.07 -0.15 0.01 0.00 0.06 0.00 0.00 31.60 31.45 3g4g h MET 313 CO -0.06 0.67 -0.61 1.15 1.06 0.00 0.00 176.91 179.12 3g4g h THR 314 N 0.81 1.29 0.17 2.22 2.02 -0.94 -2.20 112.91 116.28 3g4g h THR 314 Ca 0.20 -1.82 -0.01 0.00 0.77 0.00 0.00 66.41 65.55 3g4g h THR 314 Cb 0.15 1.86 0.00 0.00 -1.74 0.00 0.00 68.15 68.43 3g4g h THR 314 CO -0.02 0.58 -0.08 0.25 0.37 0.00 0.00 175.52 176.62 3g4g h LEU 315 N 0.51 -0.19 -1.36 2.58 5.85 -0.73 -2.82 115.31 119.13 3g4g h LEU 315 Ca -0.02 -0.05 0.12 0.00 0.84 0.00 0.00 57.88 58.77 3g4g h LEU 315 Cb 1.23 0.05 -0.06 0.00 0.37 0.00 0.00 40.66 42.26 3g4g h LEU 315 CO 0.13 -0.07 0.53 -0.08 -0.34 0.00 0.00 178.44 178.61 3g4g h GLU 316 N -0.30 0.65 0.00 1.25 4.81 -1.11 -0.40 114.58 119.49 3g4g h GLU 316 Ca -0.02 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.17 3g4g h GLU 316 Cb 0.23 -0.15 0.00 0.00 0.63 0.00 0.00 28.75 29.47 3g4g h GLU 316 CO 0.04 0.43 0.00 -0.44 -0.73 0.00 0.00 179.01 178.31 3g4g h ASP 317 N 0.67 0.00 -0.70 1.04 3.45 -1.15 -2.50 116.42 117.23 3g4g h ASP 317 Ca 0.39 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.85 3g4g h ASP 317 Cb 0.57 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.34 3g4g h ASP 317 CO -0.15 0.00 0.00 1.41 -1.57 0.00 0.00 179.24 178.93 3g4g n HIS 318 N -2.53 0.98 -3.73 4.55 8.25 -0.16 -4.79 115.22 117.79 3g4g n HIS 318 Ca 0.01 -0.48 -0.36 0.00 -0.26 0.00 0.00 57.72 56.63 3g4g n HIS 318 Cb 0.21 -0.02 -0.07 0.00 1.12 0.00 0.00 29.99 31.23 3g4g n HIS 318 CO 0.00 0.00 0.00 0.71 0.64 0.00 0.00 176.34 177.69 3g4g s TYR 319 N -1.11 3.48 -0.12 4.41 1.51 -0.94 -0.87 117.35 123.71 3g4g s TYR 319 Ca 0.47 0.44 -0.29 0.00 -1.01 0.00 0.00 57.07 56.68 3g4g s TYR 319 Cb 0.25 -2.13 -0.03 0.00 -0.11 0.00 0.00 41.96 39.94 3g4g s TYR 319 CO 0.32 0.41 1.37 -1.01 -1.11 0.00 0.00 175.55 175.53 3g4g s HIS 320 N -0.03 2.64 0.00 2.71 3.76 -1.26 -4.76 115.29 118.35 3g4g s HIS 320 Ca 0.12 0.79 0.00 0.00 -0.15 0.00 0.00 55.06 55.82 3g4g s HIS 320 Cb -0.12 -3.62 0.00 0.00 1.11 0.00 0.00 32.58 29.95 3g4g s HIS 320 CO 0.01 -2.30 0.80 0.00 -0.85 0.00 0.00 174.74 172.40 3g4g n ALA 321 N 6.55 0.00 -0.37 -1.40 0.00 -1.26 -2.89 120.51 121.15 3g4g n ALA 321 Ca 0.15 0.00 0.29 0.00 0.00 0.00 0.00 53.44 53.87 3g4g n ALA 321 Cb 0.44 0.40 0.58 0.00 0.00 0.00 0.00 19.45 20.87 3g4g n ALA 321 CO 0.00 0.00 0.00 0.38 0.00 0.00 0.00 177.50 177.88 3g4g h ASP 322 N 0.00 0.34 -3.40 0.00 2.03 -2.01 -3.44 116.42 109.94 3g4g h ASP 322 Ca 0.00 0.10 -0.52 0.00 -0.73 0.00 0.00 57.03 55.87 3g4g h ASP 322 Cb 0.00 0.05 0.04 0.00 -0.83 0.00 0.00 39.33 38.59 3g4g h ASP 322 CO 0.00 -0.02 0.66 -0.69 -1.03 0.00 0.00 179.24 178.17 3g4g s VAL 323 N -5.38 3.13 0.09 4.15 1.01 -1.14 -4.93 120.40 117.32 3g4g s VAL 323 Ca -0.08 0.93 -0.05 0.00 0.00 0.00 0.00 61.98 62.78 3g4g s VAL 323 Cb 0.27 -3.60 -0.25 0.00 0.00 0.00 0.00 36.38 32.80 3g4g s VAL 323 CO 0.81 0.14 1.19 0.00 0.00 0.00 0.00 175.10 177.24 3g4g h ALA 324 N 5.27 0.17 0.00 5.51 0.00 -1.86 -3.41 119.26 124.94 3g4g h ALA 324 Ca -0.45 -0.83 -0.08 0.00 0.00 0.00 0.00 54.91 53.55 3g4g h ALA 324 Cb 1.22 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.00 3g4g h ALA 324 CO 0.77 0.91 -1.00 0.98 0.00 0.00 0.00 179.25 180.91 3g4g n TYR 325 N -3.61 0.00 -1.85 0.00 9.36 -1.26 -4.74 117.16 115.07 3g4g n TYR 325 Ca -0.08 0.00 -0.41 0.00 3.32 0.00 0.00 57.90 60.73 3g4g n TYR 325 Cb 0.97 -0.24 -0.01 0.00 -0.63 0.00 0.00 39.34 39.43 3g4g n TYR 325 CO 0.00 0.00 0.00 0.72 0.22 0.00 0.00 176.86 177.80 3g4g n HIS 326 N -3.54 2.89 -3.96 2.98 8.25 -1.26 -4.28 115.22 116.29 3g4g n HIS 326 Ca -0.11 -2.92 0.00 0.00 -0.26 0.00 0.00 57.72 54.43 3g4g n HIS 326 Cb 0.43 -2.21 0.00 0.00 1.12 0.00 0.00 29.99 29.33 3g4g n HIS 326 CO 0.00 0.00 0.00 0.27 0.64 0.00 0.00 176.34 177.25 3g4g n ASN 327 N 3.89 1.39 0.26 0.41 0.23 -1.26 -4.51 115.26 115.68 3g4g n ASN 327 Ca 0.58 -0.96 0.10 0.00 -0.53 0.00 0.00 54.58 53.76 3g4g n ASN 327 Cb 0.31 0.00 0.68 0.00 -2.08 0.00 0.00 39.78 38.69 3g4g n ASN 327 CO 0.00 0.00 0.00 -0.55 -0.93 0.00 0.00 177.26 175.78 3g4g h ASN 328 N 0.00 0.00 -0.35 0.53 -1.07 -1.85 -1.95 115.58 110.89 3g4g h ASN 328 Ca 0.00 0.00 -0.17 0.00 0.07 0.00 0.00 56.30 56.20 3g4g h ASN 328 Cb 0.00 0.00 -0.00 0.00 -2.07 0.00 0.00 38.32 36.25 3g4g h ASN 328 CO 0.00 0.07 -0.44 0.40 0.07 0.00 0.00 177.43 177.53 3g4g h ILE 329 N 0.00 1.27 -0.10 6.14 2.04 -1.96 -0.79 117.51 124.10 3g4g h ILE 329 Ca -0.00 -1.62 -0.01 0.00 1.00 0.00 0.00 64.86 64.23 3g4g h ILE 329 Cb 0.14 1.46 -0.00 0.00 -0.74 0.00 0.00 36.82 37.68 3g4g h ILE 329 CO 0.01 0.54 0.03 -0.74 0.00 0.00 0.00 178.15 177.98 3g4g h HIS 330 N 0.73 0.17 -0.76 1.37 2.76 -1.62 -0.56 115.15 117.24 3g4g h HIS 330 Ca 0.05 -0.02 0.16 0.00 -2.20 0.00 0.00 60.37 58.36 3g4g h HIS 330 Cb 1.04 -0.05 -0.11 0.00 1.55 0.00 0.00 27.41 29.84 3g4g h HIS 330 CO 0.07 0.33 0.23 0.00 -1.30 0.00 0.00 177.93 177.25 3g4g h ALA 331 N 0.83 1.04 -0.40 5.26 0.00 -1.29 -0.17 119.26 124.51 3g4g h ALA 331 Ca 0.03 0.16 -0.13 0.00 0.00 0.00 0.00 54.91 54.97 3g4g h ALA 331 Cb 0.24 0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 3g4g h ALA 331 CO -0.00 -0.31 -0.25 0.00 0.00 0.00 0.00 179.25 178.68 3g4g h ALA 332 N 1.61 0.80 -0.40 0.00 0.00 -1.00 -1.45 119.26 118.81 3g4g h ALA 332 Ca 0.43 -0.39 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 3g4g h ALA 332 Cb 0.74 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.36 3g4g h ALA 332 CO -0.49 0.65 0.22 0.22 0.00 0.00 0.00 179.25 179.85 3g4g h ASP 333 N 0.71 0.50 -0.48 0.00 3.58 0.08 -1.50 116.42 119.31 3g4g h ASP 333 Ca 0.09 -0.09 -0.14 0.00 0.42 0.00 0.00 57.03 57.32 3g4g h ASP 333 Cb 0.79 -0.13 -0.01 0.00 1.72 0.00 0.00 39.33 41.70 3g4g h ASP 333 CO 0.07 0.44 -0.23 0.58 -2.88 0.00 0.00 179.24 177.22 3g4g h VAL 334 N 0.52 1.27 -0.44 2.25 2.07 -0.98 -1.82 116.25 119.11 3g4g h VAL 334 Ca 0.14 -1.40 0.03 0.00 0.82 0.00 0.00 66.70 66.29 3g4g h VAL 334 Cb 0.05 1.14 -0.03 0.00 -1.52 0.00 0.00 31.29 30.93 3g4g h VAL 334 CO -0.02 0.48 0.25 0.58 0.02 0.00 0.00 177.57 178.88 3g4g h VAL 335 N 0.86 1.01 -0.15 2.57 2.07 -1.11 -1.16 116.25 120.34 3g4g h VAL 335 Ca 0.11 -0.17 -0.15 0.00 0.82 0.00 0.00 66.70 67.30 3g4g h VAL 335 Cb 0.81 0.48 -0.01 0.00 -1.52 0.00 0.00 31.29 31.05 3g4g h VAL 335 CO 0.07 0.09 -0.56 -0.61 0.02 0.00 0.00 177.57 176.58 3g4g h GLN 336 N 0.49 0.46 -0.31 1.57 -0.00 -1.16 -1.03 115.11 115.14 3g4g h GLN 336 Ca 0.18 -0.29 -0.13 0.00 -0.00 0.00 0.00 58.65 58.41 3g4g h GLN 336 Cb 0.05 0.03 -0.00 0.00 0.00 0.00 0.00 27.48 27.56 3g4g h GLN 336 CO -0.10 0.90 -0.32 0.77 0.00 0.00 0.00 178.83 180.08 3g4g h SER 337 N 0.35 0.82 -0.43 -0.69 0.02 -1.02 -2.01 113.55 110.59 3g4g h SER 337 Ca 0.00 -0.47 0.01 0.00 -0.84 0.00 0.00 61.79 60.49 3g4g h SER 337 Cb 1.08 -0.23 -0.02 0.00 0.14 0.00 0.00 62.40 63.37 3g4g h SER 337 CO 0.10 1.12 0.27 0.74 -1.14 0.00 0.00 176.83 177.92 3g4g h THR 338 N 0.53 1.08 -0.84 -2.27 2.02 -1.04 -1.02 112.91 111.36 3g4g h THR 338 Ca 0.05 -0.19 0.13 0.00 0.77 0.00 0.00 66.41 67.17 3g4g h THR 338 Cb 0.90 0.48 -0.09 0.00 -1.74 0.00 0.00 68.15 67.70 3g4g h THR 338 CO 0.08 0.10 0.44 -0.74 0.37 0.00 0.00 175.52 175.77 3g4g h HIS 339 N 0.55 0.79 -0.10 3.16 -0.00 -0.97 0.93 115.15 119.50 3g4g h HIS 339 Ca 0.16 0.03 -0.19 0.00 -0.00 0.00 0.00 60.37 60.38 3g4g h HIS 339 Cb -0.03 -0.22 0.01 0.00 -0.00 0.00 0.00 27.41 27.17 3g4g h HIS 339 CO -0.06 0.22 -0.66 0.28 -0.00 0.00 0.00 177.93 177.71 3g4g h VAL 340 N 0.66 1.33 -0.15 5.26 2.07 -1.05 -3.25 116.25 121.13 3g4g h VAL 340 Ca 0.45 -1.94 -0.06 0.00 0.82 0.00 0.00 66.70 65.96 3g4g h VAL 340 Cb 0.58 2.18 -0.01 0.00 -1.52 0.00 0.00 31.29 32.52 3g4g h VAL 340 CO -0.33 0.60 -0.20 -0.07 0.02 0.00 0.00 177.57 177.58 3g4g h LEU 341 N 0.28 0.24 -1.39 2.57 3.38 -0.58 -2.31 115.31 117.49 3g4g h LEU 341 Ca -0.05 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.85 3g4g h LEU 341 Cb 1.31 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 42.00 3g4g h LEU 341 CO 0.14 0.46 0.00 -0.07 0.09 0.00 0.00 178.44 179.05 3g4g h LEU 342 N 0.23 0.00 -0.60 1.67 3.38 -0.87 -3.13 115.31 115.98 3g4g h LEU 342 Ca 0.04 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.01 3g4g h LEU 342 Cb 0.49 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.24 3g4g h LEU 342 CO 0.03 0.00 -0.62 -1.20 0.09 0.00 0.00 178.44 176.74 3g4g n SER 343 N -2.56 1.55 -4.60 -0.43 7.64 -0.87 -4.84 113.62 109.50 3g4g n SER 343 Ca 0.00 -1.27 -0.49 0.00 1.01 0.00 0.00 58.87 58.12 3g4g n SER 343 Cb 0.18 0.68 -0.04 0.00 -1.01 0.00 0.00 64.21 64.01 3g4g n SER 343 CO 0.00 0.00 0.00 1.07 -3.01 0.00 0.00 175.04 173.10 3g4g n THR 344 N -0.58 0.63 -0.31 0.44 5.66 -1.19 -4.88 114.28 114.05 3g4g n THR 344 Ca 0.07 -0.16 0.13 0.00 -3.05 0.00 0.00 64.05 61.04 3g4g n THR 344 Cb 0.39 -0.97 0.31 0.00 -1.55 0.00 0.00 70.33 68.50 3g4g n THR 344 CO 0.00 0.00 0.00 -0.65 -3.05 0.00 0.00 175.07 171.37 3g4g h PRO 345 N 3.94 0.46 0.00 1.09 0.11 -1.92 -1.43 132.00 134.25 3g4g h PRO 345 Ca -0.45 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.64 3g4g h PRO 345 Cb 1.33 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.33 3g4g h PRO 345 CO 0.74 0.31 0.00 0.00 -0.21 0.00 0.00 178.00 178.83 3g4g h ALA 346 N 1.69 1.00 -0.47 -0.75 0.00 -1.83 -1.65 119.26 117.25 3g4g h ALA 346 Ca 0.56 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.47 3g4g h ALA 346 Cb 1.03 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.82 3g4g h ALA 346 CO -0.49 0.00 0.00 1.28 0.00 0.00 0.00 179.25 180.04 3g4g n LEU 347 N -2.78 3.48 -4.68 0.00 4.77 -0.54 -0.82 117.00 116.43 3g4g n LEU 347 Ca -0.02 -2.14 -0.42 0.00 -0.03 0.00 0.00 56.01 53.40 3g4g n LEU 347 Cb 0.10 -0.36 -0.03 0.00 -2.33 0.00 0.00 43.42 40.80 3g4g n LEU 347 CO 0.18 0.80 1.49 -1.61 -1.33 0.00 0.00 177.39 176.92 3g4g s GLU 348 N -1.26 4.15 0.00 3.23 2.02 -0.62 -2.25 118.70 123.96 3g4g s GLU 348 Ca 0.34 2.55 0.00 0.00 0.02 0.00 0.00 54.97 57.88 3g4g s GLU 348 Cb 0.20 -3.82 0.00 0.00 0.10 0.00 0.00 34.13 30.61 3g4g s GLU 348 CO 0.20 -0.87 0.00 0.00 0.02 0.00 0.00 175.26 174.62 3g4g n ALA 349 N 6.40 0.00 -0.03 5.21 0.00 -1.26 -4.89 120.51 125.94 3g4g n ALA 349 Ca 0.18 0.00 -0.15 0.00 0.00 0.00 0.00 53.44 53.48 3g4g n ALA 349 Cb 0.40 -0.75 -0.09 0.00 0.00 0.00 0.00 19.45 19.01 3g4g n ALA 349 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 3g4g h VAL 350 N 0.00 1.43 -2.97 0.00 2.07 -1.80 -3.45 116.25 111.52 3g4g h VAL 350 Ca 0.00 -1.65 -0.61 0.00 0.82 0.00 0.00 66.70 65.25 3g4g h VAL 350 Cb 0.40 2.30 -0.05 0.00 -1.52 0.00 0.00 31.29 32.42 3g4g h VAL 350 CO 0.00 0.47 -0.36 -0.36 0.02 0.00 0.00 177.57 177.34 3g4g s PHE 351 N -3.72 3.56 0.96 1.57 0.08 -1.26 -5.00 117.98 114.17 3g4g s PHE 351 Ca -0.14 0.57 -0.13 0.00 0.12 0.00 0.00 56.93 57.35 3g4g s PHE 351 Cb 0.03 -2.00 0.17 0.00 -0.57 0.00 0.00 43.02 40.65 3g4g s PHE 351 CO 0.76 0.57 1.14 0.95 -0.10 0.00 0.00 175.22 178.54 3g4g s THR 352 N -1.39 1.97 0.12 0.64 -4.23 -1.26 -4.86 115.64 106.62 3g4g s THR 352 Ca 0.31 0.00 0.19 0.00 -1.18 0.00 0.00 61.69 61.01 3g4g s THR 352 Cb -0.13 -2.69 0.14 0.00 1.34 0.00 0.00 72.50 71.16 3g4g s THR 352 CO 0.19 0.00 1.71 0.44 -0.54 0.00 0.00 174.62 176.42 3g4g h ASP 353 N -1.68 0.00 -0.20 3.99 3.32 -1.98 -1.45 116.42 118.41 3g4g h ASP 353 Ca -0.51 0.00 -0.13 0.00 0.02 0.00 0.00 57.03 56.41 3g4g h ASP 353 Cb 1.32 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.88 3g4g h ASP 353 CO 0.58 0.37 -0.38 0.25 -1.72 0.00 0.00 179.24 178.33 3g4g h LEU 354 N 0.00 0.69 -0.62 1.55 5.85 -1.98 0.15 115.31 120.95 3g4g h LEU 354 Ca -0.00 -0.54 -0.07 0.00 0.84 0.00 0.00 57.88 58.10 3g4g h LEU 354 Cb 0.94 -0.20 -0.02 0.00 0.37 0.00 0.00 40.66 41.75 3g4g h LEU 354 CO 0.05 1.10 0.10 -0.33 -0.34 0.00 0.00 178.44 179.02 3g4g h GLU 355 N 0.30 1.03 -0.78 1.25 5.08 -1.90 0.14 114.58 119.70 3g4g h GLU 355 Ca 0.01 -0.28 -0.02 0.00 -1.00 0.00 0.00 59.36 58.07 3g4g h GLU 355 Cb 0.98 -0.12 -0.04 0.00 0.50 0.00 0.00 28.75 30.07 3g4g h GLU 355 CO 0.09 0.96 0.42 0.82 -1.00 0.00 0.00 179.01 180.30 3g4g h ILE 356 N 0.94 1.24 -0.61 3.13 2.04 -1.11 -0.43 117.51 122.71 3g4g h ILE 356 Ca 0.19 -0.60 -0.07 0.00 1.00 0.00 0.00 64.86 65.38 3g4g h ILE 356 Cb 0.43 0.20 -0.03 0.00 -0.74 0.00 0.00 36.82 36.69 3g4g h ILE 356 CO 0.01 0.26 0.09 0.25 0.00 0.00 0.00 178.15 178.77 3g4g h LEU 357 N 1.09 0.95 -0.13 1.44 5.85 -0.30 -2.61 115.31 121.60 3g4g h LEU 357 Ca 0.27 -0.22 -0.01 0.00 0.84 0.00 0.00 57.88 58.77 3g4g h LEU 357 Cb 0.04 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 40.81 3g4g h LEU 357 CO -0.04 0.96 0.05 0.00 -0.34 0.00 0.00 178.44 179.07 3g4g h ALA 358 N 1.15 0.16 -0.63 1.25 0.00 0.02 -2.02 119.26 119.20 3g4g h ALA 358 Ca 0.19 -0.09 -0.07 0.00 0.00 0.00 0.00 54.91 54.93 3g4g h ALA 358 Cb 0.42 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.13 3g4g h ALA 358 CO 0.01 -0.26 0.10 0.00 0.00 0.00 0.00 179.25 179.10 3g4g h ALA 359 N 0.91 0.98 -0.15 0.00 0.00 -0.85 -1.25 119.26 118.90 3g4g h ALA 359 Ca 0.04 -0.26 -0.18 0.00 0.00 0.00 0.00 54.91 54.52 3g4g h ALA 359 Cb 0.15 -0.24 0.01 0.00 0.00 0.00 0.00 17.79 17.71 3g4g h ALA 359 CO -0.00 0.64 -0.59 0.82 0.00 0.00 0.00 179.25 180.11 3g4g h ILE 360 N 0.97 1.32 -0.32 0.00 2.04 -1.48 -1.34 117.51 118.70 3g4g h ILE 360 Ca 0.19 -1.84 -0.02 0.00 1.00 0.00 0.00 64.86 64.19 3g4g h ILE 360 Cb 0.42 2.02 -0.01 0.00 -0.74 0.00 0.00 36.82 38.51 3g4g h ILE 360 CO 0.01 0.57 0.13 0.15 0.00 0.00 0.00 178.15 179.02 3g4g h PHE 361 N 0.35 0.48 -0.37 1.37 3.57 -1.35 -1.88 116.94 119.12 3g4g h PHE 361 Ca -0.03 -0.03 0.05 0.00 3.53 0.00 0.00 57.97 61.49 3g4g h PHE 361 Cb 1.22 -0.15 -0.05 0.00 2.79 0.00 0.00 35.95 39.77 3g4g h PHE 361 CO 0.10 0.45 0.08 0.00 -2.23 0.00 0.00 178.31 176.72 3g4g h ALA 362 N 0.98 0.40 -0.79 2.41 0.00 -1.18 -1.82 119.26 119.26 3g4g h ALA 362 Ca 0.11 0.07 0.08 0.00 0.00 0.00 0.00 54.91 55.17 3g4g h ALA 362 Cb 0.17 0.08 -0.07 0.00 0.00 0.00 0.00 17.79 17.97 3g4g h ALA 362 CO -0.01 -0.32 0.44 0.77 0.00 0.00 0.00 179.25 180.14 3g4g h SER 363 N 0.21 0.64 -0.69 0.00 0.02 -1.13 -1.17 113.55 111.44 3g4g h SER 363 Ca 0.17 0.04 -0.07 0.00 -0.84 0.00 0.00 61.79 61.10 3g4g h SER 363 Cb 0.19 -0.08 -0.03 0.00 0.14 0.00 0.00 62.40 62.62 3g4g h SER 363 CO -0.22 0.38 0.17 0.00 -1.14 0.00 0.00 176.83 176.02 3g4g h ALA 364 N 1.43 0.98 -0.02 3.77 0.00 -0.65 -3.21 119.26 121.56 3g4g h ALA 364 Ca 0.37 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 55.04 3g4g h ALA 364 Cb 0.31 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 17.84 3g4g h ALA 364 CO -0.23 0.66 -0.26 0.44 0.00 0.00 0.00 179.25 179.86 3g4g n ILE 365 N -4.23 0.00 0.33 0.00 -5.35 -0.75 -4.66 119.36 104.69 3g4g n ILE 365 Ca 0.05 -0.36 0.22 0.00 -0.27 0.00 0.00 62.75 62.39 3g4g n ILE 365 Cb 0.26 1.32 1.10 0.00 -1.74 0.00 0.00 39.64 40.58 3g4g n ILE 365 CO 0.00 0.00 0.00 1.12 -1.76 0.00 0.00 176.55 175.91 3g4g h HIS 366 N 3.37 0.00 0.00 4.28 2.07 -1.21 -2.08 115.15 121.58 3g4g h HIS 366 Ca 0.00 0.00 -0.01 0.00 -2.85 0.00 0.00 60.37 57.51 3g4g h HIS 366 Cb 0.85 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 30.81 3g4g h HIS 366 CO 0.00 0.00 -0.27 -0.25 -3.07 0.00 0.00 177.93 174.34 3g4g n ASP 367 N -3.08 1.31 -4.77 3.10 8.00 -1.26 -4.88 116.55 114.97 3g4g n ASP 367 Ca -0.02 -2.64 -0.40 0.00 0.71 0.00 0.00 54.79 52.43 3g4g n ASP 367 Cb 0.12 -0.34 -0.01 0.00 -0.02 0.00 0.00 41.12 40.88 3g4g n ASP 367 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 3g4g s VAL 368 N -1.61 2.52 -1.54 2.53 0.11 -0.78 -2.22 120.40 119.40 3g4g s VAL 368 Ca 0.19 0.50 0.00 0.00 -2.93 0.00 0.00 61.98 59.74 3g4g s VAL 368 Cb 0.17 -3.31 0.00 0.00 -1.53 0.00 0.00 36.38 31.71 3g4g s VAL 368 CO 0.01 0.11 0.00 -0.67 -3.33 0.00 0.00 175.10 171.21 3g4g n ASP 369 N 0.49 -5.14 -4.72 3.54 2.03 -0.05 -4.41 116.55 108.29 3g4g n ASP 369 Ca 0.01 0.03 -0.42 0.00 0.52 0.00 0.00 54.79 54.93 3g4g n ASP 369 Cb 0.42 -4.22 -0.03 0.00 -0.72 0.00 0.00 41.12 36.57 3g4g n ASP 369 CO 0.00 0.00 0.00 -2.28 -1.92 0.00 0.00 177.20 173.00 3g4g s HIS 370 N -2.86 3.25 -0.86 -0.67 2.46 -0.94 -4.90 115.29 110.77 3g4g s HIS 370 Ca 0.00 1.07 0.27 0.00 0.47 0.00 0.00 55.06 56.87 3g4g s HIS 370 Cb 0.00 -3.64 0.92 0.00 -0.13 0.00 0.00 32.58 29.73 3g4g s HIS 370 CO 0.00 -2.15 1.77 -0.35 -2.47 0.00 0.00 174.74 171.53 3g4g n PRO 371 N 3.42 0.13 -0.81 2.88 -0.04 -1.26 -4.59 135.00 134.73 3g4g n PRO 371 Ca 0.09 0.09 0.00 0.00 -0.04 0.00 0.00 63.50 63.64 3g4g n PRO 371 Cb 0.43 -1.64 0.00 0.00 -0.04 0.00 0.00 33.50 32.25 3g4g n PRO 371 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3g4g n GLY 372 N 1.41 0.90 3.06 0.55 0.00 -1.26 -4.97 105.19 104.88 3g4g n GLY 372 Ca 0.06 -0.53 -0.11 0.00 0.00 0.00 0.00 46.02 45.43 3g4g n GLY 372 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3g4g s VAL 373 N -2.00 0.44 0.93 1.61 -7.23 -1.26 -4.67 120.40 108.21 3g4g s VAL 373 Ca 0.00 -1.22 -0.12 0.00 -1.81 0.00 0.00 61.98 58.83 3g4g s VAL 373 Cb 0.00 -0.75 0.15 0.00 0.56 0.00 0.00 36.38 36.34 3g4g s VAL 373 CO 0.00 -0.53 1.09 -0.94 -0.31 0.00 0.00 175.10 174.42 3g4g s SER 374 N -1.86 3.23 0.26 4.85 1.04 -1.26 -4.91 113.70 115.04 3g4g s SER 374 Ca -0.07 1.42 -0.04 0.00 0.48 0.00 0.00 55.95 57.73 3g4g s SER 374 Cb -0.06 -2.09 0.33 0.00 0.10 0.00 0.00 66.02 64.29 3g4g s SER 374 CO -0.01 -2.78 1.93 0.78 0.98 0.00 0.00 173.24 174.13 3g4g h ASN 375 N -1.65 1.10 -0.32 7.02 2.35 -2.01 -2.58 115.58 119.49 3g4g h ASN 375 Ca -0.51 -0.02 -0.05 0.00 -0.55 0.00 0.00 56.30 55.17 3g4g h ASN 375 Cb 1.30 -0.26 -0.01 0.00 0.05 0.00 0.00 38.32 39.39 3g4g h ASN 375 CO 0.55 0.78 0.02 -0.61 -1.65 0.00 0.00 177.43 176.51 3g4g h GLN 376 N 1.29 0.55 -0.87 0.81 5.75 -1.96 -0.42 115.11 120.26 3g4g h GLN 376 Ca 0.37 -0.17 0.14 0.00 -0.15 0.00 0.00 58.65 58.85 3g4g h GLN 376 Cb -0.08 -0.05 -0.09 0.00 1.07 0.00 0.00 27.48 28.32 3g4g h GLN 376 CO -0.10 0.67 0.47 0.35 -2.65 0.00 0.00 178.83 177.57 3g4g h PHE 377 N 0.36 0.82 -0.56 3.99 3.04 -1.90 0.38 116.94 123.07 3g4g h PHE 377 Ca 0.09 0.03 -0.10 0.00 3.98 0.00 0.00 57.97 61.97 3g4g h PHE 377 Cb 0.41 -0.24 -0.02 0.00 2.56 0.00 0.00 35.95 38.67 3g4g h PHE 377 CO 0.03 0.22 -0.06 -0.07 -2.02 0.00 0.00 178.31 176.42 3g4g h LEU 378 N 0.68 1.01 -0.53 0.59 3.38 -1.17 -1.50 115.31 117.77 3g4g h LEU 378 Ca 0.47 -0.31 -0.15 0.00 0.09 0.00 0.00 57.88 57.98 3g4g h LEU 378 Cb 0.63 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 41.09 3g4g h LEU 378 CO -0.34 1.09 -0.44 0.40 0.09 0.00 0.00 178.44 179.24 3g4g h ILE 379 N 0.92 1.29 0.00 1.22 2.04 -0.02 -2.22 117.51 120.75 3g4g h ILE 379 Ca 0.15 -1.62 -0.03 0.00 1.00 0.00 0.00 64.86 64.36 3g4g h ILE 379 Cb 0.61 1.55 -0.00 0.00 -0.74 0.00 0.00 36.82 38.23 3g4g h ILE 379 CO 0.04 0.52 -0.14 0.78 0.00 0.00 0.00 178.15 179.35 3g4g h ASN 380 N 0.57 0.00 -0.52 1.72 2.35 -0.18 -2.94 115.58 116.58 3g4g h ASN 380 Ca 0.04 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.79 3g4g h ASN 380 Cb 0.98 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.35 3g4g h ASN 380 CO 0.09 0.14 0.00 0.35 -1.65 0.00 0.00 177.43 176.37 3g4g n THR 381 N -3.22 0.73 -3.82 2.81 -2.24 -0.58 -4.96 114.28 103.00 3g4g n THR 381 Ca 0.01 -0.86 -0.25 0.00 -2.27 0.00 0.00 64.05 60.68 3g4g n THR 381 Cb 0.45 0.76 0.02 0.00 -2.10 0.00 0.00 70.33 69.47 3g4g n THR 381 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 3g4g n ASN 382 N 1.46 -1.90 -4.78 3.42 3.02 -1.11 -4.96 115.26 110.41 3g4g n ASN 382 Ca 0.20 -0.85 -0.32 0.00 -0.03 0.00 0.00 54.58 53.58 3g4g n ASN 382 Cb 0.59 -3.78 0.05 0.00 -0.61 0.00 0.00 39.78 36.03 3g4g n ASN 382 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 3g4g s SER 383 N -4.09 5.15 0.30 6.41 1.04 -0.84 -4.94 113.70 116.73 3g4g s SER 383 Ca 0.18 1.85 -0.02 0.00 0.48 0.00 0.00 55.95 58.45 3g4g s SER 383 Cb -0.09 -2.53 0.46 0.00 0.10 0.00 0.00 66.02 63.95 3g4g s SER 383 CO 0.84 -1.60 1.97 -0.08 0.98 0.00 0.00 173.24 175.34 3g4g h GLU 384 N -0.29 1.07 -0.40 4.02 4.81 -1.92 -2.44 114.58 119.42 3g4g h GLU 384 Ca -0.45 -0.06 -0.05 0.00 -0.13 0.00 0.00 59.36 58.66 3g4g h GLU 384 Cb 1.23 -0.24 -0.02 0.00 0.63 0.00 0.00 28.75 30.35 3g4g h GLU 384 CO 0.55 0.71 0.06 -0.07 -0.73 0.00 0.00 179.01 179.53 3g4g h LEU 385 N 1.11 0.64 -0.64 1.64 3.38 -1.93 -0.91 115.31 118.60 3g4g h LEU 385 Ca 0.31 -0.26 -0.02 0.00 0.09 0.00 0.00 57.88 57.99 3g4g h LEU 385 Cb -0.11 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 40.44 3g4g h LEU 385 CO -0.07 0.75 0.32 0.00 0.09 0.00 0.00 178.44 179.52 3g4g h ALA 386 N 0.92 0.82 0.18 1.53 0.00 -1.79 -1.61 119.26 119.32 3g4g h ALA 386 Ca 0.12 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3g4g h ALA 386 Cb 0.38 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 3g4g h ALA 386 CO 0.01 0.38 -0.18 1.25 0.00 0.00 0.00 179.25 180.70 3g4g h LEU 387 N 0.88 -0.48 -0.73 0.00 5.85 -1.35 0.73 115.31 120.20 3g4g h LEU 387 Ca 0.22 0.05 0.14 0.00 0.84 0.00 0.00 57.88 59.13 3g4g h LEU 387 Cb 0.10 0.17 -0.10 0.00 0.37 0.00 0.00 40.66 41.20 3g4g h LEU 387 CO -0.03 -0.27 0.25 -0.03 -0.34 0.00 0.00 178.44 178.02 3g4g h MET 388 N -0.39 0.37 -0.03 1.25 4.05 -0.95 -3.16 114.93 116.07 3g4g h MET 388 Ca 0.00 -0.02 0.00 0.00 -0.28 0.00 0.00 59.70 59.40 3g4g h MET 388 Cb 0.37 -0.08 0.00 0.00 -0.80 0.00 0.00 31.60 31.09 3g4g h MET 388 CO -0.05 0.25 0.00 0.66 0.23 0.00 0.00 176.91 178.00 3g4g n TYR 389 N -5.05 0.07 -1.09 1.39 4.01 -0.62 -4.96 117.16 110.90 3g4g n TYR 389 Ca 0.14 -0.80 0.00 0.00 -0.16 0.00 0.00 57.90 57.07 3g4g n TYR 389 Cb 0.42 -0.12 0.00 0.00 -0.31 0.00 0.00 39.34 39.33 3g4g n TYR 389 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 3g4g n ASN 390 N -1.00 -0.69 0.00 7.72 3.02 0.24 -1.16 115.26 123.39 3g4g n ASN 390 Ca 0.11 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.66 3g4g n ASN 390 Cb 0.51 -0.25 0.00 0.00 -0.61 0.00 0.00 39.78 39.43 3g4g n ASN 390 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 3g4g n ASP 391 N 0.90 -3.54 -4.45 6.41 8.00 -0.43 -4.97 116.55 118.47 3g4g n ASP 391 Ca 0.00 0.00 -0.37 0.00 0.71 0.00 0.00 54.79 55.13 3g4g n ASP 391 Cb 0.25 -2.53 -0.12 0.00 -0.02 0.00 0.00 41.12 38.70 3g4g n ASP 391 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 3g4g s SER 392 N -2.08 5.36 -1.54 -2.24 0.01 -0.31 -4.57 113.70 108.34 3g4g s SER 392 Ca 0.00 -0.32 -0.01 0.00 1.31 0.00 0.00 55.95 56.92 3g4g s SER 392 Cb 0.00 -1.97 0.01 0.00 0.21 0.00 0.00 66.02 64.28 3g4g s SER 392 CO 0.00 -0.10 0.04 -1.20 0.41 0.00 0.00 173.24 172.39 3g4g n SER 393 N 4.95 0.77 -0.11 2.44 7.64 -1.26 -4.78 113.62 123.27 3g4g n SER 393 Ca -0.15 -1.25 -0.06 0.00 1.01 0.00 0.00 58.87 58.42 3g4g n SER 393 Cb 0.50 -1.56 0.01 0.00 -1.01 0.00 0.00 64.21 62.16 3g4g n SER 393 CO 0.00 0.00 0.00 0.58 -3.01 0.00 0.00 175.04 172.61 3g4g h VAL 394 N -1.67 0.44 -0.05 0.44 2.07 -1.85 -0.48 116.25 115.14 3g4g h VAL 394 Ca -0.64 0.00 -0.21 0.00 0.82 0.00 0.00 66.70 66.67 3g4g h VAL 394 Cb 1.37 0.44 0.00 0.00 -1.52 0.00 0.00 31.29 31.58 3g4g h VAL 394 CO 0.71 0.00 -0.84 -0.07 0.02 0.00 0.00 177.57 177.38 3g4g h LEU 395 N -0.12 0.60 -0.62 2.57 3.38 -1.95 -2.77 115.31 116.42 3g4g h LEU 395 Ca 0.19 -0.44 -0.15 0.00 0.09 0.00 0.00 57.88 57.58 3g4g h LEU 395 Cb 0.41 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.97 3g4g h LEU 395 CO -0.46 1.21 -0.54 -0.33 0.09 0.00 0.00 178.44 178.41 3g4g h GLU 396 N 0.31 0.42 -0.37 1.13 3.07 -1.81 0.82 114.58 118.15 3g4g h GLU 396 Ca -0.06 -0.26 -0.01 0.00 -0.50 0.00 0.00 59.36 58.53 3g4g h GLU 396 Cb 1.45 0.03 -0.02 0.00 -0.84 0.00 0.00 28.75 29.37 3g4g h GLU 396 CO 0.15 0.86 0.21 -0.91 -1.40 0.00 0.00 179.01 177.91 3g4g h ASN 397 N 0.33 0.46 -0.14 1.42 2.35 -1.15 -2.49 115.58 116.36 3g4g h ASN 397 Ca 0.01 -0.08 0.03 0.00 -0.55 0.00 0.00 56.30 55.70 3g4g h ASN 397 Cb 1.05 -0.12 -0.03 0.00 0.05 0.00 0.00 38.32 39.28 3g4g h ASN 397 CO 0.09 0.41 -0.04 -0.74 -1.65 0.00 0.00 177.43 175.50 3g4g h HIS 398 N 0.48 -0.08 -0.70 1.19 2.76 -1.09 -1.55 115.15 116.15 3g4g h HIS 398 Ca 0.13 0.01 0.02 0.00 -2.20 0.00 0.00 60.37 58.33 3g4g h HIS 398 Cb 0.05 0.06 -0.04 0.00 1.55 0.00 0.00 27.41 29.02 3g4g h HIS 398 CO -0.03 -0.06 0.45 0.45 -1.30 0.00 0.00 177.93 177.44 3g4g h HIS 399 N -0.01 0.85 -0.31 5.26 3.86 -0.83 -1.37 115.15 122.60 3g4g h HIS 399 Ca 0.07 0.02 0.02 0.00 -1.16 0.00 0.00 60.37 59.32 3g4g h HIS 399 Cb 0.11 -0.28 -0.03 0.00 1.06 0.00 0.00 27.41 28.27 3g4g h HIS 399 CO -0.18 0.50 0.14 -0.07 0.86 0.00 0.00 177.93 179.19 3g4g h LEU 400 N 0.90 0.20 -0.38 2.43 3.38 -1.23 -2.14 115.31 118.46 3g4g h LEU 400 Ca 0.27 0.02 -0.01 0.00 0.09 0.00 0.00 57.88 58.25 3g4g h LEU 400 Cb -0.03 -0.02 -0.02 0.00 0.09 0.00 0.00 40.66 40.68 3g4g h LEU 400 CO -0.09 0.15 0.21 0.00 0.09 0.00 0.00 178.44 178.80 3g4g h ALA 401 N 1.17 0.49 -0.22 1.53 0.00 -0.47 -1.65 119.26 120.11 3g4g h ALA 401 Ca 0.13 -0.08 -0.03 0.00 0.00 0.00 0.00 54.91 54.94 3g4g h ALA 401 Cb 0.06 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 3g4g h ALA 401 CO -0.10 0.01 0.04 0.28 0.00 0.00 0.00 179.25 179.47 3g4g h VAL 402 N 0.48 1.22 -0.71 0.00 2.07 -1.28 0.25 116.25 118.29 3g4g h VAL 402 Ca 0.13 -0.74 -0.03 0.00 0.82 0.00 0.00 66.70 66.88 3g4g h VAL 402 Cb 0.05 1.29 -0.03 0.00 -1.52 0.00 0.00 31.29 31.08 3g4g h VAL 402 CO -0.02 0.23 0.33 1.23 0.02 0.00 0.00 177.57 179.36 3g4g h GLY 403 N 0.17 1.11 1.71 2.17 0.00 -1.25 0.11 103.07 107.08 3g4g h GLY 403 Ca 0.07 -0.56 -0.17 0.00 0.00 0.00 0.00 47.33 46.67 3g4g h GLY 403 CO 0.00 0.53 -0.70 0.74 0.00 0.00 0.00 176.54 177.11 3g4g h PHE 404 N 1.00 0.38 -0.80 5.60 0.04 -1.32 -3.28 116.94 118.56 3g4g h PHE 404 Ca 0.24 -0.17 0.02 0.00 2.80 0.00 0.00 57.97 60.87 3g4g h PHE 404 Cb 0.14 -0.06 -0.04 0.00 2.20 0.00 0.00 35.95 38.18 3g4g h PHE 404 CO 0.01 0.89 0.52 -0.22 -0.60 0.00 0.00 178.31 178.91 3g4g h LYS 405 N 0.20 1.01 0.00 1.51 1.63 0.34 -2.92 116.57 118.34 3g4g h LYS 405 Ca -0.02 -0.06 0.00 0.00 -0.85 0.00 0.00 60.65 59.72 3g4g h LYS 405 Cb 1.25 -0.23 0.00 0.00 -0.60 0.00 0.00 32.23 32.66 3g4g h LYS 405 CO 0.11 0.67 0.00 -0.07 -3.45 0.00 0.00 179.45 176.71 3g4g h LEU 406 N 1.04 0.00 -1.43 5.20 3.38 -0.87 -1.72 115.31 120.91 3g4g h LEU 406 Ca 0.31 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.24 3g4g h LEU 406 Cb -0.05 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.69 3g4g h LEU 406 CO -0.09 0.00 -0.16 -0.07 0.09 0.00 0.00 178.44 178.21 3g4g h LEU 407 N 0.00 0.00 -0.06 1.67 3.38 -1.63 -3.09 115.31 115.58 3g4g h LEU 407 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3g4g h LEU 407 Cb 0.20 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.95 3g4g h LEU 407 CO 0.00 0.16 -0.07 0.00 0.09 0.00 0.00 178.44 178.62 3g4g n GLN 408 N -3.40 0.33 -0.96 1.13 6.02 -0.65 -2.87 117.38 116.97 3g4g n GLN 408 Ca -0.00 -0.06 -0.29 0.00 -0.01 0.00 0.00 57.00 56.64 3g4g n GLN 408 Cb 0.35 -1.50 0.21 0.00 1.02 0.00 0.00 30.24 30.32 3g4g n GLN 408 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 177.06 174.84 3g4g s GLU 409 N -2.71 -0.37 -0.22 -1.09 2.02 -1.17 -4.96 118.70 110.20 3g4g s GLU 409 Ca 0.23 0.47 -0.29 0.00 0.02 0.00 0.00 54.97 55.40 3g4g s GLU 409 Cb 0.20 -1.65 0.01 0.00 0.10 0.00 0.00 34.13 32.79 3g4g s GLU 409 CO 0.51 -3.26 1.04 -1.83 0.02 0.00 0.00 175.26 171.73 3g4g s GLU 410 N -4.90 4.27 -1.41 1.61 1.03 -1.26 -2.66 118.70 115.38 3g4g s GLU 410 Ca 0.67 1.36 -0.10 0.00 0.03 0.00 0.00 54.97 56.93 3g4g s GLU 410 Cb -0.19 -3.64 0.03 0.00 -0.80 0.00 0.00 34.13 29.54 3g4g s GLU 410 CO 0.59 -0.61 1.12 -1.71 -1.33 0.00 0.00 175.26 173.32 3g4g n ASN 411 N 6.25 -5.73 -0.01 0.83 4.05 -1.26 -4.94 115.26 114.44 3g4g n ASN 411 Ca 0.12 -0.62 0.00 0.00 0.45 0.00 0.00 54.58 54.53 3g4g n ASN 411 Cb 0.46 -4.67 -0.00 0.00 1.23 0.00 0.00 39.78 36.80 3g4g n ASN 411 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 3g4g s ASP 413 N -0.78 6.39 0.20 0.00 2.15 -1.14 -4.64 116.67 118.84 3g4g s ASP 413 Ca 0.01 -1.44 0.24 0.00 0.43 0.00 0.00 52.55 51.79 3g4g s ASP 413 Cb 0.01 -2.57 0.91 0.00 -0.30 0.00 0.00 42.92 40.97 3g4g s ASP 413 CO 0.03 -1.61 1.72 2.30 -0.17 0.00 0.00 175.17 177.45 3g4g n ILE 414 N 6.95 0.71 -0.87 4.11 -5.35 -1.26 -2.12 119.36 121.53 3g4g n ILE 414 Ca 0.35 0.04 0.08 0.00 -0.27 0.00 0.00 62.75 62.95 3g4g n ILE 414 Cb 0.50 -0.91 0.35 0.00 -1.74 0.00 0.00 39.64 37.85 3g4g n ILE 414 CO 0.00 0.00 0.00 0.49 -1.76 0.00 0.00 176.55 175.28 3g4g n PHE 415 N -2.12 1.64 0.30 4.28 3.72 -1.26 -4.61 117.46 119.41 3g4g n PHE 415 Ca 0.04 -0.75 0.15 0.00 -0.05 0.00 0.00 57.45 56.84 3g4g n PHE 415 Cb 0.30 -0.41 0.92 0.00 -0.94 0.00 0.00 39.48 39.35 3g4g n PHE 415 CO 0.00 0.00 0.00 -0.56 -0.05 0.00 0.00 176.76 176.15 3g4g h GLN 416 N 3.36 0.00 -0.44 -1.08 3.07 -1.78 -2.15 115.11 116.09 3g4g h GLN 416 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.74 3g4g h GLN 416 Cb 1.73 0.00 0.00 0.00 0.08 0.00 0.00 27.48 29.29 3g4g h GLN 416 CO 0.37 0.00 0.00 0.09 0.09 0.00 0.00 178.83 179.38 3g4g n ASN 417 N -3.85 3.92 -4.82 0.06 3.02 -1.26 -4.95 115.26 107.39 3g4g n ASN 417 Ca -0.03 -2.47 -0.35 0.00 -0.03 0.00 0.00 54.58 51.70 3g4g n ASN 417 Cb 0.08 -0.46 -0.06 0.00 -0.61 0.00 0.00 39.78 38.73 3g4g n ASN 417 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 3g4g s LEU 418 N -1.85 4.25 0.87 3.41 1.02 -0.81 -4.87 118.68 120.69 3g4g s LEU 418 Ca 0.40 1.48 -0.11 0.00 0.02 0.00 0.00 54.13 55.91 3g4g s LEU 418 Cb 0.27 -3.84 0.11 0.00 0.02 0.00 0.00 46.19 42.75 3g4g s LEU 418 CO 0.17 -0.07 1.10 0.42 0.02 0.00 0.00 176.35 177.99 3g4g s THR 419 N -1.69 2.78 0.17 5.49 -4.23 -1.26 -4.73 115.64 112.17 3g4g s THR 419 Ca 0.48 0.25 -0.18 0.00 -1.18 0.00 0.00 61.69 61.07 3g4g s THR 419 Cb -0.15 -2.62 0.10 0.00 1.34 0.00 0.00 72.50 71.17 3g4g s THR 419 CO 0.20 -0.33 1.65 0.50 -0.54 0.00 0.00 174.62 176.10 3g4g h LYS 420 N -1.51 -0.05 -0.67 3.99 3.11 -1.98 0.23 116.57 119.69 3g4g h LYS 420 Ca -0.47 0.00 -0.06 0.00 -2.81 0.00 0.00 60.65 57.32 3g4g h LYS 420 Cb 1.26 0.01 -0.03 0.00 -1.00 0.00 0.00 32.23 32.48 3g4g h LYS 420 CO 0.50 -0.04 0.19 0.87 -2.81 0.00 0.00 179.45 178.17 3g4g h LYS 421 N -0.06 1.03 -0.06 1.90 1.57 -1.99 0.15 116.57 119.12 3g4g h LYS 421 Ca 0.20 -0.22 -0.01 0.00 -1.87 0.00 0.00 60.65 58.75 3g4g h LYS 421 Cb 0.36 -0.15 -0.00 0.00 0.08 0.00 0.00 32.23 32.51 3g4g h LYS 421 CO -0.45 0.90 0.01 1.96 -0.57 0.00 0.00 179.45 181.30 3g4g h GLN 422 N 0.99 0.09 -0.92 3.15 4.20 -1.78 -2.29 115.11 118.56 3g4g h GLN 422 Ca 0.22 -0.03 0.14 0.00 0.06 0.00 0.00 58.65 59.04 3g4g h GLN 422 Cb 0.31 -0.01 -0.09 0.00 0.30 0.00 0.00 27.48 27.99 3g4g h GLN 422 CO -0.00 0.33 0.53 0.00 -0.67 0.00 0.00 178.83 179.02 3g4g h ARG 423 N -0.16 0.77 -0.31 1.46 3.08 -0.09 -0.79 114.38 118.34 3g4g h ARG 423 Ca 0.02 -0.05 -0.17 0.00 0.07 0.00 0.00 59.98 59.85 3g4g h ARG 423 Cb 0.29 -0.17 -0.00 0.00 0.08 0.00 0.00 29.97 30.16 3g4g h ARG 423 CO 0.00 0.51 -0.47 1.96 -1.07 0.00 0.00 179.97 180.89 3g4g h GLN 424 N 0.79 0.82 0.11 0.04 4.20 -0.87 -1.81 115.11 118.38 3g4g h GLN 424 Ca 0.48 -0.48 -0.01 0.00 0.06 0.00 0.00 58.65 58.71 3g4g h GLN 424 Cb 0.59 0.04 0.00 0.00 0.30 0.00 0.00 27.48 28.41 3g4g h GLN 424 CO -0.31 1.11 -0.05 1.03 -0.67 0.00 0.00 178.83 179.94 3g4g h SER 425 N 0.65 -0.12 -0.92 1.46 0.87 -1.06 -2.55 113.55 111.89 3g4g h SER 425 Ca 0.03 -0.41 0.09 0.00 -1.23 0.00 0.00 61.79 60.27 3g4g h SER 425 Cb 1.06 0.03 -0.07 0.00 -0.44 0.00 0.00 62.40 62.98 3g4g h SER 425 CO 0.11 0.39 0.57 0.25 -0.53 0.00 0.00 176.83 177.61 3g4g h LEU 426 N -0.68 0.85 -0.35 2.23 6.46 -1.19 -0.33 115.31 122.31 3g4g h LEU 426 Ca -0.01 0.03 -0.01 0.00 -0.12 0.00 0.00 57.88 57.77 3g4g h LEU 426 Cb 0.52 -0.14 -0.02 0.00 -0.73 0.00 0.00 40.66 40.30 3g4g h LEU 426 CO 0.02 0.50 0.16 -0.09 -0.62 0.00 0.00 178.44 178.42 3g4g h ARG 427 N 0.96 0.51 -0.79 1.25 2.43 -1.29 0.99 114.38 118.43 3g4g h ARG 427 Ca 0.43 -0.08 0.02 0.00 -0.81 0.00 0.00 59.98 59.54 3g4g h ARG 427 Cb 0.32 -0.09 -0.04 0.00 -0.42 0.00 0.00 29.97 29.74 3g4g h ARG 427 CO -0.22 0.47 0.52 -0.22 -1.51 0.00 0.00 179.97 179.00 3g4g h LYS 428 N 0.42 1.01 -0.21 0.20 3.64 -1.12 -0.96 116.57 119.55 3g4g h LYS 428 Ca 0.12 -0.06 -0.02 0.00 -1.27 0.00 0.00 60.65 59.42 3g4g h LYS 428 Cb 0.14 -0.23 -0.01 0.00 -0.41 0.00 0.00 32.23 31.72 3g4g h LYS 428 CO -0.01 0.67 0.04 0.52 -2.27 0.00 0.00 179.45 178.40 3g4g h MET 429 N 1.04 0.34 -0.34 1.90 2.86 -0.53 -2.48 114.93 117.71 3g4g h MET 429 Ca 0.30 -0.09 -0.01 0.00 -2.06 0.00 0.00 59.70 57.84 3g4g h MET 429 Cb -0.08 -0.04 -0.02 0.00 0.06 0.00 0.00 31.60 31.52 3g4g h MET 429 CO -0.08 0.48 0.16 0.28 1.06 0.00 0.00 176.91 178.81 3g4g h VAL 430 N 0.15 1.16 -0.82 -2.22 2.07 -0.74 -0.81 116.25 115.04 3g4g h VAL 430 Ca 0.06 -0.47 0.03 0.00 0.82 0.00 0.00 66.70 67.15 3g4g h VAL 430 Cb 0.29 0.84 -0.05 0.00 -1.52 0.00 0.00 31.29 30.85 3g4g h VAL 430 CO 0.00 0.17 0.53 0.40 0.02 0.00 0.00 177.57 178.69 3g4g h ILE 431 N 0.42 1.14 -0.20 4.57 2.04 -1.18 -0.55 117.51 123.75 3g4g h ILE 431 Ca 0.12 -0.36 -0.17 0.00 1.00 0.00 0.00 64.86 65.45 3g4g h ILE 431 Cb 0.12 0.01 -0.00 0.00 -0.74 0.00 0.00 36.82 36.21 3g4g h ILE 431 CO -0.01 0.19 -0.58 0.44 0.00 0.00 0.00 178.15 178.18 3g4g h ASP 432 N 1.04 0.72 0.35 1.72 3.45 -1.11 -2.32 116.42 120.27 3g4g h ASP 432 Ca 0.33 -0.40 -0.02 0.00 0.43 0.00 0.00 57.03 57.37 3g4g h ASP 432 Cb -0.01 -0.21 0.00 0.00 -0.56 0.00 0.00 39.33 38.56 3g4g h ASP 432 CO -0.11 1.15 -0.17 0.40 -1.57 0.00 0.00 179.24 178.94 3g4g h ILE 433 N 0.49 0.64 -0.46 0.35 2.04 -0.66 -2.77 117.51 117.13 3g4g h ILE 433 Ca 0.00 -0.48 -0.01 0.00 1.00 0.00 0.00 64.86 65.38 3g4g h ILE 433 Cb 1.15 0.88 -0.02 0.00 -0.74 0.00 0.00 36.82 38.08 3g4g h ILE 433 CO 0.11 0.09 0.24 0.58 0.00 0.00 0.00 178.15 179.18 3g4g h VAL 434 N -0.75 1.15 0.00 1.67 2.07 -1.10 -0.40 116.25 118.89 3g4g h VAL 434 Ca -0.05 -0.38 -0.09 0.00 0.82 0.00 0.00 66.70 67.00 3g4g h VAL 434 Cb 0.51 0.54 -0.01 0.00 -1.52 0.00 0.00 31.29 30.80 3g4g h VAL 434 CO 0.08 0.16 -0.44 -0.07 0.02 0.00 0.00 177.57 177.33 3g4g h LEU 435 N 0.64 0.00 0.00 2.57 3.38 -1.46 -1.46 115.31 118.97 3g4g h LEU 435 Ca 0.16 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.13 3g4g h LEU 435 Cb 0.03 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.78 3g4g h LEU 435 CO -0.03 0.44 0.00 0.00 0.09 0.00 0.00 178.44 178.94 3g4g n ALA 436 N -2.29 1.91 1.02 1.53 0.00 -0.17 -2.57 120.51 119.94 3g4g n ALA 436 Ca 0.00 -0.08 0.12 0.00 0.00 0.00 0.00 53.44 53.48 3g4g n ALA 436 Cb 0.57 -1.26 0.25 0.00 0.00 0.00 0.00 19.45 19.01 3g4g n ALA 436 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 3g4g n THR 437 N -1.25 0.00 -1.59 0.00 -2.24 -0.55 -4.81 114.28 103.85 3g4g n THR 437 Ca 0.08 -0.01 -0.45 0.00 -2.27 0.00 0.00 64.05 61.40 3g4g n THR 437 Cb 0.12 0.28 -0.04 0.00 -2.10 0.00 0.00 70.33 68.59 3g4g n THR 437 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 3g4g n ASP 438 N -1.44 3.19 -0.05 3.42 -0.08 -1.06 -4.85 116.55 115.68 3g4g n ASP 438 Ca 0.06 0.46 0.13 0.00 -1.51 0.00 0.00 54.79 53.92 3g4g n ASP 438 Cb 0.34 -1.46 0.53 0.00 2.34 0.00 0.00 41.12 42.86 3g4g n ASP 438 CO 0.00 0.00 0.00 0.24 0.12 0.00 0.00 177.20 177.56 3g4g h MET 439 N 13.04 0.33 0.00 -0.67 2.86 -1.87 -0.21 114.93 128.41 3g4g h MET 439 Ca -0.41 -0.02 0.00 0.00 -2.06 0.00 0.00 59.70 57.21 3g4g h MET 439 Cb 1.26 -0.07 0.00 0.00 0.06 0.00 0.00 31.60 32.85 3g4g h MET 439 CO 0.97 0.22 0.00 0.66 1.06 0.00 0.00 176.91 179.81 3g4g h SER 440 N 0.34 0.00 0.11 1.22 4.64 -1.60 -0.42 113.55 117.83 3g4g h SER 440 Ca 0.25 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.57 3g4g h SER 440 Cb 0.55 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.64 3g4g h SER 440 CO -0.06 0.00 -0.08 0.29 -0.87 0.00 0.00 176.83 176.11 3g4g n LYS 441 N -2.32 1.24 -0.21 4.77 4.76 -0.09 -2.43 118.16 123.88 3g4g n LYS 441 Ca -0.01 -0.63 0.00 0.00 -2.87 0.00 0.00 58.31 54.80 3g4g n LYS 441 Cb 0.09 -1.49 0.08 0.00 -1.84 0.00 0.00 35.03 31.87 3g4g n LYS 441 CO 0.00 0.00 0.00 1.25 -1.37 0.00 0.00 177.40 177.28 3g4g h HIS 442 N 1.54 -0.20 -0.12 2.13 -0.00 -1.20 -0.22 115.15 117.08 3g4g h HIS 442 Ca 0.00 0.05 -0.20 0.00 -0.00 0.00 0.00 60.37 60.22 3g4g h HIS 442 Cb 0.43 0.18 0.00 0.00 -0.00 0.00 0.00 27.41 28.02 3g4g h HIS 442 CO 0.00 -0.23 -0.74 0.52 -0.00 0.00 0.00 177.93 177.48 3g4g h MET 443 N 0.05 0.58 0.52 5.26 2.86 -1.80 0.16 114.93 122.55 3g4g h MET 443 Ca 0.31 -0.46 -0.02 0.00 -2.06 0.00 0.00 59.70 57.47 3g4g h MET 443 Cb 0.50 0.10 -0.01 0.00 0.06 0.00 0.00 31.60 32.24 3g4g h MET 443 CO -0.59 1.09 -0.40 -0.91 1.06 0.00 0.00 176.91 177.16 3g4g h ASN 444 N 0.39 -1.05 -0.59 1.22 2.35 -1.72 0.02 115.58 116.21 3g4g h ASN 444 Ca -0.04 0.08 0.06 0.00 -0.55 0.00 0.00 56.30 55.85 3g4g h ASN 444 Cb 1.34 0.33 -0.05 0.00 0.05 0.00 0.00 38.32 39.99 3g4g h ASN 444 CO 0.14 -0.58 0.30 0.25 -1.65 0.00 0.00 177.43 175.88 3g4g h LEU 445 N -0.90 0.42 -1.39 1.61 5.85 -0.94 -1.38 115.31 118.58 3g4g h LEU 445 Ca -0.06 0.04 -0.03 0.00 0.84 0.00 0.00 57.88 58.67 3g4g h LEU 445 Cb 0.76 -0.04 -0.02 0.00 0.37 0.00 0.00 40.66 41.74 3g4g h LEU 445 CO 0.01 0.28 0.03 0.25 -0.34 0.00 0.00 178.44 178.66 3g4g h LEU 446 N 0.56 0.40 -0.56 2.25 5.85 -0.45 -1.02 115.31 122.34 3g4g h LEU 446 Ca 0.27 -0.06 -0.06 0.00 0.84 0.00 0.00 57.88 58.87 3g4g h LEU 446 Cb 0.19 -0.10 -0.02 0.00 0.37 0.00 0.00 40.66 41.10 3g4g h LEU 446 CO -0.19 0.45 0.13 0.00 -0.34 0.00 0.00 178.44 178.49 3g4g h ALA 447 N 1.61 0.73 -0.08 1.25 0.00 0.11 -1.91 119.26 120.98 3g4g h ALA 447 Ca 0.10 -0.22 -0.14 0.00 0.00 0.00 0.00 54.91 54.65 3g4g h ALA 447 Cb 0.23 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 3g4g h ALA 447 CO 0.00 0.44 -0.58 -0.44 0.00 0.00 0.00 179.25 178.67 3g4g h ASP 448 N 0.79 0.27 -0.63 0.00 3.32 -0.88 -1.94 116.42 117.35 3g4g h ASP 448 Ca 0.17 -0.15 -0.07 0.00 0.02 0.00 0.00 57.03 57.01 3g4g h ASP 448 Cb 0.35 -0.08 -0.03 0.00 0.22 0.00 0.00 39.33 39.80 3g4g h ASP 448 CO 0.00 0.79 0.13 0.25 -1.72 0.00 0.00 179.24 178.69 3g4g h LEU 449 N 0.18 0.97 0.00 1.55 5.85 -1.05 -2.02 115.31 120.80 3g4g h LEU 449 Ca -0.00 -0.24 -0.00 0.00 0.84 0.00 0.00 57.88 58.47 3g4g h LEU 449 Cb 1.07 -0.26 0.00 0.00 0.37 0.00 0.00 40.66 41.85 3g4g h LEU 449 CO 0.09 0.96 -0.00 0.11 -0.34 0.00 0.00 178.44 179.26 3g4g h LYS 450 N 0.93 -0.00 -0.84 1.25 1.57 -1.13 -1.60 116.57 116.75 3g4g h LYS 450 Ca 0.19 0.00 0.14 0.00 -1.87 0.00 0.00 60.65 59.11 3g4g h LYS 450 Cb 0.39 0.00 -0.06 0.00 0.08 0.00 0.00 32.23 32.64 3g4g h LYS 450 CO 0.01 0.10 0.54 1.15 -0.57 0.00 0.00 179.45 180.68 3g4g h THR 451 N -0.10 0.84 0.00 -0.16 2.02 -1.34 -0.13 112.91 114.04 3g4g h THR 451 Ca -0.00 -0.21 -0.16 0.00 0.77 0.00 0.00 66.41 66.81 3g4g h THR 451 Cb 0.10 0.17 -0.02 0.00 -1.74 0.00 0.00 68.15 66.65 3g4g h THR 451 CO 0.00 0.11 -0.74 -0.03 0.37 0.00 0.00 175.52 175.23 3g4g h MET 452 N 0.62 0.00 -0.03 6.66 1.85 -0.80 -1.62 114.93 121.61 3g4g h MET 452 Ca 0.41 0.00 -0.10 0.00 -0.61 0.00 0.00 59.70 59.40 3g4g h MET 452 Cb 0.71 0.00 0.01 0.00 0.43 0.00 0.00 31.60 32.74 3g4g h MET 452 CO -0.17 0.74 -0.36 0.28 -0.40 0.00 0.00 176.91 177.00 3g4g h VAL 453 N 0.00 1.46 -1.00 -5.77 2.07 -0.70 -2.58 116.25 109.72 3g4g h VAL 453 Ca -0.01 -1.87 0.21 0.00 0.82 0.00 0.00 66.70 65.86 3g4g h VAL 453 Cb 1.47 2.52 -0.11 0.00 -1.52 0.00 0.00 31.29 33.65 3g4g h VAL 453 CO 0.10 0.53 0.61 -0.33 0.02 0.00 0.00 177.57 178.49 3g4g h GLU 454 N -0.25 0.67 -0.41 1.57 5.08 -0.88 -1.88 114.58 118.48 3g4g h GLU 454 Ca -0.04 -0.04 -0.08 0.00 -1.00 0.00 0.00 59.36 58.21 3g4g h GLU 454 Cb 1.06 -0.15 -0.05 0.00 0.50 0.00 0.00 28.75 30.11 3g4g h GLU 454 CO 0.07 0.44 0.05 0.25 -1.00 0.00 0.00 179.01 178.82 3g4g n THR 455 N -4.81 2.52 -1.67 1.13 -2.24 -0.62 -5.02 114.28 103.57 3g4g n THR 455 Ca 0.25 -1.94 -0.46 0.00 -2.27 0.00 0.00 64.05 59.63 3g4g n THR 455 Cb 0.64 -0.29 -0.04 0.00 -2.10 0.00 0.00 70.33 68.54 3g4g n THR 455 CO 0.00 0.00 0.00 1.17 -0.57 0.00 0.00 175.07 175.67 3g4g n LYS 456 N -0.45 2.13 -4.96 -0.78 4.81 -0.71 -5.00 118.16 113.21 3g4g n LYS 456 Ca 0.28 0.77 -0.31 0.00 -0.87 0.00 0.00 58.31 58.18 3g4g n LYS 456 Cb 1.05 -2.51 -0.15 0.00 0.02 0.00 0.00 35.03 33.45 3g4g n LYS 456 CO 0.00 0.00 0.00 0.15 1.17 0.00 0.00 177.40 178.72 3g4g s LYS 457 N 0.54 1.94 0.02 1.64 1.02 -1.26 -5.09 119.74 118.55 3g4g s LYS 457 Ca 0.76 -1.04 -0.00 0.00 0.02 0.00 0.00 55.97 55.71 3g4g s LYS 457 Cb -0.67 -2.04 -0.02 0.00 -0.52 0.00 0.00 37.83 34.58 3g4g s LYS 457 CO 0.41 0.53 -0.03 0.14 -0.92 0.00 0.00 175.35 175.48 3g4g s VAL 458 N -0.78 0.12 1.12 3.17 -7.23 -1.26 -1.55 120.40 114.00 3g4g s VAL 458 Ca 0.12 -1.00 -0.15 0.00 -1.81 0.00 0.00 61.98 59.14 3g4g s VAL 458 Cb -0.10 -0.39 0.25 0.00 0.56 0.00 0.00 36.38 36.70 3g4g s VAL 458 CO 0.02 -0.55 1.07 0.42 -0.31 0.00 0.00 175.10 175.75 3g4g s THR 459 N -1.70 1.86 -1.87 5.32 -4.23 -0.12 -4.90 115.64 110.00 3g4g s THR 459 Ca -0.14 0.00 0.23 0.00 -1.18 0.00 0.00 61.69 60.61 3g4g s THR 459 Cb -0.08 -2.36 0.61 0.00 1.34 0.00 0.00 72.50 72.01 3g4g s THR 459 CO -0.02 0.00 1.76 -1.54 -0.54 0.00 0.00 174.62 174.28 3g4g n SER 460 N -4.62 0.00 -0.79 3.99 3.41 -1.26 -1.56 113.62 112.80 3g4g n SER 460 Ca 0.07 -0.57 0.08 0.00 -0.26 0.00 0.00 58.87 58.18 3g4g n SER 460 Cb 0.57 -0.07 0.16 0.00 -0.26 0.00 0.00 64.21 64.62 3g4g n SER 460 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 3g4g n SER 461 N -1.07 2.95 0.00 4.04 3.41 -1.26 -4.97 113.62 116.73 3g4g n SER 461 Ca 0.16 -1.89 0.00 0.00 -0.26 0.00 0.00 58.87 56.88 3g4g n SER 461 Cb 0.10 -0.22 0.00 0.00 -0.26 0.00 0.00 64.21 63.83 3g4g n SER 461 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3g4g n GLY 462 N 0.87 0.57 3.73 5.00 0.00 -0.60 -5.04 105.19 109.73 3g4g n GLY 462 Ca 0.14 -0.08 -0.39 0.00 0.00 0.00 0.00 46.02 45.69 3g4g n GLY 462 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3g4g s VAL 463 N -2.00 4.99 0.55 1.61 1.01 -1.26 -4.68 120.40 120.62 3g4g s VAL 463 Ca 0.00 1.35 -0.21 0.00 0.00 0.00 0.00 61.98 63.13 3g4g s VAL 463 Cb 0.00 -3.99 -0.06 0.00 0.00 0.00 0.00 36.38 32.33 3g4g s VAL 463 CO 0.00 0.32 1.15 -0.11 0.00 0.00 0.00 175.10 176.46 3g4g n LEU 464 N 3.39 4.40 -3.99 3.92 7.94 -0.00 -0.94 117.00 131.71 3g4g n LEU 464 Ca -0.03 0.92 -0.31 0.00 -1.11 0.00 0.00 56.01 55.47 3g4g n LEU 464 Cb 0.51 -1.47 -0.15 0.00 0.53 0.00 0.00 43.42 42.84 3g4g n LEU 464 CO 0.46 -1.22 -0.33 -0.22 -1.11 0.00 0.00 177.39 174.96 3g4g s LEU 465 N -2.48 4.44 -0.33 -1.96 2.96 -0.59 -4.78 118.68 115.94 3g4g s LEU 465 Ca 0.72 -2.07 -0.02 0.00 -0.22 0.00 0.00 54.13 52.54 3g4g s LEU 465 Cb -0.44 -1.54 0.07 0.00 0.50 0.00 0.00 46.19 44.78 3g4g s LEU 465 CO 0.49 -0.38 0.05 -0.76 -1.32 0.00 0.00 176.35 174.44 3g4g s LEU 466 N 0.99 4.29 -0.06 -0.68 1.43 -1.26 -4.59 118.68 118.80 3g4g s LEU 466 Ca 0.10 -1.52 0.00 0.00 -1.03 0.00 0.00 54.13 51.68 3g4g s LEU 466 Cb -0.19 -1.73 -0.26 0.00 0.03 0.00 0.00 46.19 44.04 3g4g s LEU 466 CO -0.10 -0.34 0.60 0.44 0.23 0.00 0.00 176.35 177.18 3g4g h ASP 467 N 7.98 0.29 -4.31 2.29 5.19 -1.97 -3.47 116.42 122.42 3g4g h ASP 467 Ca -0.18 -0.55 -0.50 0.00 -0.62 0.00 0.00 57.03 55.18 3g4g h ASP 467 Cb 1.05 -0.09 -0.22 0.00 0.18 0.00 0.00 39.33 40.25 3g4g h ASP 467 CO 0.57 1.49 -0.81 0.54 -3.12 0.00 0.00 179.24 177.91 3g4g s ASN 468 N -6.74 2.12 0.32 6.45 2.20 -1.26 -5.04 114.94 112.99 3g4g s ASN 468 Ca -0.13 -0.61 0.06 0.00 -0.94 0.00 0.00 52.86 51.24 3g4g s ASN 468 Cb 0.07 -0.11 0.87 0.00 -2.00 0.00 0.00 41.25 40.08 3g4g s ASN 468 CO 0.81 0.02 1.59 0.22 -2.94 0.00 0.00 177.10 176.80 3g4g h TYR 469 N 4.35 0.24 -0.13 1.54 3.20 -1.99 -0.16 116.97 124.02 3g4g h TYR 469 Ca -0.43 0.06 -0.09 0.00 3.14 0.00 0.00 58.73 61.41 3g4g h TYR 469 Cb 1.18 0.05 -0.01 0.00 1.54 0.00 0.00 36.73 39.49 3g4g h TYR 469 CO 0.60 -0.39 -0.32 1.03 -1.64 0.00 0.00 178.16 177.44 3g4g h SER 470 N 0.06 0.26 -0.13 -2.11 0.87 -1.99 -0.55 113.55 109.97 3g4g h SER 470 Ca 0.64 -0.09 -0.20 0.00 -1.23 0.00 0.00 61.79 60.91 3g4g h SER 470 Cb 1.42 -0.07 0.01 0.00 -0.44 0.00 0.00 62.40 63.32 3g4g h SER 470 CO -0.82 0.58 -0.69 0.44 -0.53 0.00 0.00 176.83 175.80 3g4g h ASP 471 N 0.23 0.83 0.09 6.23 3.32 -1.45 -2.79 116.42 122.87 3g4g h ASP 471 Ca 0.03 -0.64 -0.18 0.00 0.02 0.00 0.00 57.03 56.26 3g4g h ASP 471 Cb 0.69 -0.25 -0.00 0.00 0.22 0.00 0.00 39.33 39.99 3g4g h ASP 471 CO 0.05 1.34 -0.67 0.03 -1.72 0.00 0.00 179.24 178.27 3g4g h ARG 472 N 0.38 0.54 0.00 3.56 3.08 -1.15 -2.60 114.38 118.18 3g4g h ARG 472 Ca -0.05 -0.40 -0.18 0.00 0.07 0.00 0.00 59.98 59.43 3g4g h ARG 472 Cb 1.33 0.07 -0.03 0.00 0.08 0.00 0.00 29.97 31.43 3g4g h ARG 472 CO 0.14 1.02 -0.83 0.97 -1.07 0.00 0.00 179.97 180.20 3g4g h ILE 473 N 0.39 1.53 -0.08 2.04 6.09 -1.21 -2.67 117.51 123.60 3g4g h ILE 473 Ca -0.02 -2.93 -0.11 0.00 -1.37 0.00 0.00 64.86 60.44 3g4g h ILE 473 Cb 1.24 2.61 -0.01 0.00 0.47 0.00 0.00 36.82 41.12 3g4g h ILE 473 CO 0.12 0.82 -0.43 1.56 -3.07 0.00 0.00 178.15 177.15 3g4g h GLN 474 N 0.00 0.18 -0.09 2.19 4.20 -1.46 -0.66 115.11 119.47 3g4g h GLN 474 Ca -0.01 -0.09 -0.17 0.00 0.06 0.00 0.00 58.65 58.44 3g4g h GLN 474 Cb 1.54 -0.00 -0.01 0.00 0.30 0.00 0.00 27.48 29.32 3g4g h GLN 474 CO 0.11 0.58 -0.68 0.28 -0.67 0.00 0.00 178.83 178.45 3g4g h VAL 475 N 0.15 1.37 0.01 -0.54 2.07 -1.35 -2.06 116.25 115.91 3g4g h VAL 475 Ca 0.01 -2.07 -0.25 0.00 0.82 0.00 0.00 66.70 65.21 3g4g h VAL 475 Cb 0.83 2.05 0.01 0.00 -1.52 0.00 0.00 31.29 32.66 3g4g h VAL 475 CO 0.06 0.62 -1.02 -0.07 0.02 0.00 0.00 177.57 177.19 3g4g h LEU 476 N 0.27 0.77 -0.41 2.57 3.38 -1.36 -0.80 115.31 119.74 3g4g h LEU 476 Ca -0.02 -0.63 0.05 0.00 0.09 0.00 0.00 57.88 57.37 3g4g h LEU 476 Cb 1.24 -0.24 -0.04 0.00 0.09 0.00 0.00 40.66 41.71 3g4g h LEU 476 CO 0.12 1.43 0.14 1.56 0.09 0.00 0.00 178.44 181.78 3g4g h GLN 477 N 0.33 0.30 -0.06 1.13 4.20 -1.12 -1.87 115.11 118.02 3g4g h GLN 477 Ca -0.11 -0.02 -0.16 0.00 0.06 0.00 0.00 58.65 58.41 3g4g h GLN 477 Cb 1.67 -0.07 -0.01 0.00 0.30 0.00 0.00 27.48 29.37 3g4g h GLN 477 CO 0.19 0.20 -0.69 -0.91 -0.67 0.00 0.00 178.83 176.95 3g4g h ASN 478 N 0.31 0.32 -0.59 1.46 2.35 -1.28 -1.84 115.58 116.31 3g4g h ASN 478 Ca 0.19 -0.20 -0.02 0.00 -0.55 0.00 0.00 56.30 55.72 3g4g h ASN 478 Cb 0.17 -0.09 -0.03 0.00 0.05 0.00 0.00 38.32 38.42 3g4g h ASN 478 CO -0.19 0.91 0.29 -0.03 -1.65 0.00 0.00 177.43 176.76 3g4g h MET 479 N 0.19 0.85 0.00 0.81 4.05 -0.91 -0.25 114.93 119.66 3g4g h MET 479 Ca -0.02 -0.12 -0.06 0.00 -0.28 0.00 0.00 59.70 59.22 3g4g h MET 479 Cb 1.23 -0.15 -0.01 0.00 -0.80 0.00 0.00 31.60 31.87 3g4g h MET 479 CO 0.11 0.68 -0.39 0.28 0.23 0.00 0.00 176.91 177.82 3g4g h VAL 480 N 0.80 0.43 -0.30 -5.77 2.07 -1.25 -2.45 116.25 109.79 3g4g h VAL 480 Ca 0.20 -1.62 -0.18 0.00 0.82 0.00 0.00 66.70 65.93 3g4g h VAL 480 Cb 0.11 2.16 -0.00 0.00 -1.52 0.00 0.00 31.29 32.04 3g4g h VAL 480 CO -0.03 0.24 -0.51 -0.74 0.02 0.00 0.00 177.57 176.56 3g4g h HIS 481 N 0.00 1.04 -0.45 1.57 6.17 -1.14 -1.30 115.15 121.05 3g4g h HIS 481 Ca -0.01 -0.36 -0.03 0.00 0.71 0.00 0.00 60.37 60.68 3g4g h HIS 481 Cb 1.21 -0.20 -0.02 0.00 2.52 0.00 0.00 27.41 30.92 3g4g h HIS 481 CO 0.00 1.17 0.17 0.00 0.71 0.00 0.00 177.93 179.99 3g4g h ALA 483 N 1.02 0.98 0.00 0.00 0.00 -1.41 -0.94 119.26 118.91 3g4g h ALA 483 Ca 0.15 -0.16 -0.03 0.00 0.00 0.00 0.00 54.91 54.86 3g4g h ALA 483 Cb 0.20 -0.30 -0.00 0.00 0.00 0.00 0.00 17.79 17.69 3g4g h ALA 483 CO -0.01 0.56 -0.17 0.22 0.00 0.00 0.00 179.25 179.85 3g4g h ASP 484 N 1.07 0.00 -0.61 0.00 3.58 -1.10 -2.95 116.42 116.41 3g4g h ASP 484 Ca 0.26 0.00 -0.40 0.00 0.42 0.00 0.00 57.03 57.31 3g4g h ASP 484 Cb 0.14 0.00 -0.25 0.00 1.72 0.00 0.00 39.33 40.94 3g4g h ASP 484 CO -0.03 0.17 -0.15 0.18 -2.88 0.00 0.00 179.24 176.53 3g4g n LEU 485 N -4.29 5.10 -0.34 2.28 4.77 -0.62 -4.67 117.00 119.23 3g4g n LEU 485 Ca -0.02 -4.21 0.12 0.00 -0.03 0.00 0.00 56.01 51.86 3g4g n LEU 485 Cb 0.23 -0.60 0.13 0.00 -2.33 0.00 0.00 43.42 40.84 3g4g n LEU 485 CO 0.36 1.60 0.39 -1.54 -1.33 0.00 0.00 177.39 176.87 3g4g n SER 486 N -0.95 1.52 -0.30 -1.43 3.41 -0.45 -4.54 113.62 110.89 3g4g n SER 486 Ca 0.43 -1.20 0.02 0.00 -0.26 0.00 0.00 58.87 57.86 3g4g n SER 486 Cb 0.95 0.40 0.16 0.00 -0.26 0.00 0.00 64.21 65.46 3g4g n SER 486 CO 0.00 0.00 0.00 0.78 -0.16 0.00 0.00 175.04 175.66 3g4g h ASN 487 N 1.68 0.72 0.49 4.04 -0.26 -1.83 0.80 115.58 121.23 3g4g h ASN 487 Ca 0.00 0.04 0.00 0.00 -0.56 0.00 0.00 56.30 55.78 3g4g h ASN 487 Cb 0.64 -0.11 0.00 0.00 -1.06 0.00 0.00 38.32 37.79 3g4g h ASN 487 CO 0.00 0.43 0.00 -2.65 -1.06 0.00 0.00 177.43 174.15 3g4g n PRO 488 N -4.70 0.33 0.00 0.81 -0.02 -1.26 -2.51 135.00 127.64 3g4g n PRO 488 Ca 0.13 0.05 0.13 0.00 -2.02 0.00 0.00 63.50 61.80 3g4g n PRO 488 Cb 0.24 -1.50 0.37 0.00 -0.02 0.00 0.00 33.50 32.59 3g4g n PRO 488 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 3g4g n THR 489 N -1.30 0.00 -3.43 3.45 -2.24 0.27 -4.13 114.28 106.90 3g4g n THR 489 Ca 0.11 -0.31 -0.22 0.00 -2.27 0.00 0.00 64.05 61.37 3g4g n THR 489 Cb 0.20 0.80 -0.01 0.00 -2.10 0.00 0.00 70.33 69.23 3g4g n THR 489 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 3g4g s LYS 490 N -2.06 3.28 0.22 -0.78 -0.14 -1.04 -4.53 119.74 114.68 3g4g s LYS 490 Ca 0.33 -0.63 -0.31 0.00 -1.36 0.00 0.00 55.97 54.00 3g4g s LYS 490 Cb 0.20 -2.73 -0.15 0.00 -1.68 0.00 0.00 37.83 33.48 3g4g s LYS 490 CO 0.35 0.08 1.10 -2.30 -0.76 0.00 0.00 175.35 173.82 3g4g n PRO 491 N -1.74 1.22 -0.29 -1.68 -0.02 -1.26 -4.56 135.00 126.67 3g4g n PRO 491 Ca -0.03 0.43 0.11 0.00 -2.02 0.00 0.00 63.50 61.99 3g4g n PRO 491 Cb 0.57 -1.87 0.25 0.00 -0.02 0.00 0.00 33.50 32.43 3g4g n PRO 491 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 3g4g h LEU 492 N 2.84 -0.17 -0.91 2.45 5.85 -1.94 0.27 115.31 123.70 3g4g h LEU 492 Ca -0.41 0.21 0.21 0.00 0.84 0.00 0.00 57.88 58.73 3g4g h LEU 492 Cb 1.34 0.32 -0.12 0.00 0.37 0.00 0.00 40.66 42.57 3g4g h LEU 492 CO 0.67 -0.19 0.44 0.06 -0.34 0.00 0.00 178.44 179.08 3g4g h GLN 493 N 0.15 0.46 0.00 1.25 3.07 -2.01 -1.23 115.11 116.80 3g4g h GLN 493 Ca 0.51 -0.03 -0.00 0.00 0.09 0.00 0.00 58.65 59.23 3g4g h GLN 493 Cb 1.01 -0.10 0.00 0.00 0.08 0.00 0.00 27.48 28.46 3g4g h GLN 493 CO -0.69 0.30 -0.00 -0.07 0.09 0.00 0.00 178.83 178.46 3g4g h LEU 494 N 0.47 -0.00 -0.87 0.06 3.38 -0.84 -3.31 115.31 114.19 3g4g h LEU 494 Ca 0.56 -0.87 0.13 0.00 0.09 0.00 0.00 57.88 57.80 3g4g h LEU 494 Cb 1.04 0.00 -0.09 0.00 0.09 0.00 0.00 40.66 41.70 3g4g h LEU 494 CO -0.49 0.87 0.49 0.22 0.09 0.00 0.00 178.44 179.61 3g4g h TYR 495 N -0.87 0.87 -0.57 1.13 3.20 -0.86 -1.52 116.97 118.36 3g4g h TYR 495 Ca -0.00 0.03 -0.03 0.00 3.14 0.00 0.00 58.73 61.87 3g4g h TYR 495 Cb 0.87 -0.26 -0.03 0.00 1.54 0.00 0.00 36.73 38.85 3g4g h TYR 495 CO 0.23 0.27 0.23 -0.09 -1.64 0.00 0.00 178.16 177.17 3g4g h ARG 496 N 0.73 0.81 -0.11 1.82 2.43 -1.35 -1.70 114.38 117.02 3g4g h ARG 496 Ca 0.45 -0.12 -0.20 0.00 -0.81 0.00 0.00 59.98 59.31 3g4g h ARG 496 Cb 0.56 -0.15 0.00 0.00 -0.42 0.00 0.00 29.97 29.96 3g4g h ARG 496 CO -0.31 0.67 -0.75 1.96 -1.51 0.00 0.00 179.97 180.02 3g4g h GLN 497 N 0.81 0.55 -0.80 0.20 4.20 -1.38 -1.59 115.11 117.10 3g4g h GLN 497 Ca 0.19 -0.45 -0.04 0.00 0.06 0.00 0.00 58.65 58.41 3g4g h GLN 497 Cb 0.15 0.09 -0.04 0.00 0.30 0.00 0.00 27.48 27.99 3g4g h GLN 497 CO -0.02 1.08 0.35 -1.49 -0.67 0.00 0.00 178.83 178.07 3g4g h TRP 498 N 0.38 1.19 -0.48 2.96 -0.00 -1.22 -1.94 115.95 116.83 3g4g h TRP 498 Ca -0.04 -0.08 -0.02 0.00 -0.00 0.00 0.00 58.89 58.75 3g4g h TRP 498 Cb 1.34 -0.36 -0.02 0.00 -0.00 0.00 0.00 29.16 30.12 3g4g h TRP 498 CO 0.06 0.89 0.21 1.15 -0.00 0.00 0.00 178.44 180.75 3g4g h THR 499 N 1.15 1.20 -0.50 1.49 2.02 -1.15 0.78 112.91 117.90 3g4g h THR 499 Ca 0.27 -0.61 0.03 0.00 0.77 0.00 0.00 66.41 66.88 3g4g h THR 499 Cb 0.18 0.71 -0.04 0.00 -1.74 0.00 0.00 68.15 67.26 3g4g h THR 499 CO -0.03 0.23 0.27 0.44 0.37 0.00 0.00 175.52 176.81 3g4g h ASP 500 N 0.64 0.41 -0.35 4.18 3.32 -1.21 -1.24 116.42 122.17 3g4g h ASP 500 Ca 0.16 0.02 -0.06 0.00 0.02 0.00 0.00 57.03 57.17 3g4g h ASP 500 Cb 0.17 -0.06 -0.01 0.00 0.22 0.00 0.00 39.33 39.64 3g4g h ASP 500 CO -0.02 0.29 -0.01 0.03 -1.72 0.00 0.00 179.24 177.82 3g4g h ARG 501 N 0.53 0.63 -0.36 3.56 3.08 -0.96 -1.08 114.38 119.78 3g4g h ARG 501 Ca 0.21 -0.20 -0.02 0.00 0.07 0.00 0.00 59.98 60.03 3g4g h ARG 501 Cb 0.08 -0.05 -0.02 0.00 0.08 0.00 0.00 29.97 30.06 3g4g h ARG 501 CO -0.13 0.75 0.13 0.97 -1.07 0.00 0.00 179.97 180.62 3g4g h ILE 502 N 0.44 1.20 -0.78 2.04 6.09 -0.78 -1.58 117.51 124.14 3g4g h ILE 502 Ca 0.10 -0.64 -0.03 0.00 -1.37 0.00 0.00 64.86 62.92 3g4g h ILE 502 Cb 0.47 0.94 -0.04 0.00 0.47 0.00 0.00 36.82 38.66 3g4g h ILE 502 CO 0.02 0.22 0.37 0.24 -3.07 0.00 0.00 178.15 175.93 3g4g h MET 503 N 0.44 1.12 -0.55 2.19 2.86 -1.17 0.13 114.93 119.95 3g4g h MET 503 Ca 0.12 -0.16 -0.03 0.00 -2.06 0.00 0.00 59.70 57.56 3g4g h MET 503 Cb 0.22 -0.20 -0.02 0.00 0.06 0.00 0.00 31.60 31.65 3g4g h MET 503 CO -0.01 0.86 0.21 1.49 1.06 0.00 0.00 176.91 180.53 3g4g h GLU 504 N 1.11 0.83 -0.50 1.72 4.81 -1.03 0.69 114.58 122.20 3g4g h GLU 504 Ca 0.27 -0.16 -0.07 0.00 -0.13 0.00 0.00 59.36 59.27 3g4g h GLU 504 Cb 0.12 -0.13 -0.02 0.00 0.63 0.00 0.00 28.75 29.35 3g4g h GLU 504 CO -0.03 0.73 0.05 1.49 -0.73 0.00 0.00 179.01 180.52 3g4g h GLU 505 N 0.76 0.85 -0.69 1.92 4.81 -0.88 -2.41 114.58 118.93 3g4g h GLU 505 Ca 0.18 -0.24 -0.01 0.00 -0.13 0.00 0.00 59.36 59.16 3g4g h GLU 505 Cb 0.22 -0.09 -0.03 0.00 0.63 0.00 0.00 28.75 29.48 3g4g h GLU 505 CO -0.01 0.86 0.38 0.74 -0.73 0.00 0.00 179.01 180.24 3g4g h PHE 506 N 0.72 0.95 -0.23 0.92 0.04 -0.47 -2.51 116.94 116.36 3g4g h PHE 506 Ca 0.15 -0.02 -0.07 0.00 2.80 0.00 0.00 57.97 60.82 3g4g h PHE 506 Cb 0.44 -0.30 -0.01 0.00 2.20 0.00 0.00 35.95 38.27 3g4g h PHE 506 CO 0.03 0.68 -0.17 0.74 -0.60 0.00 0.00 178.31 178.99 3g4g h PHE 507 N 0.95 0.43 -0.04 -0.55 0.04 -0.77 -0.71 116.94 116.30 3g4g h PHE 507 Ca 0.24 -0.07 -0.12 0.00 2.80 0.00 0.00 57.97 60.83 3g4g h PHE 507 Cb 0.04 -0.12 -0.01 0.00 2.20 0.00 0.00 35.95 38.06 3g4g h PHE 507 CO -0.00 0.55 -0.53 0.00 -0.60 0.00 0.00 178.31 177.73 3g4g h ARG 508 N 0.37 0.11 -0.08 1.51 3.08 -1.18 0.08 114.38 118.28 3g4g h ARG 508 Ca 0.07 -0.07 -0.01 0.00 0.07 0.00 0.00 59.98 60.04 3g4g h ARG 508 Cb 0.51 0.01 -0.00 0.00 0.08 0.00 0.00 29.97 30.56 3g4g h ARG 508 CO 0.03 0.61 -0.00 0.37 -1.07 0.00 0.00 179.97 179.91 3g4g h GLN 509 N 0.09 0.15 -0.96 0.04 4.15 -0.99 -2.58 115.11 115.01 3g4g h GLN 509 Ca -0.00 -0.05 0.18 0.00 0.77 0.00 0.00 58.65 59.55 3g4g h GLN 509 Cb 0.96 -0.01 -0.09 0.00 0.21 0.00 0.00 27.48 28.55 3g4g h GLN 509 CO 0.07 0.42 0.61 0.78 -1.93 0.00 0.00 178.83 178.79 3g4g h GLY 510 N -0.14 1.42 1.44 2.39 0.00 -0.93 0.83 103.07 108.09 3g4g h GLY 510 Ca 0.02 -0.31 -0.14 0.00 0.00 0.00 0.00 47.33 46.90 3g4g h GLY 510 CO 0.00 0.01 -0.42 -0.55 0.00 0.00 0.00 176.54 175.59 3g4g h ASP 511 N 0.69 0.65 -0.61 0.19 3.32 -0.87 -1.76 116.42 118.03 3g4g h ASP 511 Ca 0.52 -0.30 -0.08 0.00 0.02 0.00 0.00 57.03 57.18 3g4g h ASP 511 Cb 0.88 -0.18 -0.02 0.00 0.22 0.00 0.00 39.33 40.22 3g4g h ASP 511 CO -0.28 0.99 0.06 0.03 -1.72 0.00 0.00 179.24 178.32 3g4g h ARG 512 N 0.50 1.05 -0.72 3.56 3.08 -0.68 -2.31 114.38 118.85 3g4g h ARG 512 Ca 0.04 -0.30 -0.06 0.00 0.07 0.00 0.00 59.98 59.72 3g4g h ARG 512 Cb 0.94 -0.11 -0.03 0.00 0.08 0.00 0.00 29.97 30.85 3g4g h ARG 512 CO 0.08 1.00 0.21 0.93 -1.07 0.00 0.00 179.97 181.13 3g4g h GLU 513 N 0.95 1.13 -0.63 0.04 5.08 -0.69 -2.15 114.58 118.31 3g4g h GLU 513 Ca 0.18 -0.25 -0.08 0.00 -1.00 0.00 0.00 59.36 58.21 3g4g h GLU 513 Cb 0.49 -0.16 -0.02 0.00 0.50 0.00 0.00 28.75 29.55 3g4g h GLU 513 CO 0.02 0.97 0.08 -0.09 -1.00 0.00 0.00 179.01 178.98 3g4g h ARG 514 N 1.08 1.07 -0.15 2.33 2.43 -1.24 -0.07 114.38 119.82 3g4g h ARG 514 Ca 0.23 -0.30 -0.09 0.00 -0.81 0.00 0.00 59.98 59.01 3g4g h ARG 514 Cb 0.32 -0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 29.74 3g4g h ARG 514 CO -0.01 1.00 -0.29 0.93 -1.51 0.00 0.00 179.97 180.10 3g4g h GLU 515 N 0.98 0.29 0.00 0.20 5.08 -1.23 -2.38 114.58 117.51 3g4g h GLU 515 Ca 0.19 -0.11 0.00 0.00 -1.00 0.00 0.00 59.36 58.44 3g4g h GLU 515 Cb 0.47 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.70 3g4g h GLU 515 CO 0.02 0.56 0.00 0.54 -1.00 0.00 0.00 179.01 179.13 3g4g n ARG 516 N -4.12 0.17 -0.69 2.33 1.74 -0.82 -4.90 116.66 110.36 3g4g n ARG 516 Ca -0.01 0.21 0.00 0.00 -0.77 0.00 0.00 57.85 57.29 3g4g n ARG 516 Cb 0.40 -1.73 0.00 0.00 -1.02 0.00 0.00 32.46 30.11 3g4g n ARG 516 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3g4g n GLY 517 N 0.97 0.63 3.92 -0.13 0.00 -0.88 -5.05 105.19 104.66 3g4g n GLY 517 Ca 0.05 -0.24 -0.26 0.00 0.00 0.00 0.00 46.02 45.57 3g4g n GLY 517 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3g4g s MET 518 N -0.64 2.85 0.21 1.61 -1.94 -0.09 -5.01 119.30 116.28 3g4g s MET 518 Ca 0.00 -0.10 -0.30 0.00 -1.71 0.00 0.00 55.69 53.58 3g4g s MET 518 Cb 0.00 -2.30 -0.09 0.00 2.01 0.00 0.00 34.83 34.46 3g4g s MET 518 CO 0.00 -0.71 1.24 -1.21 -0.01 0.00 0.00 175.02 174.33 3g4g s GLU 519 N -4.97 4.45 0.11 2.03 0.41 -1.26 -4.37 118.70 115.10 3g4g s GLU 519 Ca 0.54 1.96 -0.30 0.00 -0.41 0.00 0.00 54.97 56.76 3g4g s GLU 519 Cb -0.10 -3.21 -0.06 0.00 -1.78 0.00 0.00 34.13 28.98 3g4g s GLU 519 CO 0.44 -0.14 0.98 0.42 -0.49 0.00 0.00 175.26 176.47 3g4g s ILE 520 N -0.13 4.48 0.63 -1.63 1.01 -1.26 -4.92 121.20 119.38 3g4g s ILE 520 Ca 0.53 2.03 -0.17 0.00 0.00 0.00 0.00 60.65 63.05 3g4g s ILE 520 Cb -0.34 -4.30 -0.02 0.00 0.01 0.00 0.00 42.46 37.81 3g4g s ILE 520 CO 0.39 0.30 1.13 -0.44 0.00 0.00 0.00 174.94 176.32 3g4g s SER 521 N 0.09 5.19 0.17 3.58 0.01 -1.26 -4.92 113.70 116.56 3g4g s SER 521 Ca 0.48 2.12 -0.33 0.00 1.31 0.00 0.00 55.95 59.53 3g4g s SER 521 Cb -0.24 -2.57 -0.16 0.00 0.21 0.00 0.00 66.02 63.27 3g4g s SER 521 CO 0.30 -1.58 1.18 -2.65 0.41 0.00 0.00 173.24 170.90 3g4g n PRO 522 N -2.06 1.22 -0.97 12.44 -0.02 -1.26 -1.67 135.00 142.68 3g4g n PRO 522 Ca 0.11 0.44 0.00 0.00 -2.02 0.00 0.00 63.50 62.03 3g4g n PRO 522 Cb 0.51 -1.95 0.00 0.00 -0.02 0.00 0.00 33.50 32.04 3g4g n PRO 522 CO 0.00 0.00 0.00 -1.33 1.98 0.00 0.00 175.50 176.15 3g4g n MET 523 N 1.79 -0.80 0.00 -0.52 2.81 -1.26 -4.87 117.12 114.27 3g4g n MET 523 Ca 0.15 0.20 0.09 0.00 -1.81 0.00 0.00 57.70 56.33 3g4g n MET 523 Cb 0.25 -3.86 0.07 0.00 -0.71 0.00 0.00 33.22 28.97 3g4g n MET 523 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 3g4g s ASP 525 N -1.49 5.84 0.54 0.00 -1.08 -1.26 -3.81 116.67 115.42 3g4g s ASP 525 Ca 0.20 -0.73 0.32 0.00 -0.52 0.00 0.00 52.55 51.82 3g4g s ASP 525 Cb 0.15 -2.07 1.47 0.00 -1.46 0.00 0.00 42.92 41.00 3g4g s ASP 525 CO 0.23 -0.32 2.04 0.07 0.52 0.00 0.00 175.17 177.70 3g4g h LYS 526 N 8.47 0.00 -0.01 4.34 2.10 -1.91 -2.45 116.57 127.11 3g4g h LYS 526 Ca -0.29 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.36 3g4g h LYS 526 Cb 1.13 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.46 3g4g h LYS 526 CO 0.66 0.08 -0.18 0.72 -2.00 0.00 0.00 179.45 178.73 3g4g n HIS 527 N -3.31 0.00 -2.82 0.07 8.25 -1.26 -4.53 115.22 111.62 3g4g n HIS 527 Ca -0.01 0.00 -0.10 0.00 -0.26 0.00 0.00 57.72 57.35 3g4g n HIS 527 Cb 0.28 -0.16 0.03 0.00 1.12 0.00 0.00 29.99 31.26 3g4g n HIS 527 CO 0.00 0.00 0.00 -1.71 0.64 0.00 0.00 176.34 175.27 3g4g n ASN 528 N -0.81 -2.50 -3.97 0.41 5.15 -0.93 -5.13 115.26 107.49 3g4g n ASN 528 Ca 0.13 -3.18 -0.23 0.00 -0.60 0.00 0.00 54.58 50.70 3g4g n ASN 528 Cb 0.31 1.46 -0.17 0.00 -0.53 0.00 0.00 39.78 40.85 3g4g n ASN 528 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3g4g s ALA 529 N 0.45 1.08 -0.75 5.20 0.00 -1.20 -4.73 121.76 121.80 3g4g s ALA 529 Ca 0.32 -0.31 -0.03 0.00 0.00 0.00 0.00 51.96 51.94 3g4g s ALA 529 Cb 0.20 -0.56 0.19 0.00 0.00 0.00 0.00 23.12 22.95 3g4g s ALA 529 CO -0.21 0.01 0.60 -1.12 0.00 0.00 0.00 175.76 175.04 3g4g s SER 530 N 0.86 5.66 0.18 0.00 0.01 -1.26 -4.94 113.70 114.22 3g4g s SER 530 Ca -0.11 -3.17 -0.07 0.00 1.31 0.00 0.00 55.95 53.90 3g4g s SER 530 Cb -0.15 -1.91 0.09 0.00 0.21 0.00 0.00 66.02 64.26 3g4g s SER 530 CO 0.01 -0.32 1.58 0.58 0.41 0.00 0.00 173.24 175.51 3g4g h VAL 531 N 4.77 1.27 0.08 3.43 2.07 -1.98 -1.27 116.25 124.61 3g4g h VAL 531 Ca 0.06 -1.39 -0.00 0.00 0.82 0.00 0.00 66.70 66.19 3g4g h VAL 531 Cb 0.91 1.20 0.00 0.00 -1.52 0.00 0.00 31.29 31.88 3g4g h VAL 531 CO 0.77 0.47 -0.04 -0.33 0.02 0.00 0.00 177.57 178.46 3g4g h GLU 532 N 0.76 -0.10 0.59 1.57 3.07 -1.92 -1.79 114.58 116.76 3g4g h GLU 532 Ca 0.10 0.01 -0.02 0.00 -0.50 0.00 0.00 59.36 58.94 3g4g h GLU 532 Cb 0.79 0.02 -0.01 0.00 -0.84 0.00 0.00 28.75 28.72 3g4g h GLU 532 CO 0.07 0.13 -0.38 0.87 -1.40 0.00 0.00 179.01 178.30 3g4g h LYS 533 N -0.31 -0.88 -1.00 2.33 1.57 -1.83 -2.72 116.57 113.72 3g4g h LYS 533 Ca -0.01 0.06 0.32 0.00 -1.87 0.00 0.00 60.65 59.15 3g4g h LYS 533 Cb 0.27 0.20 -0.15 0.00 0.08 0.00 0.00 32.23 32.63 3g4g h LYS 533 CO 0.02 -0.59 0.56 0.66 -0.57 0.00 0.00 179.45 179.53 3g4g h SER 534 N -0.92 0.50 0.64 0.86 4.64 -1.17 -0.57 113.55 117.53 3g4g h SER 534 Ca -0.07 0.19 -0.13 0.00 -0.47 0.00 0.00 61.79 61.31 3g4g h SER 534 Cb 0.75 0.14 -0.02 0.00 -0.31 0.00 0.00 62.40 62.96 3g4g h SER 534 CO 0.06 -0.14 -0.61 1.56 -0.87 0.00 0.00 176.83 176.83 3g4g h GLN 535 N 0.32 0.00 -0.01 4.77 1.08 -1.01 -0.98 115.11 119.28 3g4g h GLN 535 Ca 0.73 0.00 -0.22 0.00 -1.45 0.00 0.00 58.65 57.71 3g4g h GLN 535 Cb 1.66 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 29.10 3g4g h GLN 535 CO -0.61 0.61 -0.91 0.28 -0.95 0.00 0.00 178.83 177.25 3g4g h VAL 536 N 0.00 1.40 -0.19 -0.54 2.07 -0.97 -2.39 116.25 115.64 3g4g h VAL 536 Ca -0.01 -2.42 -0.14 0.00 0.82 0.00 0.00 66.70 64.95 3g4g h VAL 536 Cb 1.10 2.39 0.00 0.00 -1.52 0.00 0.00 31.29 33.25 3g4g h VAL 536 CO 0.08 0.72 -0.43 1.23 0.02 0.00 0.00 177.57 179.19 3g4g h GLY 537 N 1.28 0.68 0.20 2.17 0.00 -1.28 -2.23 103.07 103.89 3g4g h GLY 537 Ca -0.07 -0.84 0.08 0.00 0.00 0.00 0.00 47.33 46.51 3g4g h GLY 537 CO 0.16 0.75 -0.06 -2.75 0.00 0.00 0.00 176.54 174.63 3g4g h PHE 538 N 0.30 -0.15 -0.25 5.60 3.57 -1.22 -0.18 116.94 124.61 3g4g h PHE 538 Ca -0.00 0.04 -0.07 0.00 3.53 0.00 0.00 57.97 61.46 3g4g h PHE 538 Cb 1.04 0.13 -0.01 0.00 2.79 0.00 0.00 35.95 39.91 3g4g h PHE 538 CO 0.09 -0.15 -0.12 0.82 -2.23 0.00 0.00 178.31 176.72 3g4g h ILE 539 N 0.04 1.30 -0.40 1.41 2.04 -1.46 -1.09 117.51 119.35 3g4g h ILE 539 Ca 0.21 -1.20 -0.15 0.00 1.00 0.00 0.00 64.86 64.72 3g4g h ILE 539 Cb 0.32 1.55 -0.01 0.00 -0.74 0.00 0.00 36.82 37.93 3g4g h ILE 539 CO -0.41 0.38 -0.33 0.44 0.00 0.00 0.00 178.15 178.22 3g4g h ASP 540 N 0.26 0.97 0.19 1.72 3.32 -1.24 0.37 116.42 122.00 3g4g h ASP 540 Ca 0.06 -0.42 0.00 0.00 0.02 0.00 0.00 57.03 56.69 3g4g h ASP 540 Cb 0.63 -0.27 0.00 0.00 0.22 0.00 0.00 39.33 39.91 3g4g h ASP 540 CO 0.04 1.20 -1.45 -1.22 -1.72 0.00 0.00 179.24 176.09 3g4g n TYR 541 N -4.07 0.14 0.08 4.55 4.02 -0.09 -4.45 117.16 117.34 3g4g n TYR 541 Ca -0.01 0.04 0.00 0.00 -0.01 0.00 0.00 57.90 57.92 3g4g n TYR 541 Cb 0.52 -0.41 0.00 0.00 -0.02 0.00 0.00 39.34 39.43 3g4g n TYR 541 CO 0.00 0.00 0.00 -0.89 -1.01 0.00 0.00 176.86 174.96 3g4g n ILE 542 N -2.04 0.31 -0.01 -0.72 5.41 -0.58 -4.82 119.36 116.91 3g4g n ILE 542 Ca -0.00 0.10 -0.17 0.00 1.00 0.00 0.00 62.75 63.68 3g4g n ILE 542 Cb 0.48 -0.89 -0.10 0.00 -0.71 0.00 0.00 39.64 38.42 3g4g n ILE 542 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 176.55 177.13 3g4g h VAL 543 N 0.00 1.40 -0.18 1.39 2.07 -1.19 -2.91 116.25 116.83 3g4g h VAL 543 Ca 0.00 -1.96 -0.18 0.00 0.82 0.00 0.00 66.70 65.38 3g4g h VAL 543 Cb 0.12 2.41 0.01 0.00 -1.52 0.00 0.00 31.29 32.31 3g4g h VAL 543 CO 0.00 0.58 -0.59 -0.74 0.02 0.00 0.00 177.57 176.84 3g4g h HIS 544 N -0.00 0.94 -0.99 1.57 -0.00 -0.50 -1.20 115.15 114.97 3g4g h HIS 544 Ca -0.06 -0.39 0.02 0.00 -0.00 0.00 0.00 60.37 59.95 3g4g h HIS 544 Cb 1.24 -0.16 -0.05 0.00 -0.00 0.00 0.00 27.41 28.44 3g4g h HIS 544 CO 0.13 1.19 0.65 -1.35 -0.00 0.00 0.00 177.93 178.56 3g4g h PRO 545 N 0.42 1.26 0.38 5.26 0.11 -1.74 0.91 132.00 138.61 3g4g h PRO 545 Ca -0.02 -0.08 -0.02 0.00 0.11 0.00 0.00 66.00 65.99 3g4g h PRO 545 Cb 1.22 -0.28 0.00 0.00 0.11 0.00 0.00 31.00 32.05 3g4g h PRO 545 CO 0.13 0.84 -0.18 1.25 -0.21 0.00 0.00 178.00 179.82 3g4g h LEU 546 N 1.30 -0.43 -0.68 2.35 5.85 -1.40 -2.79 115.31 119.52 3g4g h LEU 546 Ca 0.38 -0.10 -0.14 0.00 0.84 0.00 0.00 57.88 58.86 3g4g h LEU 546 Cb -0.08 0.11 -0.01 0.00 0.37 0.00 0.00 40.66 41.05 3g4g h LEU 546 CO -0.10 -0.14 -0.61 -0.50 -0.34 0.00 0.00 178.44 176.75 3g4g h TRP 547 N -0.73 0.22 -0.82 1.25 4.06 -1.14 -1.11 115.95 117.68 3g4g h TRP 547 Ca -0.05 -0.08 0.06 0.00 2.06 0.00 0.00 58.89 60.87 3g4g h TRP 547 Cb 0.50 -0.04 -0.06 0.00 -1.00 0.00 0.00 29.16 28.57 3g4g h TRP 547 CO -0.00 0.74 0.50 1.49 -3.56 0.00 0.00 178.44 177.61 3g4g h GLU 548 N 0.12 0.89 -0.25 0.49 4.81 -0.90 0.76 114.58 120.50 3g4g h GLU 548 Ca -0.01 -0.05 -0.18 0.00 -0.13 0.00 0.00 59.36 58.98 3g4g h GLU 548 Cb 1.11 -0.20 -0.00 0.00 0.63 0.00 0.00 28.75 30.29 3g4g h GLU 548 CO 0.09 0.59 -0.57 1.15 -0.73 0.00 0.00 179.01 179.54 3g4g h THR 549 N 0.92 1.29 -0.69 0.32 2.02 -1.15 -2.15 112.91 113.47 3g4g h THR 549 Ca 0.36 -1.78 -0.07 0.00 0.77 0.00 0.00 66.41 65.69 3g4g h THR 549 Cb 0.16 1.70 -0.03 0.00 -1.74 0.00 0.00 68.15 68.24 3g4g h THR 549 CO -0.17 0.57 0.14 -0.25 0.37 0.00 0.00 175.52 176.18 3g4g h TRP 550 N 0.60 1.18 -0.82 3.16 2.91 -1.08 -2.31 115.95 119.60 3g4g h TRP 550 Ca 0.01 -0.15 0.00 0.00 1.13 0.00 0.00 58.89 59.88 3g4g h TRP 550 Cb 1.17 -0.33 -0.04 0.00 -0.51 0.00 0.00 29.16 29.45 3g4g h TRP 550 CO 0.07 0.97 0.52 0.00 -1.03 0.00 0.00 178.44 178.97 3g4g h ALA 551 N 1.07 1.05 -0.73 2.65 0.00 -0.71 -1.25 119.26 121.33 3g4g h ALA 551 Ca 0.21 -0.07 0.08 0.00 0.00 0.00 0.00 54.91 55.13 3g4g h ALA 551 Cb 0.41 -0.33 -0.07 0.00 0.00 0.00 0.00 17.79 17.80 3g4g h ALA 551 CO 0.01 0.48 0.40 -0.44 0.00 0.00 0.00 179.25 179.70 3g4g h ASP 552 N 1.12 0.57 -0.30 0.00 5.19 -1.09 0.34 116.42 122.24 3g4g h ASP 552 Ca 0.30 0.04 -0.02 0.00 -0.62 0.00 0.00 57.03 56.73 3g4g h ASP 552 Cb -0.09 -0.06 -0.01 0.00 0.18 0.00 0.00 39.33 39.34 3g4g h ASP 552 CO -0.06 0.34 0.12 0.25 -3.12 0.00 0.00 179.24 176.77 3g4g h LEU 553 N 0.70 0.42 -3.37 1.55 5.85 -0.70 -3.19 115.31 116.57 3g4g h LEU 553 Ca 0.34 -0.17 0.00 0.00 0.84 0.00 0.00 57.88 58.89 3g4g h LEU 553 Cb 0.29 -0.11 0.00 0.00 0.37 0.00 0.00 40.66 41.21 3g4g h LEU 553 CO -0.23 0.48 0.00 1.33 -0.34 0.00 0.00 178.44 179.68 3g4g n VAL 554 N -4.73 2.43 -1.59 1.05 0.24 -0.80 -4.97 118.33 109.95 3g4g n VAL 554 Ca -0.02 -1.64 -0.51 0.00 -2.04 0.00 0.00 64.34 60.13 3g4g n VAL 554 Cb 0.14 -0.23 -0.05 0.00 -1.47 0.00 0.00 33.84 32.22 3g4g n VAL 554 CO 0.00 0.00 0.00 1.57 -2.14 0.00 0.00 176.83 176.26 3g4g n HIS 555 N 0.03 1.51 -0.91 6.34 -0.00 0.10 -1.12 115.22 121.17 3g4g n HIS 555 Ca 0.24 0.62 0.08 0.00 -0.00 0.00 0.00 57.72 58.66 3g4g n HIS 555 Cb 1.01 -2.33 0.35 0.00 -0.00 0.00 0.00 29.99 29.01 3g4g n HIS 555 CO 0.00 0.00 0.00 -0.35 -0.00 0.00 0.00 176.34 175.99 3g4g n PRO 556 N 2.38 4.10 0.04 1.57 -0.04 -1.26 -4.93 135.00 136.86 3g4g n PRO 556 Ca 0.17 -3.02 0.16 0.00 -0.04 0.00 0.00 63.50 60.78 3g4g n PRO 556 Cb 0.21 -2.08 0.65 0.00 -0.04 0.00 0.00 33.50 32.24 3g4g n PRO 556 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 3g4g h ASP 557 N 3.19 0.06 -0.58 3.54 3.32 -1.42 -2.68 116.42 121.86 3g4g h ASP 557 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3g4g h ASP 557 Cb 1.74 -0.01 0.00 0.00 0.22 0.00 0.00 39.33 41.28 3g4g h ASP 557 CO 0.37 0.04 0.00 0.00 -1.72 0.00 0.00 179.24 177.93 3g4g n ALA 558 N -2.60 2.89 -0.13 3.45 0.00 -1.26 -4.67 120.51 118.19 3g4g n ALA 558 Ca 0.07 -1.30 -0.11 0.00 0.00 0.00 0.00 53.44 52.10 3g4g n ALA 558 Cb 0.46 -1.01 -0.02 0.00 0.00 0.00 0.00 19.45 18.88 3g4g n ALA 558 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.50 177.87 3g4g h GLN 559 N 3.58 0.74 -0.69 0.00 5.75 -1.85 -2.21 115.11 120.44 3g4g h GLN 559 Ca 0.00 -0.29 -0.05 0.00 -0.15 0.00 0.00 58.65 58.16 3g4g h GLN 559 Cb 1.19 -0.04 -0.03 0.00 1.07 0.00 0.00 27.48 29.67 3g4g h GLN 559 CO 0.16 0.89 0.22 -0.44 -2.65 0.00 0.00 178.83 177.01 3g4g h ASP 560 N 0.55 0.97 -0.88 -0.69 3.32 -1.85 0.22 116.42 118.06 3g4g h ASP 560 Ca 0.09 -0.17 -0.01 0.00 0.02 0.00 0.00 57.03 56.96 3g4g h ASP 560 Cb 0.62 -0.25 -0.04 0.00 0.22 0.00 0.00 39.33 39.88 3g4g h ASP 560 CO 0.04 0.90 0.50 0.40 -1.72 0.00 0.00 179.24 179.37 3g4g h ILE 561 N 1.01 1.25 0.00 0.35 2.04 -1.84 -0.66 117.51 119.66 3g4g h ILE 561 Ca 0.23 -0.59 -0.16 0.00 1.00 0.00 0.00 64.86 65.33 3g4g h ILE 561 Cb 0.27 0.04 -0.02 0.00 -0.74 0.00 0.00 36.82 36.37 3g4g h ILE 561 CO -0.01 0.27 -0.79 0.25 0.00 0.00 0.00 178.15 177.87 3g4g h LEU 562 N 1.22 0.00 -0.51 1.44 5.85 -0.87 -1.62 115.31 120.82 3g4g h LEU 562 Ca 0.31 0.00 -0.11 0.00 0.84 0.00 0.00 57.88 58.92 3g4g h LEU 562 Cb -0.01 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.01 3g4g h LEU 562 CO -0.05 0.78 -0.13 0.44 -0.34 0.00 0.00 178.44 179.13 3g4g h ASP 563 N 0.00 0.99 -0.17 1.25 3.32 -0.33 -2.46 116.42 119.03 3g4g h ASP 563 Ca -0.01 -0.36 -0.01 0.00 0.02 0.00 0.00 57.03 56.66 3g4g h ASP 563 Cb 1.60 -0.27 -0.01 0.00 0.22 0.00 0.00 39.33 40.87 3g4g h ASP 563 CO 0.10 1.13 0.05 0.74 -1.72 0.00 0.00 179.24 179.54 3g4g h THR 564 N 0.85 1.19 -0.79 0.35 2.02 -1.00 -1.13 112.91 114.40 3g4g h THR 564 Ca 0.13 -0.58 0.17 0.00 0.77 0.00 0.00 66.41 66.90 3g4g h THR 564 Cb 0.70 1.26 -0.11 0.00 -1.74 0.00 0.00 68.15 68.25 3g4g h THR 564 CO 0.05 0.18 0.26 0.25 0.37 0.00 0.00 175.52 176.63 3g4g h LEU 565 N 0.09 0.14 -0.01 2.58 5.85 -1.24 0.20 115.31 122.93 3g4g h LEU 565 Ca 0.05 0.14 -0.26 0.00 0.84 0.00 0.00 57.88 58.66 3g4g h LEU 565 Cb 0.23 0.16 0.02 0.00 0.37 0.00 0.00 40.66 41.45 3g4g h LEU 565 CO -0.00 -0.01 -1.02 -0.33 -0.34 0.00 0.00 178.44 176.74 3g4g h GLU 566 N 0.33 0.71 -0.78 1.25 5.08 -1.29 -1.21 114.58 118.67 3g4g h GLU 566 Ca 0.46 -0.75 0.04 0.00 -1.00 0.00 0.00 59.36 58.11 3g4g h GLU 566 Cb 0.80 0.21 -0.05 0.00 0.50 0.00 0.00 28.75 30.20 3g4g h GLU 566 CO -0.50 1.32 0.49 -0.44 -1.00 0.00 0.00 179.01 178.87 3g4g h ASP 567 N 0.39 0.78 0.55 1.42 3.32 -0.66 -1.20 116.42 121.02 3g4g h ASP 567 Ca -0.12 0.01 -0.14 0.00 0.02 0.00 0.00 57.03 56.79 3g4g h ASP 567 Cb 1.67 -0.16 -0.02 0.00 0.22 0.00 0.00 39.33 41.05 3g4g h ASP 567 CO 0.20 0.52 -0.64 0.78 -1.72 0.00 0.00 179.24 178.38 3g4g h ASN 568 N 0.92 0.10 -0.34 6.45 2.35 -0.43 -0.86 115.58 123.76 3g4g h ASN 568 Ca 0.33 -0.06 -0.04 0.00 -0.55 0.00 0.00 56.30 55.97 3g4g h ASN 568 Cb 0.08 -0.03 -0.01 0.00 0.05 0.00 0.00 38.32 38.41 3g4g h ASN 568 CO -0.14 0.72 0.05 -0.09 -1.65 0.00 0.00 177.43 176.32 3g4g h ARG 569 N 0.06 0.57 -0.26 0.81 1.12 -0.96 -2.46 114.38 113.26 3g4g h ARG 569 Ca -0.01 -0.16 -0.04 0.00 -1.11 0.00 0.00 59.98 58.66 3g4g h ARG 569 Cb 1.15 -0.07 -0.01 0.00 -0.01 0.00 0.00 29.97 31.03 3g4g h ARG 569 CO 0.09 0.65 -0.03 1.49 -3.11 0.00 0.00 179.97 179.07 3g4g h GLU 570 N 0.40 0.40 -0.23 0.20 4.57 -0.34 -1.54 114.58 118.04 3g4g h GLU 570 Ca 0.10 -0.08 -0.08 0.00 -1.18 0.00 0.00 59.36 58.13 3g4g h GLU 570 Cb 0.36 -0.06 -0.00 0.00 -0.16 0.00 0.00 28.75 28.89 3g4g h GLU 570 CO 0.01 0.45 -0.16 2.35 -1.18 0.00 0.00 179.01 180.47 3g4g h TRP 571 N 0.38 0.61 -0.05 0.92 7.01 -0.99 -2.44 115.95 121.40 3g4g h TRP 571 Ca 0.08 -0.17 -0.09 0.00 2.11 0.00 0.00 58.89 60.83 3g4g h TRP 571 Cb 0.30 -0.13 -0.01 0.00 -2.10 0.00 0.00 29.16 27.22 3g4g h TRP 571 CO 0.01 0.82 -0.39 1.88 -2.79 0.00 0.00 178.44 177.97 3g4g h TYR 572 N 0.22 0.12 -0.00 2.65 0.05 -1.12 -2.57 116.97 116.31 3g4g h TYR 572 Ca 0.04 -0.03 -0.00 0.00 0.05 0.00 0.00 58.73 58.80 3g4g h TYR 572 Cb 0.69 -0.03 -0.00 0.00 1.01 0.00 0.00 36.73 38.40 3g4g h TYR 572 CO 0.07 0.48 0.00 0.37 -1.05 0.00 0.00 178.16 178.04 3g4g h GLN 573 N 0.09 0.01 0.00 4.88 5.75 -1.24 -2.89 115.11 121.71 3g4g h GLN 573 Ca 0.01 -0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.51 3g4g h GLN 573 Cb 0.74 -0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.29 3g4g h GLN 573 CO 0.06 0.17 0.00 0.66 -2.65 0.00 0.00 178.83 177.06 3g4g h SER 574 N -0.16 0.00 0.25 -0.69 4.64 -1.16 -1.87 113.55 114.56 3g4g h SER 574 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3g4g h SER 574 Cb 0.16 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.25 3g4g h SER 574 CO -0.00 0.00 -0.75 0.41 -0.87 0.00 0.00 176.83 175.62 3g4g n THR 575 N -2.60 0.00 -1.80 2.95 -1.04 -0.99 -4.93 114.28 105.87 3g4g n THR 575 Ca -0.01 -0.00 -0.42 0.00 -2.04 0.00 0.00 64.05 61.58 3g4g n THR 575 Cb 0.12 0.62 -0.03 0.00 -1.82 0.00 0.00 70.33 69.23 3g4g n THR 575 CO 0.00 0.00 0.00 -0.63 -0.64 0.00 0.00 175.07 173.80 3g4g s ILE 576 N -3.00 3.13 0.49 12.58 1.01 -0.71 -4.93 121.20 129.78 3g4g s ILE 576 Ca 0.09 0.27 -0.23 0.00 0.00 0.00 0.00 60.65 60.78 3g4g s ILE 576 Cb 0.17 -3.18 -0.06 0.00 0.01 0.00 0.00 42.46 39.40 3g4g s ILE 576 CO 0.79 -0.02 1.34 -2.84 0.00 0.00 0.00 174.94 174.21 3g4g s PRO 577 N 3.96 3.46 -0.07 2.79 0.02 -1.26 -5.02 135.00 138.88 3g4g s PRO 577 Ca 0.82 2.21 0.05 0.00 0.02 0.00 0.00 61.00 64.09 3g4g s PRO 577 Cb -0.40 -2.44 -0.01 0.00 0.02 0.00 0.00 34.50 31.67 3g4g s PRO 577 CO 0.37 -0.92 -0.22 -0.65 -0.33 0.00 0.00 177.00 175.24 3g4g s GLN 578 N -2.68 2.68 0.73 5.54 -0.21 -1.26 -5.12 119.66 119.34 3g4g s GLN 578 Ca 0.66 -0.86 -0.14 0.00 0.02 0.00 0.00 55.36 55.04 3g4g s GLN 578 Cb -0.39 -2.25 0.04 0.00 1.00 0.00 0.00 33.01 31.41 3g4g s GLN 578 CO 0.48 0.37 1.18 0.00 -2.12 0.00 0.00 175.29 175.21 3g4g s ALA 579 N -0.13 2.13 0.00 6.09 0.00 -1.26 -5.31 121.76 123.28 3g4g s ALA 579 Ca -0.04 0.78 0.00 0.00 0.00 0.00 0.00 51.96 52.70 3g4g s ALA 579 Cb -0.14 -3.44 0.00 0.00 0.00 0.00 0.00 23.12 19.54 3g4g s ALA 579 CO 0.04 -1.84 0.00 1.58 0.00 0.00 0.00 175.76 175.54