#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3gmj s PRO 258 N 0.00 3.79 0.42 3.49 0.05 -1.26 -4.99 135.00 136.50 3gmj s PRO 258 Ca 0.00 0.23 0.14 0.00 0.05 0.00 0.00 61.00 61.41 3gmj s PRO 258 Cb 0.00 -2.83 1.01 0.00 0.05 0.00 0.00 34.50 32.72 3gmj s PRO 258 CO 0.00 0.44 1.95 0.00 0.05 0.00 0.00 177.00 179.45 3gmj h ALA 259 N 3.11 2.02 -3.88 8.56 0.00 -1.99 -3.41 119.26 123.67 3gmj h ALA 259 Ca -0.48 -0.01 -0.45 0.00 0.00 0.00 0.00 54.91 53.98 3gmj h ALA 259 Cb 1.18 -0.09 -0.26 0.00 0.00 0.00 0.00 17.79 18.62 3gmj h ALA 259 CO 0.68 -0.18 -0.80 -0.06 0.00 0.00 0.00 179.25 178.90 3gmj s PHE 260 N -5.43 1.19 -0.12 0.00 0.08 -1.26 -4.58 117.98 107.87 3gmj s PHE 260 Ca -0.08 -0.31 0.16 0.00 0.12 0.00 0.00 56.93 56.82 3gmj s PHE 260 Cb 0.20 -0.73 -0.12 0.00 -0.57 0.00 0.00 43.02 41.80 3gmj s PHE 260 CO 0.76 0.02 0.88 0.11 -0.10 0.00 0.00 175.22 176.89 3gmj h TRP 261 N 5.22 0.00 -4.08 0.36 5.08 -1.37 -3.42 115.95 117.74 3gmj h TRP 261 Ca -0.36 0.00 -0.12 0.00 1.08 0.00 0.00 58.89 59.48 3gmj h TRP 261 Cb 1.18 0.00 -0.14 0.00 -3.00 0.00 0.00 29.16 27.19 3gmj h TRP 261 CO 0.49 0.59 -0.50 0.00 -1.28 0.00 0.00 178.44 177.74 3gmj s ALA 262 N -2.91 0.28 0.05 0.11 0.00 -1.24 -0.97 121.76 117.08 3gmj s ALA 262 Ca -0.02 -1.04 0.04 0.00 0.00 0.00 0.00 51.96 50.94 3gmj s ALA 262 Cb 0.09 0.62 -0.03 0.00 0.00 0.00 0.00 23.12 23.80 3gmj s ALA 262 CO 0.81 -0.50 -0.12 -1.54 0.00 0.00 0.00 175.76 174.40 3gmj s SER 263 N -2.95 1.43 -0.10 0.00 1.04 -0.45 -1.39 113.70 111.28 3gmj s SER 263 Ca 0.13 -0.55 0.00 0.00 0.48 0.00 0.00 55.95 56.01 3gmj s SER 263 Cb 0.06 -0.04 0.02 0.00 0.10 0.00 0.00 66.02 66.16 3gmj s SER 263 CO -0.05 -0.08 -0.08 -0.63 0.98 0.00 0.00 173.24 173.38 3gmj s ILE 264 N -1.17 1.02 -0.03 -1.02 1.01 0.18 0.09 121.20 121.28 3gmj s ILE 264 Ca -0.03 -0.31 0.03 0.00 0.00 0.00 0.00 60.65 60.34 3gmj s ILE 264 Cb -0.09 -1.02 -0.03 0.00 0.01 0.00 0.00 42.46 41.33 3gmj s ILE 264 CO 0.02 0.36 -0.10 0.00 0.00 0.00 0.00 174.94 175.21 3gmj s ALA 265 N 1.50 2.84 0.00 9.38 0.00 -0.17 -0.96 121.76 134.36 3gmj s ALA 265 Ca 0.01 -0.99 0.00 0.00 0.00 0.00 0.00 51.96 50.98 3gmj s ALA 265 Cb -0.13 -1.06 -0.04 0.00 0.00 0.00 0.00 23.12 21.89 3gmj s ALA 265 CO -0.06 0.58 0.06 -0.47 0.00 0.00 0.00 175.76 175.88 3gmj s TYR 266 N -0.85 3.24 0.12 0.00 5.04 -1.26 0.40 117.35 124.03 3gmj s TYR 266 Ca 0.14 0.17 0.03 0.00 -2.44 0.00 0.00 57.07 54.97 3gmj s TYR 266 Cb -0.11 -1.72 -0.04 0.00 0.35 0.00 0.00 41.96 40.44 3gmj s TYR 266 CO 0.03 0.53 -0.09 0.71 -1.34 0.00 0.00 175.55 175.40 3gmj s TYR 267 N -1.18 1.06 -0.30 4.97 2.02 0.89 -0.24 117.35 124.57 3gmj s TYR 267 Ca 0.22 -0.79 0.02 0.00 -0.37 0.00 0.00 57.07 56.15 3gmj s TYR 267 Cb -0.12 -0.57 0.09 0.00 -0.40 0.00 0.00 41.96 40.95 3gmj s TYR 267 CO 0.14 -0.03 0.03 -1.21 -1.57 0.00 0.00 175.55 172.91 3gmj s GLU 268 N -3.53 1.36 6.07 -0.62 2.02 -0.79 -2.04 118.70 121.16 3gmj s GLU 268 Ca 0.12 -1.44 0.00 0.00 0.02 0.00 0.00 54.97 53.67 3gmj s GLU 268 Cb 0.02 -2.73 0.00 0.00 0.10 0.00 0.00 34.13 31.52 3gmj s GLU 268 CO -0.02 -0.85 0.00 1.28 0.02 0.00 0.00 175.26 175.69 3gmj n LEU 269 N 4.51 0.00 -0.11 1.80 4.77 -0.90 -3.16 117.00 123.91 3gmj n LEU 269 Ca -0.02 0.00 0.03 0.00 -0.03 0.00 0.00 56.01 55.98 3gmj n LEU 269 Cb 0.42 0.00 0.05 0.00 -2.33 0.00 0.00 43.42 41.57 3gmj n LEU 269 CO 0.18 0.00 0.53 -0.46 -1.33 0.00 0.00 177.39 176.32 3gmj n ASN 270 N 10.53 2.23 -4.33 -1.43 0.23 -1.24 -4.36 115.26 116.89 3gmj n ASN 270 Ca 0.00 -2.23 -0.34 0.00 -0.53 0.00 0.00 54.58 51.48 3gmj n ASN 270 Cb 0.00 -0.12 -0.14 0.00 -2.08 0.00 0.00 39.78 37.44 3gmj n ASN 270 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 3gmj n ARG 272 N 4.12 2.39 -5.01 0.00 5.12 -1.26 -1.88 116.66 120.14 3gmj n ARG 272 Ca -0.18 0.86 -0.30 0.00 -1.93 0.00 0.00 57.85 56.29 3gmj n ARG 272 Cb 0.52 -2.60 -0.17 0.00 -1.16 0.00 0.00 32.46 29.05 3gmj n ARG 272 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 3gmj s VAL 273 N 0.29 1.80 0.07 1.55 1.01 0.66 -4.86 120.40 120.92 3gmj s VAL 273 Ca 0.69 -0.87 0.00 0.00 0.00 0.00 0.00 61.98 61.81 3gmj s VAL 273 Cb -0.58 -1.58 0.00 0.00 0.00 0.00 0.00 36.38 34.23 3gmj s VAL 273 CO 0.45 0.50 0.00 0.61 0.00 0.00 0.00 175.10 176.66 3gmj n GLY 274 N 3.64 -1.84 3.77 4.51 0.00 -1.26 -4.18 105.19 109.82 3gmj n GLY 274 Ca -0.20 -1.45 -0.31 0.00 0.00 0.00 0.00 46.02 44.06 3gmj n GLY 274 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3gmj s GLU 275 N -1.89 2.11 0.21 1.61 2.02 -1.26 -4.83 118.70 116.66 3gmj s GLU 275 Ca 0.00 0.95 -0.30 0.00 0.02 0.00 0.00 54.97 55.64 3gmj s GLU 275 Cb 0.00 -1.90 -0.08 0.00 0.10 0.00 0.00 34.13 32.25 3gmj s GLU 275 CO 0.00 -1.69 1.15 0.08 0.02 0.00 0.00 175.26 174.82 3gmj s VAL 276 N -2.98 3.63 -0.07 2.63 1.01 -1.26 -4.68 120.40 118.68 3gmj s VAL 276 Ca 0.61 1.44 -0.13 0.00 0.00 0.00 0.00 61.98 63.91 3gmj s VAL 276 Cb -0.16 -3.92 -0.05 0.00 0.00 0.00 0.00 36.38 32.25 3gmj s VAL 276 CO 0.56 0.26 0.32 -0.36 0.00 0.00 0.00 175.10 175.88 3gmj s PHE 277 N -0.38 3.63 -0.05 5.22 0.08 -0.14 -4.95 117.98 121.40 3gmj s PHE 277 Ca 0.50 0.79 0.04 0.00 0.12 0.00 0.00 56.93 58.38 3gmj s PHE 277 Cb -0.32 -2.22 -0.02 0.00 -0.57 0.00 0.00 43.02 39.89 3gmj s PHE 277 CO 0.37 0.57 -0.16 -1.01 -0.10 0.00 0.00 175.22 174.89 3gmj s HIS 278 N -0.68 2.64 -0.21 0.36 3.76 -1.26 -0.64 115.29 119.25 3gmj s HIS 278 Ca 0.20 -0.25 -0.04 0.00 -0.15 0.00 0.00 55.06 54.83 3gmj s HIS 278 Cb -0.15 -1.62 -0.01 0.00 1.11 0.00 0.00 32.58 31.91 3gmj s HIS 278 CO 0.09 0.12 -0.04 0.00 -0.85 0.00 0.00 174.74 174.05 3gmj n ASN 280 N 4.56 2.47 -4.73 0.00 0.23 -1.26 -1.12 115.26 115.41 3gmj n ASN 280 Ca -0.18 -0.01 -0.42 0.00 -0.53 0.00 0.00 54.58 53.44 3gmj n ASN 280 Cb 0.51 0.59 -0.02 0.00 -2.08 0.00 0.00 39.78 38.78 3gmj n ASN 280 CO 0.00 0.00 0.00 0.21 -0.93 0.00 0.00 177.26 176.54 3gmj s ASN 281 N -4.49 6.54 0.31 0.53 2.47 -1.26 -4.83 114.94 114.22 3gmj s ASN 281 Ca -0.08 2.73 0.23 0.00 0.42 0.00 0.00 52.86 56.17 3gmj s ASN 281 Cb 0.03 -2.61 1.13 0.00 -1.45 0.00 0.00 41.25 38.36 3gmj s ASN 281 CO 0.42 -0.82 1.71 0.78 -3.72 0.00 0.00 177.10 175.46 3gmj h ASN 282 N 5.86 0.00 -3.32 -4.21 4.21 -1.94 -3.38 115.58 112.80 3gmj h ASN 282 Ca -0.45 0.00 -0.67 0.00 1.21 0.00 0.00 56.30 56.40 3gmj h ASN 282 Cb 1.21 0.00 -0.36 0.00 -1.12 0.00 0.00 38.32 38.05 3gmj h ASN 282 CO 0.85 0.00 -0.84 -0.55 -1.29 0.00 0.00 177.43 175.60 3gmj s SER 283 N -4.20 3.54 0.10 5.81 0.15 -1.26 -0.14 113.70 117.70 3gmj s SER 283 Ca 0.00 -0.89 0.09 0.00 0.70 0.00 0.00 55.95 55.86 3gmj s SER 283 Cb 0.08 -1.50 -0.04 0.00 -1.71 0.00 0.00 66.02 62.86 3gmj s SER 283 CO 0.29 -0.06 -0.23 0.68 1.20 0.00 0.00 173.24 175.12 3gmj s VAL 284 N 1.23 1.89 -0.08 4.45 -7.23 -0.75 -4.93 120.40 114.97 3gmj s VAL 284 Ca 0.01 -1.56 0.03 0.00 -1.81 0.00 0.00 61.98 58.65 3gmj s VAL 284 Cb -0.15 -1.69 -0.02 0.00 0.56 0.00 0.00 36.38 35.08 3gmj s VAL 284 CO -0.10 0.03 -0.18 -0.63 -0.31 0.00 0.00 175.10 173.91 3gmj s ILE 285 N -1.07 2.69 -0.32 -0.62 -1.09 -1.14 -0.41 121.20 119.25 3gmj s ILE 285 Ca 0.09 -0.82 -0.04 0.00 -2.23 0.00 0.00 60.65 57.65 3gmj s ILE 285 Cb -0.10 -2.06 0.05 0.00 -1.58 0.00 0.00 42.46 38.77 3gmj s ILE 285 CO 0.04 0.56 0.04 -0.69 -1.23 0.00 0.00 174.94 173.67 3gmj s VAL 286 N -0.13 3.31 0.50 2.92 1.01 0.55 0.45 120.40 129.01 3gmj s VAL 286 Ca -0.03 -1.30 0.00 0.00 0.00 0.00 0.00 61.98 60.66 3gmj s VAL 286 Cb -0.14 -2.89 0.00 0.00 0.00 0.00 0.00 36.38 33.35 3gmj s VAL 286 CO 0.04 -0.15 0.00 -0.90 0.00 0.00 0.00 175.10 174.09 3gmj n ASP 287 N 4.70 3.37 -1.61 3.32 5.68 -0.51 -1.01 116.55 130.49 3gmj n ASP 287 Ca -0.13 -3.17 0.08 0.00 -0.50 0.00 0.00 54.79 51.08 3gmj n ASP 287 Cb 0.44 0.34 0.36 0.00 -1.14 0.00 0.00 41.12 41.12 3gmj n ASP 287 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3gmj n GLY 288 N -0.92 2.97 0.00 6.12 0.00 0.10 -0.38 105.19 113.08 3gmj n GLY 288 Ca -0.20 -0.89 0.00 0.00 0.00 0.00 0.00 46.02 44.93 3gmj n GLY 288 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3gmj n PHE 289 N 0.78 -0.45 -1.38 1.61 3.72 -1.26 -3.11 117.46 117.37 3gmj n PHE 289 Ca 0.26 0.00 0.07 0.00 -0.05 0.00 0.00 57.45 57.73 3gmj n PHE 289 Cb 0.99 0.00 0.09 0.00 -0.94 0.00 0.00 39.48 39.63 3gmj n PHE 289 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 176.76 176.96 3gmj n THR 290 N -0.18 1.28 -2.76 4.37 -2.24 -1.26 -0.13 114.28 113.36 3gmj n THR 290 Ca 0.00 -1.54 -0.42 0.00 -2.27 0.00 0.00 64.05 59.82 3gmj n THR 290 Cb 0.00 0.00 -0.03 0.00 -2.10 0.00 0.00 70.33 68.20 3gmj n THR 290 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 3gmj s ASN 291 N -2.27 7.15 0.00 3.42 2.47 -1.26 -4.75 114.94 119.70 3gmj s ASN 291 Ca 0.22 1.42 0.28 0.00 0.42 0.00 0.00 52.86 55.20 3gmj s ASN 291 Cb 0.19 -2.52 1.15 0.00 -1.45 0.00 0.00 41.25 38.62 3gmj s ASN 291 CO 0.02 -0.43 1.81 -2.65 -3.72 0.00 0.00 177.10 172.14 3gmj n PRO 292 N 5.05 0.65 -1.59 0.43 -0.02 -1.26 -4.31 135.00 133.94 3gmj n PRO 292 Ca 0.07 -0.24 -0.45 0.00 -2.02 0.00 0.00 63.50 60.86 3gmj n PRO 292 Cb 0.49 -1.49 -0.04 0.00 -0.02 0.00 0.00 33.50 32.43 3gmj n PRO 292 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 3gmj n SER 293 N -0.96 3.22 0.22 2.55 2.88 -1.26 -4.80 113.62 115.47 3gmj n SER 293 Ca 0.14 0.44 0.10 0.00 -1.33 0.00 0.00 58.87 58.22 3gmj n SER 293 Cb 0.29 -1.48 0.44 0.00 -0.75 0.00 0.00 64.21 62.71 3gmj n SER 293 CO 0.00 0.00 0.00 0.78 -1.23 0.00 0.00 175.04 174.59 3gmj h ASN 294 N 13.23 0.00 0.00 -3.46 4.21 -1.91 -3.38 115.58 124.27 3gmj h ASN 294 Ca -0.41 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.10 3gmj h ASN 294 Cb 1.26 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 38.46 3gmj h ASN 294 CO 0.97 0.20 0.00 0.59 -1.29 0.00 0.00 177.43 177.90 3gmj n ASN 295 N -3.32 0.00 0.00 5.81 3.02 -1.26 -4.30 115.26 115.21 3gmj n ASN 295 Ca 0.01 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.56 3gmj n ASN 295 Cb 0.44 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.61 3gmj n ASN 295 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 3gmj n SER 296 N 0.00 0.00 0.00 6.41 3.41 -1.26 -4.52 113.62 117.66 3gmj n SER 296 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 3gmj n SER 296 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 3gmj n SER 296 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 3gmj n ASP 297 N 0.00 -0.56 -4.69 4.04 -0.08 -1.26 -5.02 116.55 108.99 3gmj n ASP 297 Ca 0.00 0.00 -0.37 0.00 -1.51 0.00 0.00 54.79 52.91 3gmj n ASP 297 Cb 0.00 -0.20 -0.08 0.00 2.34 0.00 0.00 41.12 43.18 3gmj n ASP 297 CO 0.00 0.00 0.00 -0.13 0.12 0.00 0.00 177.20 177.19 3gmj s ARG 298 N -1.95 4.17 -0.50 -0.67 0.52 -1.26 -2.87 118.95 116.39 3gmj s ARG 298 Ca 0.00 0.01 -0.17 0.00 -0.52 0.00 0.00 55.73 55.05 3gmj s ARG 298 Cb 0.00 -3.50 0.07 0.00 0.52 0.00 0.00 34.95 32.04 3gmj s ARG 298 CO 0.00 0.09 0.53 0.00 0.02 0.00 0.00 175.30 175.93 3gmj h LEU 301 N 9.43 0.00 -1.66 0.00 4.07 -0.80 -3.27 115.31 123.08 3gmj h LEU 301 Ca -0.29 0.00 -0.01 0.00 0.08 0.00 0.00 57.88 57.66 3gmj h LEU 301 Cb 1.10 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 42.84 3gmj h LEU 301 CO 1.01 0.13 -0.03 1.23 -1.08 0.00 0.00 178.44 179.70 3gmj h GLY 302 N 2.19 0.00 -2.76 0.83 0.00 -0.46 -2.00 103.07 100.87 3gmj h GLY 302 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 3gmj h GLY 302 CO 0.02 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.17 3gmj n GLN 303 N -3.15 3.93 -3.10 4.80 -0.00 -1.16 -4.83 117.38 113.87 3gmj n GLN 303 Ca -0.00 -2.93 -0.39 0.00 -0.00 0.00 0.00 57.00 53.67 3gmj n GLN 303 Cb 0.28 -1.99 -0.06 0.00 -0.00 0.00 0.00 30.24 28.48 3gmj n GLN 303 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.06 176.55 3gmj s LEU 304 N -2.40 4.48 0.13 2.61 1.43 -0.75 -5.06 118.68 119.11 3gmj s LEU 304 Ca 0.48 1.36 0.02 0.00 -1.03 0.00 0.00 54.13 54.97 3gmj s LEU 304 Cb 0.35 -3.09 -0.04 0.00 0.03 0.00 0.00 46.19 43.44 3gmj s LEU 304 CO 0.17 0.12 0.25 -0.55 0.23 0.00 0.00 176.35 176.56 3gmj s SER 305 N -0.44 6.23 -0.30 2.29 0.15 -1.26 -5.05 113.70 115.32 3gmj s SER 305 Ca 0.34 0.15 -0.07 0.00 0.70 0.00 0.00 55.95 57.07 3gmj s SER 305 Cb -0.20 -1.86 0.18 0.00 -1.71 0.00 0.00 66.02 62.44 3gmj s SER 305 CO 0.21 0.08 0.85 0.21 1.20 0.00 0.00 173.24 175.79 3gmj s ASN 306 N -3.07 -0.89 0.22 5.45 2.47 -1.26 -4.69 114.94 113.17 3gmj s ASN 306 Ca 0.34 0.49 -0.03 0.00 0.42 0.00 0.00 52.86 54.08 3gmj s ASN 306 Cb -0.11 1.72 0.21 0.00 -1.45 0.00 0.00 41.25 41.61 3gmj s ASN 306 CO 0.28 -0.17 1.62 -0.37 -3.72 0.00 0.00 177.10 174.74 3gmj h VAL 307 N 5.57 1.28 0.00 -5.21 -1.51 -2.05 -2.92 116.25 111.42 3gmj h VAL 307 Ca -0.16 -1.42 0.00 0.00 -1.23 0.00 0.00 66.70 63.89 3gmj h VAL 307 Cb 1.17 1.35 0.00 0.00 -2.13 0.00 0.00 31.29 31.68 3gmj h VAL 307 CO 0.06 0.46 0.00 0.59 -1.23 0.00 0.00 177.57 177.45 3gmj n ASN 308 N -4.08 0.00 -4.73 4.19 4.13 -1.26 -4.82 115.26 108.68 3gmj n ASN 308 Ca -0.01 0.15 -0.36 0.00 1.68 0.00 0.00 54.58 56.04 3gmj n ASN 308 Cb 0.46 -0.15 0.07 0.00 -1.54 0.00 0.00 39.78 38.62 3gmj n ASN 308 CO 0.00 0.00 0.00 -0.60 0.28 0.00 0.00 177.26 176.94 3gmj s ARG 309 N -2.31 2.56 0.40 3.52 3.52 -1.10 -5.05 118.95 120.49 3gmj s ARG 309 Ca 0.00 1.96 0.04 0.00 -0.13 0.00 0.00 55.73 57.60 3gmj s ARG 309 Cb 0.00 -1.86 -0.04 0.00 -1.56 0.00 0.00 34.95 31.49 3gmj s ARG 309 CO 0.00 -1.57 0.07 0.54 -0.81 0.00 0.00 175.30 173.54 3gmj s ASN 310 N -1.55 3.01 0.22 -2.12 2.20 -1.26 -5.03 114.94 110.41 3gmj s ASN 310 Ca 0.80 -1.55 -0.08 0.00 -0.94 0.00 0.00 52.86 51.09 3gmj s ASN 310 Cb -0.35 0.25 0.18 0.00 -2.00 0.00 0.00 41.25 39.33 3gmj s ASN 310 CO 0.39 -0.78 1.82 0.77 -2.94 0.00 0.00 177.10 176.37 3gmj h SER 311 N 1.80 1.08 0.78 3.54 4.64 -1.99 -0.85 113.55 122.55 3gmj h SER 311 Ca -0.39 -0.12 -0.04 0.00 -0.47 0.00 0.00 61.79 60.76 3gmj h SER 311 Cb 1.27 -0.28 -0.01 0.00 -0.31 0.00 0.00 62.40 63.08 3gmj h SER 311 CO 0.66 0.89 -0.20 0.00 -0.87 0.00 0.00 176.83 177.31 3gmj h THR 312 N 1.18 0.56 0.24 2.95 1.03 -1.99 -1.53 112.91 115.35 3gmj h THR 312 Ca 0.29 -0.99 -0.34 0.00 -0.01 0.00 0.00 66.41 65.36 3gmj h THR 312 Cb 0.09 1.67 0.03 0.00 -1.07 0.00 0.00 68.15 68.86 3gmj h THR 312 CO -0.04 0.20 -1.56 0.40 -0.01 0.00 0.00 175.52 174.51 3gmj h ILE 313 N 0.00 1.18 -0.56 0.00 2.04 -1.76 -2.89 117.51 115.52 3gmj h ILE 313 Ca -0.00 -2.64 -0.00 0.00 1.00 0.00 0.00 64.86 63.21 3gmj h ILE 313 Cb 0.65 2.97 -0.03 0.00 -0.74 0.00 0.00 36.82 39.67 3gmj h ILE 313 CO 0.03 0.82 0.34 -0.33 0.00 0.00 0.00 178.15 179.01 3gmj h GLU 314 N 0.13 0.76 -0.31 2.37 5.08 -0.97 -1.37 114.58 120.28 3gmj h GLU 314 Ca -0.28 -0.07 -0.00 0.00 -1.00 0.00 0.00 59.36 58.01 3gmj h GLU 314 Cb 2.15 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 31.23 3gmj h GLU 314 CO 0.25 0.55 0.19 -0.91 -1.00 0.00 0.00 179.01 178.08 3gmj h ASN 315 N 0.76 0.37 -0.99 1.42 2.35 -1.38 -2.48 115.58 115.63 3gmj h ASN 315 Ca 0.20 -0.05 0.01 0.00 -0.55 0.00 0.00 56.30 55.92 3gmj h ASN 315 Cb -0.02 -0.09 -0.05 0.00 0.05 0.00 0.00 38.32 38.21 3gmj h ASN 315 CO -0.04 0.31 0.66 0.74 -1.65 0.00 0.00 177.43 177.44 3gmj h THR 316 N 0.39 1.25 0.00 2.81 2.02 -1.31 -2.32 112.91 115.75 3gmj h THR 316 Ca 0.11 -0.46 -0.02 0.00 0.77 0.00 0.00 66.41 66.81 3gmj h THR 316 Cb 0.01 -0.21 -0.00 0.00 -1.74 0.00 0.00 68.15 66.21 3gmj h THR 316 CO -0.02 0.24 -0.08 0.03 0.37 0.00 0.00 175.52 176.06 3gmj h ARG 317 N 1.34 0.00 -0.17 6.66 3.08 -0.80 -0.80 114.38 123.68 3gmj h ARG 317 Ca 0.37 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.42 3gmj h ARG 317 Cb -0.14 0.00 0.00 0.00 0.08 0.00 0.00 29.97 29.91 3gmj h ARG 317 CO -0.08 0.08 0.00 0.54 -1.07 0.00 0.00 179.97 179.44 3gmj n ARG 318 N -3.48 1.59 0.00 0.04 1.74 -0.88 -3.68 116.66 111.99 3gmj n ARG 318 Ca -0.02 -0.89 0.00 0.00 -0.77 0.00 0.00 57.85 56.17 3gmj n ARG 318 Cb 0.22 -1.32 0.00 0.00 -1.02 0.00 0.00 32.46 30.34 3gmj n ARG 318 CO 0.00 0.00 0.00 0.72 -1.52 0.00 0.00 177.63 176.83 3gmj n HIS 319 N 0.14 0.00 -0.02 -1.55 8.25 -0.33 -4.65 115.22 117.06 3gmj n HIS 319 Ca 0.14 0.00 -0.11 0.00 -0.26 0.00 0.00 57.72 57.49 3gmj n HIS 319 Cb 0.26 0.00 -0.05 0.00 1.12 0.00 0.00 29.99 31.32 3gmj n HIS 319 CO 0.00 0.00 0.00 0.82 0.64 0.00 0.00 176.34 177.80 3gmj h ILE 320 N 0.21 1.09 0.00 1.59 2.04 -1.58 -3.38 117.51 117.48 3gmj h ILE 320 Ca 0.00 -0.23 0.00 0.00 1.00 0.00 0.00 64.86 65.63 3gmj h ILE 320 Cb 0.11 0.99 0.00 0.00 -0.74 0.00 0.00 36.82 37.18 3gmj h ILE 320 CO 0.00 0.08 0.00 0.61 0.00 0.00 0.00 178.15 178.84 3gmj n GLY 321 N -0.95 2.65 0.30 5.37 0.00 -1.26 -0.70 105.19 110.61 3gmj n GLY 321 Ca -0.05 0.29 0.17 0.00 0.00 0.00 0.00 46.02 46.43 3gmj n GLY 321 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3gmj h LYS 322 N 0.00 0.00 0.00 1.61 1.57 -1.88 0.29 116.57 118.15 3gmj h LYS 322 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3gmj h LYS 322 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.31 3gmj h LYS 322 CO 0.00 0.03 0.00 0.41 -0.57 0.00 0.00 179.45 179.32 3gmj n GLY 323 N -0.94 1.41 3.15 3.86 0.00 0.13 -4.38 105.19 108.41 3gmj n GLY 323 Ca -0.02 -0.54 -0.23 0.00 0.00 0.00 0.00 46.02 45.22 3gmj n GLY 323 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3gmj s VAL 324 N 0.00 1.29 -0.17 1.61 0.11 -0.18 -1.03 120.40 122.03 3gmj s VAL 324 Ca 0.00 -0.78 -0.03 0.00 -2.93 0.00 0.00 61.98 58.24 3gmj s VAL 324 Cb 0.00 -1.09 -0.02 0.00 -1.53 0.00 0.00 36.38 33.74 3gmj s VAL 324 CO 0.00 0.30 -0.05 -2.28 -3.33 0.00 0.00 175.10 169.74 3gmj s HIS 325 N -0.48 2.96 -0.25 1.54 5.04 -0.15 -0.33 115.29 123.63 3gmj s HIS 325 Ca 0.06 -0.55 -0.02 0.00 -1.54 0.00 0.00 55.06 53.01 3gmj s HIS 325 Cb -0.07 -1.98 0.02 0.00 0.04 0.00 0.00 32.58 30.59 3gmj s HIS 325 CO -0.00 -0.22 -0.06 -0.51 -2.34 0.00 0.00 174.74 171.60 3gmj s LEU 326 N 0.71 3.18 -0.25 8.88 1.43 0.46 -0.31 118.68 132.78 3gmj s LEU 326 Ca -0.03 -0.85 -0.05 0.00 -1.03 0.00 0.00 54.13 52.17 3gmj s LEU 326 Cb -0.15 -1.67 -0.01 0.00 0.03 0.00 0.00 46.19 44.40 3gmj s LEU 326 CO 0.02 -0.12 0.02 -0.47 0.23 0.00 0.00 176.35 176.03 3gmj s TYR 327 N 1.33 3.05 -0.26 0.29 5.04 -0.44 -1.81 117.35 124.55 3gmj s TYR 327 Ca 0.00 -0.85 -0.13 0.00 -2.44 0.00 0.00 57.07 53.66 3gmj s TYR 327 Cb -0.17 -2.18 -0.04 0.00 0.35 0.00 0.00 41.96 39.92 3gmj s TYR 327 CO -0.04 -0.52 0.26 -0.47 -1.34 0.00 0.00 175.55 173.44 3gmj s TYR 328 N 1.51 3.27 -0.09 4.97 6.04 0.80 -1.45 117.35 132.41 3gmj s TYR 328 Ca 0.05 0.29 -0.04 0.00 0.04 0.00 0.00 57.07 57.41 3gmj s TYR 328 Cb -0.15 -2.43 0.05 0.00 -1.04 0.00 0.00 41.96 38.38 3gmj s TYR 328 CO -0.00 -0.11 0.19 0.54 -1.54 0.00 0.00 175.55 174.63 3gmj s VAL 329 N 1.62 -0.13 0.00 3.14 0.11 -0.45 -4.77 120.40 119.93 3gmj s VAL 329 Ca 0.11 0.22 0.00 0.00 -2.93 0.00 0.00 61.98 59.38 3gmj s VAL 329 Cb -0.15 -0.31 0.00 0.00 -1.53 0.00 0.00 36.38 34.39 3gmj s VAL 329 CO 0.09 0.09 0.00 0.35 -3.33 0.00 0.00 175.10 172.30 3gmj n THR 330 N 4.55 0.00 0.83 5.04 -2.24 -1.26 -0.93 114.28 120.27 3gmj n THR 330 Ca -0.20 0.00 0.09 0.00 -2.27 0.00 0.00 64.05 61.67 3gmj n THR 330 Cb 0.51 0.00 -0.11 0.00 -2.10 0.00 0.00 70.33 68.63 3gmj n THR 330 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3gmj n GLY 331 N 0.00 -0.83 3.90 3.38 0.00 -1.26 -5.00 105.19 105.39 3gmj n GLY 331 Ca 0.00 -0.54 -0.30 0.00 0.00 0.00 0.00 46.02 45.18 3gmj n GLY 331 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3gmj s GLU 332 N -2.87 3.61 -0.06 1.61 0.41 -0.11 -2.93 118.70 118.37 3gmj s GLU 332 Ca 0.06 -0.10 0.02 0.00 -0.41 0.00 0.00 54.97 54.54 3gmj s GLU 332 Cb 0.14 -2.78 0.01 0.00 -1.78 0.00 0.00 34.13 29.73 3gmj s GLU 332 CO 0.79 0.37 -0.12 0.54 -0.49 0.00 0.00 175.26 176.36 3gmj s VAL 333 N -1.83 1.08 0.08 2.63 0.11 -0.89 -1.35 120.40 120.24 3gmj s VAL 333 Ca 0.42 -0.46 0.06 0.00 -2.93 0.00 0.00 61.98 59.07 3gmj s VAL 333 Cb -0.11 -0.99 -0.04 0.00 -1.53 0.00 0.00 36.38 33.71 3gmj s VAL 333 CO 0.27 0.34 -0.06 -0.31 -3.33 0.00 0.00 175.10 172.01 3gmj s TYR 334 N 0.62 2.85 -0.07 1.54 2.02 -0.52 -0.68 117.35 123.10 3gmj s TYR 334 Ca -0.13 -0.09 0.05 0.00 -0.37 0.00 0.00 57.07 56.53 3gmj s TYR 334 Cb -0.15 -1.50 -0.01 0.00 -0.40 0.00 0.00 41.96 39.90 3gmj s TYR 334 CO 0.03 0.43 -0.24 0.00 -1.57 0.00 0.00 175.55 174.21 3gmj s ALA 335 N -1.21 2.21 -0.11 3.71 0.00 0.71 -1.33 121.76 125.75 3gmj s ALA 335 Ca 0.22 -1.02 0.03 0.00 0.00 0.00 0.00 51.96 51.20 3gmj s ALA 335 Cb -0.11 -0.75 0.00 0.00 0.00 0.00 0.00 23.12 22.26 3gmj s ALA 335 CO 0.14 0.38 -0.23 -2.00 0.00 0.00 0.00 175.76 174.06 3gmj s GLU 336 N -0.03 3.08 -0.77 0.00 2.12 0.58 -2.14 118.70 121.54 3gmj s GLU 336 Ca -0.07 -0.86 -0.23 0.00 0.36 0.00 0.00 54.97 54.17 3gmj s GLU 336 Cb -0.15 -2.36 0.06 0.00 0.26 0.00 0.00 34.13 31.95 3gmj s GLU 336 CO 0.05 0.15 1.15 0.00 -0.54 0.00 0.00 175.26 176.07 3gmj h LEU 338 N 11.94 0.00-10.28 0.00 4.07 -1.45 0.28 115.31 119.87 3gmj h LEU 338 Ca -0.16 0.00 -0.51 0.00 0.08 0.00 0.00 57.88 57.29 3gmj h LEU 338 Cb 1.05 0.00 0.18 0.00 1.08 0.00 0.00 40.66 42.97 3gmj h LEU 338 CO 1.24 0.15 0.24 -0.55 -1.08 0.00 0.00 178.44 178.44 3gmj s SER 339 N -6.03 3.23 0.15 -0.43 0.15 -0.20 -4.50 113.70 106.08 3gmj s SER 339 Ca 0.04 2.05 0.26 0.00 0.70 0.00 0.00 55.95 59.00 3gmj s SER 339 Cb 0.07 -2.53 0.93 0.00 -1.71 0.00 0.00 66.02 62.78 3gmj s SER 339 CO 0.73 -2.88 1.78 0.47 1.20 0.00 0.00 173.24 174.54 3gmj n ASP 340 N -4.08 0.53 -4.70 5.45 8.00 -1.26 -4.57 116.55 115.92 3gmj n ASP 340 Ca 0.11 0.57 -0.23 0.00 0.71 0.00 0.00 54.79 55.94 3gmj n ASP 340 Cb 0.52 -0.70 -0.06 0.00 -0.02 0.00 0.00 41.12 40.86 3gmj n ASP 340 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 3gmj s SER 341 N -3.99 4.75 0.70 -2.24 0.01 -1.26 -4.80 113.70 106.87 3gmj s SER 341 Ca 0.10 -0.60 -0.11 0.00 1.31 0.00 0.00 55.95 56.66 3gmj s SER 341 Cb 0.13 -0.93 0.01 0.00 0.21 0.00 0.00 66.02 65.45 3gmj s SER 341 CO 0.53 -0.06 1.06 0.00 0.41 0.00 0.00 173.24 175.17 3gmj s ALA 342 N -2.31 2.68 0.31 1.44 0.00 -1.26 -4.54 121.76 118.08 3gmj s ALA 342 Ca 0.33 0.08 0.09 0.00 0.00 0.00 0.00 51.96 52.47 3gmj s ALA 342 Cb -0.06 -3.18 -0.05 0.00 0.00 0.00 0.00 23.12 19.84 3gmj s ALA 342 CO 0.21 -1.23 0.02 0.96 0.00 0.00 0.00 175.76 175.72 3gmj s ILE 343 N -3.04 3.03 -0.07 0.00 -4.36 -1.12 0.15 121.20 115.79 3gmj s ILE 343 Ca 0.58 -1.92 0.01 0.00 -0.26 0.00 0.00 60.65 59.06 3gmj s ILE 343 Cb -0.14 -2.82 0.02 0.00 1.25 0.00 0.00 42.46 40.77 3gmj s ILE 343 CO 0.55 -0.28 -0.07 -0.36 0.24 0.00 0.00 174.94 175.02 3gmj s PHE 344 N -2.42 1.16 -0.08 1.37 0.40 0.45 -1.50 117.98 117.36 3gmj s PHE 344 Ca 0.34 -0.45 0.02 0.00 -0.60 0.00 0.00 56.93 56.23 3gmj s PHE 344 Cb -0.04 -0.97 -0.02 0.00 0.51 0.00 0.00 43.02 42.51 3gmj s PHE 344 CO 0.20 -0.33 -0.15 0.08 0.70 0.00 0.00 175.22 175.72 3gmj s VAL 345 N 1.22 2.97 -0.36 -0.44 1.01 0.74 -0.31 120.40 125.23 3gmj s VAL 345 Ca -0.05 -0.73 0.01 0.00 0.00 0.00 0.00 61.98 61.21 3gmj s VAL 345 Cb -0.14 -2.20 0.10 0.00 0.00 0.00 0.00 36.38 34.14 3gmj s VAL 345 CO -0.02 0.56 0.09 -1.58 0.00 0.00 0.00 175.10 174.15 3gmj s GLN 346 N -0.22 1.85 -0.20 2.72 0.74 0.60 -0.69 119.66 124.46 3gmj s GLN 346 Ca 0.01 -1.75 0.01 0.00 0.05 0.00 0.00 55.36 53.68 3gmj s GLN 346 Cb -0.13 -3.33 0.04 0.00 1.10 0.00 0.00 33.01 30.69 3gmj s GLN 346 CO 0.03 -0.93 -0.12 0.45 -0.55 0.00 0.00 175.29 174.17 3gmj s SER 347 N 1.32 3.48 0.36 6.67 0.15 -1.26 -2.61 113.70 121.82 3gmj s SER 347 Ca 0.07 -0.91 0.05 0.00 0.70 0.00 0.00 55.95 55.85 3gmj s SER 347 Cb -0.21 -1.31 0.70 0.00 -1.71 0.00 0.00 66.02 63.50 3gmj s SER 347 CO -0.06 -0.13 1.97 0.03 1.20 0.00 0.00 173.24 176.25 3gmj h ARG 348 N 7.94 0.59 -0.20 5.44 3.08 -1.82 0.64 114.38 130.05 3gmj h ARG 348 Ca -0.29 -0.07 -0.14 0.00 0.07 0.00 0.00 59.98 59.54 3gmj h ARG 348 Cb 1.10 -0.11 -0.01 0.00 0.08 0.00 0.00 29.97 31.02 3gmj h ARG 348 CO 0.50 0.48 -0.47 -0.97 -1.07 0.00 0.00 179.97 178.44 3gmj h ASN 349 N 0.59 0.55 -0.17 7.04 -0.73 -1.81 -2.26 115.58 118.79 3gmj h ASN 349 Ca 0.15 -0.26 -0.19 0.00 1.87 0.00 0.00 56.30 57.86 3gmj h ASN 349 Cb 0.11 -0.16 0.01 0.00 0.27 0.00 0.00 38.32 38.55 3gmj h ASN 349 CO -0.02 0.94 -0.64 0.00 -0.37 0.00 0.00 177.43 177.33 3gmj h ASN 351 N 0.45 0.00 0.00 0.00 2.35 -0.83 -1.79 115.58 115.76 3gmj h ASN 351 Ca -0.03 0.00 -0.15 0.00 -0.55 0.00 0.00 56.30 55.57 3gmj h ASN 351 Cb 1.27 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 39.62 3gmj h ASN 351 CO 0.14 0.00 -1.11 0.00 -1.65 0.00 0.00 177.43 174.81 3gmj n TYR 352 N -3.17 0.75 -0.34 1.19 4.19 -0.86 0.22 117.16 119.15 3gmj n TYR 352 Ca -0.03 0.32 0.36 0.00 3.31 0.00 0.00 57.90 61.87 3gmj n TYR 352 Cb 0.10 -0.90 0.73 0.00 0.49 0.00 0.00 39.34 39.75 3gmj n TYR 352 CO 0.00 0.00 0.00 0.37 0.91 0.00 0.00 176.86 178.14 3gmj h GLN 353 N -1.00 0.00 0.00 2.98 4.15 -0.59 -3.27 115.11 117.38 3gmj h GLN 353 Ca -0.22 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.20 3gmj h GLN 353 Cb 1.01 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.70 3gmj h GLN 353 CO -0.14 0.00 0.00 0.72 -1.93 0.00 0.00 178.83 177.48 3gmj n HIS 354 N -3.94 0.00 -1.90 3.99 8.25 -0.69 -5.06 115.22 115.87 3gmj n HIS 354 Ca 0.27 0.00 -0.04 0.00 -0.26 0.00 0.00 57.72 57.70 3gmj n HIS 354 Cb 1.37 0.00 -0.04 0.00 1.12 0.00 0.00 29.99 32.45 3gmj n HIS 354 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3gmj n GLY 355 N 5.00 0.56 3.94 -1.41 0.00 -1.19 -5.05 105.19 107.04 3gmj n GLY 355 Ca 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.77 3gmj n GLY 355 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3gmj s PHE 356 N 0.00 3.10 0.47 1.61 2.99 0.13 -5.00 117.98 121.28 3gmj s PHE 356 Ca 0.00 0.38 -0.25 0.00 0.00 0.00 0.00 56.93 57.07 3gmj s PHE 356 Cb 0.00 -2.74 -0.08 0.00 0.00 0.00 0.00 43.02 40.20 3gmj s PHE 356 CO 0.00 -0.85 1.41 1.58 -0.00 0.00 0.00 175.22 177.36 3gmj n HIS 357 N -2.49 2.60 0.20 0.36 -0.00 -1.26 -4.50 115.22 110.13 3gmj n HIS 357 Ca 0.05 0.44 0.18 0.00 -0.00 0.00 0.00 57.72 58.39 3gmj n HIS 357 Cb 0.59 -2.44 0.82 0.00 -0.00 0.00 0.00 29.99 28.95 3gmj n HIS 357 CO 0.00 0.00 0.00 -1.35 -0.00 0.00 0.00 176.34 174.99 3gmj h PRO 358 N 2.13 0.00 -0.34 1.57 0.11 -1.93 -0.35 132.00 133.19 3gmj h PRO 358 Ca -0.51 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.60 3gmj h PRO 358 Cb 1.28 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.39 3gmj h PRO 358 CO 0.60 0.00 0.00 -1.13 -0.21 0.00 0.00 178.00 177.26 3gmj n SER 359 N -3.50 3.19 -4.67 -2.05 3.41 -1.26 -4.53 113.62 104.20 3gmj n SER 359 Ca 0.03 -1.96 -0.48 0.00 -0.26 0.00 0.00 58.87 56.20 3gmj n SER 359 Cb 0.44 -0.22 -0.05 0.00 -0.26 0.00 0.00 64.21 64.12 3gmj n SER 359 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 3gmj n THR 360 N 1.32 0.21 -3.76 6.66 -1.04 -0.14 -4.98 114.28 112.55 3gmj n THR 360 Ca 0.19 -0.04 -0.36 0.00 -2.04 0.00 0.00 64.05 61.79 3gmj n THR 360 Cb 0.57 -1.58 -0.13 0.00 -1.82 0.00 0.00 70.33 67.37 3gmj n THR 360 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 3gmj s VAL 361 N 2.06 4.24 -0.02 12.58 1.01 -1.26 -4.40 120.40 134.60 3gmj s VAL 361 Ca 0.85 -0.22 -0.03 0.00 0.00 0.00 0.00 61.98 62.57 3gmj s VAL 361 Cb -0.72 -2.99 -0.04 0.00 0.00 0.00 0.00 36.38 32.63 3gmj s VAL 361 CO 0.44 0.33 0.18 0.00 0.00 0.00 0.00 175.10 176.05 3gmj s LYS 363 N -1.82 3.93 -0.50 0.00 2.20 -1.26 -0.19 119.74 122.10 3gmj s LYS 363 Ca 0.26 0.25 -0.00 0.00 -0.36 0.00 0.00 55.97 56.11 3gmj s LYS 363 Cb -0.13 -3.27 0.13 0.00 -1.51 0.00 0.00 37.83 33.05 3gmj s LYS 363 CO 0.17 0.57 0.28 0.42 -0.36 0.00 0.00 175.35 176.43 3gmj s ILE 364 N -0.61 3.14 1.00 5.43 1.01 -0.56 -4.97 121.20 125.63 3gmj s ILE 364 Ca 0.21 -2.72 -0.11 0.00 0.00 0.00 0.00 60.65 58.02 3gmj s ILE 364 Cb -0.15 -3.13 0.19 0.00 0.01 0.00 0.00 42.46 39.38 3gmj s ILE 364 CO 0.09 -0.77 1.09 -2.84 0.00 0.00 0.00 174.94 172.51 3gmj s PRO 365 N 0.34 0.38 0.18 2.79 0.02 -1.26 -2.80 135.00 134.65 3gmj s PRO 365 Ca 0.14 1.11 -0.33 0.00 0.02 0.00 0.00 61.00 61.94 3gmj s PRO 365 Cb -0.22 -1.69 -0.14 0.00 0.02 0.00 0.00 34.50 32.48 3gmj s PRO 365 CO -0.04 -2.93 1.56 -2.30 -0.33 0.00 0.00 177.00 172.97 3gmj n PRO 366 N -4.39 2.20 0.00 5.54 -0.02 -1.26 -1.60 135.00 135.47 3gmj n PRO 366 Ca 0.07 0.79 0.00 0.00 -2.02 0.00 0.00 63.50 62.35 3gmj n PRO 366 Cb 0.54 -2.55 0.00 0.00 -0.02 0.00 0.00 33.50 31.47 3gmj n PRO 366 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3gmj n GLY 367 N 3.20 1.41 3.97 -1.23 0.00 0.97 -5.01 105.19 108.50 3gmj n GLY 367 Ca 0.16 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.92 3gmj n GLY 367 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3gmj s SER 369 N -4.77 0.04 -0.29 0.00 0.15 -1.26 -2.14 113.70 105.43 3gmj s SER 369 Ca 0.68 -0.59 -0.16 0.00 0.70 0.00 0.00 55.95 56.58 3gmj s SER 369 Cb -0.05 0.38 0.14 0.00 -1.71 0.00 0.00 66.02 64.78 3gmj s SER 369 CO 0.47 -0.77 0.94 -0.22 1.20 0.00 0.00 173.24 174.86 3gmj s LEU 370 N -2.86 -0.58 -0.26 3.45 2.96 -0.91 -4.97 118.68 115.52 3gmj s LEU 370 Ca 0.05 0.90 -0.29 0.00 -0.22 0.00 0.00 54.13 54.57 3gmj s LEU 370 Cb 0.04 1.81 -0.00 0.00 0.50 0.00 0.00 46.19 48.54 3gmj s LEU 370 CO -0.10 -0.14 1.31 -0.75 -1.32 0.00 0.00 176.35 175.35 3gmj s LYS 371 N 1.54 3.99 -0.01 1.98 2.20 -1.26 -0.21 119.74 127.97 3gmj s LYS 371 Ca -0.08 1.37 0.19 0.00 -0.36 0.00 0.00 55.97 57.09 3gmj s LYS 371 Cb -0.04 -3.86 -0.24 0.00 -1.51 0.00 0.00 37.83 32.18 3gmj s LYS 371 CO -0.16 -1.03 0.65 0.44 -0.36 0.00 0.00 175.35 174.90 3gmj n ILE 372 N 6.01 0.00 -3.77 5.43 -5.35 0.14 -4.82 119.36 117.00 3gmj n ILE 372 Ca 0.15 -0.20 -0.13 0.00 -0.27 0.00 0.00 62.75 62.30 3gmj n ILE 372 Cb 0.46 0.66 -0.13 0.00 -1.74 0.00 0.00 39.64 38.88 3gmj n ILE 372 CO 0.00 0.00 0.00 0.12 -1.76 0.00 0.00 176.55 174.91 3gmj s PHE 373 N -2.96 -0.21 -0.29 4.28 5.36 -1.13 -3.31 117.98 119.72 3gmj s PHE 373 Ca 0.02 0.54 -0.00 0.00 -0.96 0.00 0.00 56.93 56.52 3gmj s PHE 373 Cb 0.13 -0.00 0.06 0.00 -0.34 0.00 0.00 43.02 42.87 3gmj s PHE 373 CO 0.77 -0.15 -0.02 1.21 -1.46 0.00 0.00 175.22 175.57 3gmj s ASN 374 N 0.80 4.77 0.51 6.13 3.04 -1.26 -2.09 114.94 126.84 3gmj s ASN 374 Ca -0.06 -1.38 0.29 0.00 0.04 0.00 0.00 52.86 51.75 3gmj s ASN 374 Cb -0.08 -1.66 1.28 0.00 -1.54 0.00 0.00 41.25 39.25 3gmj s ASN 374 CO -0.04 -0.26 1.97 -1.13 -3.04 0.00 0.00 177.10 174.60 3gmj h ASN 375 N 7.91 0.00 0.15 -4.21 -0.73 -1.92 -1.45 115.58 115.33 3gmj h ASN 375 Ca -0.19 0.00 -0.01 0.00 1.87 0.00 0.00 56.30 57.97 3gmj h ASN 375 Cb 1.05 0.00 0.00 0.00 0.27 0.00 0.00 38.32 39.64 3gmj h ASN 375 CO 0.52 0.12 -0.07 1.56 -0.37 0.00 0.00 177.43 179.18 3gmj h GLN 376 N 0.00 -0.19 -0.97 6.67 4.20 -1.94 -2.54 115.11 120.34 3gmj h GLN 376 Ca -0.00 0.01 0.30 0.00 0.06 0.00 0.00 58.65 59.02 3gmj h GLN 376 Cb 0.53 0.04 -0.17 0.00 0.30 0.00 0.00 27.48 28.18 3gmj h GLN 376 CO 0.02 -0.13 0.21 1.49 -0.67 0.00 0.00 178.83 179.74 3gmj h GLU 377 N -0.68 0.06 0.01 1.46 4.57 -1.97 0.70 114.58 118.73 3gmj h GLU 377 Ca -0.02 -0.00 -0.00 0.00 -1.18 0.00 0.00 59.36 58.16 3gmj h GLU 377 Cb 0.15 -0.01 0.00 0.00 -0.16 0.00 0.00 28.75 28.73 3gmj h GLU 377 CO 0.03 0.04 -0.00 0.35 -1.18 0.00 0.00 179.01 178.25 3gmj h PHE 378 N 0.06 -0.01 -1.00 0.92 3.04 -1.38 -3.05 116.94 115.51 3gmj h PHE 378 Ca 0.65 -0.00 0.22 0.00 3.98 0.00 0.00 57.97 62.82 3gmj h PHE 378 Cb 1.45 0.00 -0.10 0.00 2.56 0.00 0.00 35.95 39.86 3gmj h PHE 378 CO -0.32 -0.01 0.62 0.00 -2.02 0.00 0.00 178.31 176.59 3gmj h ALA 379 N 0.98 1.92 -1.75 2.41 0.00 0.85 -1.73 119.26 121.93 3gmj h ALA 379 Ca -0.00 0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.98 3gmj h ALA 379 Cb 0.01 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.77 3gmj h ALA 379 CO 0.00 -0.31 0.00 1.04 0.00 0.00 0.00 179.25 179.98 3gmj n GLN 380 N -4.71 0.00 -0.09 0.00 6.02 -0.72 -2.82 117.38 115.06 3gmj n GLN 380 Ca 0.24 0.23 0.03 0.00 -0.01 0.00 0.00 57.00 57.48 3gmj n GLN 380 Cb 0.70 -1.21 0.06 0.00 1.02 0.00 0.00 30.24 30.81 3gmj n GLN 380 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 3gmj n LEU 381 N -1.15 -0.07 0.10 1.08 7.99 -1.04 0.17 117.00 124.08 3gmj n LEU 381 Ca 0.00 0.46 -0.13 0.00 -0.01 0.00 0.00 56.01 56.33 3gmj n LEU 381 Cb 0.00 -0.15 -0.08 0.00 -0.11 0.00 0.00 43.42 43.08 3gmj n LEU 381 CO 0.00 -0.45 0.51 0.25 -1.51 0.00 0.00 177.39 176.19 3gmj h LEU 382 N 0.00 -1.25 -0.57 2.23 5.85 -1.27 0.01 115.31 120.31 3gmj h LEU 382 Ca 0.14 0.13 -0.07 0.00 0.84 0.00 0.00 57.88 58.92 3gmj h LEU 382 Cb 0.25 0.46 -0.02 0.00 0.37 0.00 0.00 40.66 41.72 3gmj h LEU 382 CO -0.26 -0.45 0.09 0.28 -0.34 0.00 0.00 178.44 177.76 3gmj h SER 383 N -0.61 0.91 -0.70 1.25 0.02 0.18 -2.63 113.55 111.98 3gmj h SER 383 Ca -0.01 -0.26 0.03 0.00 -0.84 0.00 0.00 61.79 60.71 3gmj h SER 383 Cb 0.61 -0.24 -0.04 0.00 0.14 0.00 0.00 62.40 62.87 3gmj h SER 383 CO -0.22 0.94 0.46 1.56 -1.14 0.00 0.00 176.83 178.43 3gmj h GLN 384 N 0.85 0.83 -0.66 3.45 4.20 -0.91 -2.64 115.11 120.21 3gmj h GLN 384 Ca 0.17 -0.05 0.00 0.00 0.06 0.00 0.00 58.65 58.83 3gmj h GLN 384 Cb 0.41 -0.19 0.00 0.00 0.30 0.00 0.00 27.48 28.01 3gmj h GLN 384 CO 0.01 0.55 0.00 -1.13 -0.67 0.00 0.00 178.83 177.59 3gmj n SER 385 N -4.45 4.14 -0.00 1.46 3.41 -0.02 -4.24 113.62 113.92 3gmj n SER 385 Ca 0.09 -2.26 -0.02 0.00 -0.26 0.00 0.00 58.87 56.42 3gmj n SER 385 Cb 0.11 -0.52 -0.01 0.00 -0.26 0.00 0.00 64.21 63.54 3gmj n SER 385 CO 0.00 0.00 0.00 0.58 -0.16 0.00 0.00 175.04 175.46 3gmj h VAL 386 N 3.87 0.00 -0.21 -3.33 2.07 -1.12 -3.31 116.25 114.21 3gmj h VAL 386 Ca 0.00 -0.87 -0.36 0.00 0.82 0.00 0.00 66.70 66.29 3gmj h VAL 386 Cb 1.19 0.00 -0.07 0.00 -1.52 0.00 0.00 31.29 30.90 3gmj h VAL 386 CO 0.14 0.00 0.77 -0.46 0.02 0.00 0.00 177.57 178.04 3gmj n ASN 387 N -4.69 6.31 0.00 0.57 0.23 -1.26 -3.09 115.26 113.33 3gmj n ASN 387 Ca -0.01 -2.64 0.00 0.00 -0.53 0.00 0.00 54.58 51.40 3gmj n ASN 387 Cb 0.04 -1.42 0.00 0.00 -2.08 0.00 0.00 39.78 36.32 3gmj n ASN 387 CO 0.00 0.00 0.00 -3.20 -0.93 0.00 0.00 177.26 173.13 3gmj n ASN 388 N 2.46 0.00 0.00 0.53 5.15 -1.25 -5.09 115.26 117.06 3gmj n ASN 388 Ca 0.52 -1.00 0.00 0.00 -0.60 0.00 0.00 54.58 53.50 3gmj n ASN 388 Cb 0.69 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.94 3gmj n ASN 388 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 3gmj n GLY 389 N 0.00 1.79 0.10 8.20 0.00 -1.18 -4.65 105.19 109.46 3gmj n GLY 389 Ca 0.00 -2.05 -0.17 0.00 0.00 0.00 0.00 46.02 43.80 3gmj n GLY 389 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 3gmj n PHE 390 N -1.52 0.39 0.31 1.61 -0.00 -1.26 -4.07 117.46 112.91 3gmj n PHE 390 Ca 0.00 0.17 0.15 0.00 -0.00 0.00 0.00 57.45 57.77 3gmj n PHE 390 Cb 0.00 -0.83 0.83 0.00 -0.00 0.00 0.00 39.48 39.47 3gmj n PHE 390 CO 0.00 0.00 0.00 1.49 -0.00 0.00 0.00 176.76 178.25 3gmj h GLU 391 N -1.00 0.00 0.03 -4.13 4.81 -1.93 0.26 114.58 112.63 3gmj h GLU 391 Ca -0.29 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 58.93 3gmj h GLU 391 Cb 1.16 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.54 3gmj h GLU 391 CO -0.18 0.00 -0.02 0.00 -0.73 0.00 0.00 179.01 178.09 3gmj h ALA 392 N 1.47 -0.04 0.00 2.92 0.00 -1.83 -2.58 119.26 119.20 3gmj h ALA 392 Ca 0.00 -0.09 -0.02 0.00 0.00 0.00 0.00 54.91 54.80 3gmj h ALA 392 Cb 0.51 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.31 3gmj h ALA 392 CO 0.00 -0.44 -0.10 -0.24 0.00 0.00 0.00 179.25 178.47 3gmj h VAL 393 N -0.20 0.18 -0.51 0.00 3.04 -0.68 -3.20 116.25 114.88 3gmj h VAL 393 Ca -0.00 -1.18 -0.09 0.00 -1.01 0.00 0.00 66.70 64.42 3gmj h VAL 393 Cb 0.19 2.03 -0.02 0.00 -2.01 0.00 0.00 31.29 31.47 3gmj h VAL 393 CO 0.01 0.10 -0.03 0.22 -1.01 0.00 0.00 177.57 176.86 3gmj h TYR 394 N 0.00 0.95 0.00 3.17 5.03 -0.85 -2.76 116.97 122.51 3gmj h TYR 394 Ca -0.00 -0.15 -0.05 0.00 2.58 0.00 0.00 58.73 61.11 3gmj h TYR 394 Cb 1.02 -0.25 -0.01 0.00 1.55 0.00 0.00 36.73 39.04 3gmj h TYR 394 CO 0.00 0.88 -0.22 0.93 -1.32 0.00 0.00 178.16 178.43 3gmj h GLU 395 N 0.81 0.00 -0.19 1.82 4.39 -1.45 -1.72 114.58 118.24 3gmj h GLU 395 Ca 0.15 0.00 0.06 0.00 0.34 0.00 0.00 59.36 59.90 3gmj h GLU 395 Cb 0.52 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.16 3gmj h GLU 395 CO 0.03 0.22 0.15 -0.07 -1.16 0.00 0.00 179.01 178.18 3gmj h LEU 396 N 0.00 0.00 -1.72 1.33 3.38 -1.57 0.44 115.31 117.17 3gmj h LEU 396 Ca -0.00 0.00 0.40 0.00 0.09 0.00 0.00 57.88 58.37 3gmj h LEU 396 Cb 0.48 0.00 -0.08 0.00 0.09 0.00 0.00 40.66 41.15 3gmj h LEU 396 CO 0.03 0.00 0.93 0.74 0.09 0.00 0.00 178.44 180.23 3gmj h THR 397 N 0.00 0.27 0.00 0.22 2.02 -1.41 0.64 112.91 114.65 3gmj h THR 397 Ca 0.09 -0.03 0.00 0.00 0.77 0.00 0.00 66.41 67.24 3gmj h THR 397 Cb 0.39 0.17 0.00 0.00 -1.74 0.00 0.00 68.15 66.97 3gmj h THR 397 CO -0.00 0.02 0.00 0.11 0.37 0.00 0.00 175.52 176.02 3gmj h LYS 398 N 0.10 0.00 0.00 6.66 1.57 -0.29 -3.16 116.57 121.46 3gmj h LYS 398 Ca 0.71 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 59.48 3gmj h LYS 398 Cb 2.50 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 34.81 3gmj h LYS 398 CO -0.17 0.00 -0.09 0.52 -0.57 0.00 0.00 179.45 179.14 3gmj h MET 399 N 0.00 0.00 -0.06 3.15 2.86 0.17 -3.29 114.93 117.76 3gmj h MET 399 Ca 0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 3gmj h MET 399 Cb 0.54 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.20 3gmj h MET 399 CO 0.00 0.03 0.00 0.00 1.06 0.00 0.00 176.91 178.00 3gmj s THR 401 N -1.94 3.10 -0.05 0.00 2.01 -1.24 -0.84 115.64 116.67 3gmj s THR 401 Ca 0.36 -0.70 0.03 0.00 0.31 0.00 0.00 61.69 61.70 3gmj s THR 401 Cb 0.20 -2.23 0.01 0.00 0.01 0.00 0.00 72.50 70.49 3gmj s THR 401 CO 0.32 0.58 -0.14 -0.63 -0.69 0.00 0.00 174.62 174.06 3gmj s ILE 402 N -0.54 1.21 -0.05 1.82 1.01 -0.24 -4.65 121.20 119.76 3gmj s ILE 402 Ca 0.07 -0.56 0.01 0.00 0.00 0.00 0.00 60.65 60.18 3gmj s ILE 402 Cb -0.12 -1.07 -0.03 0.00 0.01 0.00 0.00 42.46 41.25 3gmj s ILE 402 CO 0.01 0.36 -0.05 -0.13 0.00 0.00 0.00 174.94 175.13 3gmj s ARG 403 N 0.37 2.75 -0.08 2.79 0.52 -1.07 -0.40 118.95 123.83 3gmj s ARG 403 Ca -0.09 -0.56 -0.04 0.00 -0.52 0.00 0.00 55.73 54.51 3gmj s ARG 403 Cb -0.13 -2.61 0.04 0.00 0.52 0.00 0.00 34.95 32.76 3gmj s ARG 403 CO 0.03 0.66 0.18 1.41 0.02 0.00 0.00 175.30 177.59 3gmj s MET 404 N -0.97 0.15 0.03 3.54 -2.45 -0.81 -0.29 119.30 118.50 3gmj s MET 404 Ca 0.14 0.39 0.05 0.00 -1.25 0.00 0.00 55.69 55.01 3gmj s MET 404 Cb -0.11 -0.10 -0.03 0.00 1.25 0.00 0.00 34.83 35.83 3gmj s MET 404 CO 0.03 -0.13 -0.10 0.45 1.05 0.00 0.00 175.02 176.32 3gmj s SER 405 N 0.96 4.41 -0.26 1.11 0.15 0.57 -1.02 113.70 119.62 3gmj s SER 405 Ca -0.07 -0.24 -0.11 0.00 0.70 0.00 0.00 55.95 56.23 3gmj s SER 405 Cb -0.09 -0.94 -0.05 0.00 -1.71 0.00 0.00 66.02 63.23 3gmj s SER 405 CO -0.05 0.26 0.18 -0.36 1.20 0.00 0.00 173.24 174.47 3gmj s PHE 406 N -1.02 3.27 0.00 3.44 0.08 -0.51 -0.41 117.98 122.84 3gmj s PHE 406 Ca 0.17 0.18 0.00 0.00 0.12 0.00 0.00 56.93 57.41 3gmj s PHE 406 Cb -0.11 -2.34 0.00 0.00 -0.57 0.00 0.00 43.02 40.00 3gmj s PHE 406 CO 0.08 -0.06 0.00 0.28 -0.10 0.00 0.00 175.22 175.42 3gmj n VAL 407 N 4.70 0.00 -2.02 -0.44 0.31 0.12 -4.66 118.33 116.34 3gmj n VAL 407 Ca -0.14 0.00 -0.42 0.00 -0.01 0.00 0.00 64.34 63.77 3gmj n VAL 407 Cb 0.52 0.00 -0.03 0.00 -0.91 0.00 0.00 33.84 33.42 3gmj n VAL 407 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 3gmj s LYS 408 N 0.00 4.27 0.57 5.55 -0.14 -1.26 -4.69 119.74 124.05 3gmj s LYS 408 Ca 0.00 2.28 0.07 0.00 -1.36 0.00 0.00 55.97 56.96 3gmj s LYS 408 Cb 0.00 -3.13 0.08 0.00 -1.68 0.00 0.00 37.83 33.10 3gmj s LYS 408 CO 0.00 -0.44 0.79 0.20 -0.76 0.00 0.00 175.35 175.14 3gmj s GLY 409 N 0.56 1.78 0.07 -3.33 0.00 -1.26 -4.84 107.32 100.29 3gmj s GLY 409 Ca 0.61 -1.94 -0.11 0.00 0.00 0.00 0.00 44.72 43.29 3gmj s GLY 409 CO 0.40 -1.52 0.23 0.66 0.00 0.00 0.00 173.10 172.87 3gmj s TRP 410 N -2.71 0.04 0.00 1.90 -2.14 -1.26 -4.66 118.94 110.11 3gmj s TRP 410 Ca 0.61 -0.34 0.00 0.00 2.66 0.00 0.00 56.10 59.03 3gmj s TRP 410 Cb -0.07 0.01 0.00 0.00 -3.10 0.00 0.00 33.47 30.31 3gmj s TRP 410 CO 0.39 -0.52 0.00 0.41 -2.66 0.00 0.00 176.95 174.57 3gmj n GLY 411 N 0.26 -0.05 3.69 3.67 0.00 0.69 -4.83 105.19 108.62 3gmj n GLY 411 Ca -0.17 -1.30 -0.50 0.00 0.00 0.00 0.00 46.02 44.05 3gmj n GLY 411 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3gmj n ALA 412 N 3.99 0.66 -0.19 4.61 0.00 -1.26 -1.05 120.51 127.27 3gmj n ALA 412 Ca 0.00 0.30 0.00 0.00 0.00 0.00 0.00 53.44 53.74 3gmj n ALA 412 Cb 0.00 -2.45 0.00 0.00 0.00 0.00 0.00 19.45 17.00 3gmj n ALA 412 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 3gmj n GLU 413 N 6.43 0.00 -4.49 0.00 4.71 -1.26 -5.06 120.64 120.97 3gmj n GLU 413 Ca 0.23 0.00 -0.23 0.00 -0.01 0.00 0.00 57.16 57.15 3gmj n GLU 413 Cb 0.26 -0.55 -0.10 0.00 -1.01 0.00 0.00 31.44 30.04 3gmj n GLU 413 CO 0.00 0.00 0.00 0.71 0.09 0.00 0.00 177.13 177.93 3gmj s TYR 414 N -2.43 2.00 0.06 -0.32 2.02 -0.21 -5.05 117.35 113.41 3gmj s TYR 414 Ca 0.00 -0.97 -0.15 0.00 -0.37 0.00 0.00 57.07 55.58 3gmj s TYR 414 Cb 0.00 -1.34 -0.29 0.00 -0.40 0.00 0.00 41.96 39.93 3gmj s TYR 414 CO 0.00 0.03 1.11 1.25 -1.57 0.00 0.00 175.55 176.36 3gmj h HIS 415 N 2.00 1.03 -2.63 2.71 -0.00 -1.91 -3.44 115.15 112.92 3gmj h HIS 415 Ca -0.41 -0.64 -0.54 0.00 -0.00 0.00 0.00 60.37 58.78 3gmj h HIS 415 Cb 1.25 -0.08 0.01 0.00 -0.00 0.00 0.00 27.41 28.58 3gmj h HIS 415 CO 0.75 1.48 1.05 1.03 -0.00 0.00 0.00 177.93 182.25 3gmj s ARG 416 N -3.00 4.19 -0.08 5.26 0.52 -1.26 -4.88 118.95 119.70 3gmj s ARG 416 Ca -0.09 2.29 0.16 0.00 -0.52 0.00 0.00 55.73 57.56 3gmj s ARG 416 Cb 0.06 -3.82 -0.24 0.00 0.52 0.00 0.00 34.95 31.46 3gmj s ARG 416 CO 0.94 -0.80 0.25 1.04 0.02 0.00 0.00 175.30 176.75 3gmj n GLN 417 N 6.45 0.86 -4.60 3.54 1.13 -1.26 0.25 117.38 123.74 3gmj n GLN 417 Ca 0.17 -0.10 -0.28 0.00 -1.94 0.00 0.00 57.00 54.85 3gmj n GLN 417 Cb 0.42 -1.41 -0.14 0.00 0.11 0.00 0.00 30.24 29.22 3gmj n GLN 417 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 3gmj s ASP 418 N -4.36 3.01 0.52 1.08 -0.00 -1.26 -4.00 116.67 111.66 3gmj s ASP 418 Ca -0.07 -0.65 0.21 0.00 -0.00 0.00 0.00 52.55 52.05 3gmj s ASP 418 Cb 0.09 -0.23 1.37 0.00 -0.00 0.00 0.00 42.92 44.14 3gmj s ASP 418 CO 0.69 0.19 2.11 1.62 -0.00 0.00 0.00 175.17 179.78 3gmj h VAL 419 N 4.11 0.84 0.00 -1.27 3.04 -1.96 0.11 116.25 121.11 3gmj h VAL 419 Ca -0.47 -0.29 0.00 0.00 -1.01 0.00 0.00 66.70 64.92 3gmj h VAL 419 Cb 1.16 1.17 0.00 0.00 -2.01 0.00 0.00 31.29 31.61 3gmj h VAL 419 CO 0.42 0.08 0.00 0.35 -1.01 0.00 0.00 177.57 177.40 3gmj n THR 420 N -4.12 1.21 0.22 3.17 -2.24 -1.26 -0.86 114.28 110.40 3gmj n THR 420 Ca -0.03 0.37 0.12 0.00 -2.27 0.00 0.00 64.05 62.24 3gmj n THR 420 Cb 0.16 -1.25 0.10 0.00 -2.10 0.00 0.00 70.33 67.25 3gmj n THR 420 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 3gmj h SER 421 N 0.00 0.00 -3.90 3.42 0.02 -1.02 -3.30 113.55 108.77 3gmj h SER 421 Ca 0.00 -0.02 -0.46 0.00 -0.84 0.00 0.00 61.79 60.46 3gmj h SER 421 Cb 0.18 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 62.70 3gmj h SER 421 CO 0.00 0.01 0.32 0.42 -1.14 0.00 0.00 176.83 176.44 3gmj s THR 422 N -3.27 4.29 0.16 -2.27 -4.23 -0.04 -4.90 115.64 105.39 3gmj s THR 422 Ca 0.04 1.68 -0.03 0.00 -1.18 0.00 0.00 61.69 62.20 3gmj s THR 422 Cb 0.08 -3.88 -0.13 0.00 1.34 0.00 0.00 72.50 69.91 3gmj s THR 422 CO 0.73 0.02 1.39 -0.65 -0.54 0.00 0.00 174.62 175.56 3gmj h PRO 423 N 2.83 0.43 -3.45 3.99 0.11 -1.90 -2.40 132.00 131.62 3gmj h PRO 423 Ca -0.47 -0.38 -0.43 0.00 0.11 0.00 0.00 66.00 64.82 3gmj h PRO 423 Cb 1.19 0.09 -0.39 0.00 0.11 0.00 0.00 31.00 31.99 3gmj h PRO 423 CO 0.64 1.02 -0.76 0.00 -0.21 0.00 0.00 178.00 178.70 3gmj s TRP 425 N 2.04 -0.39 0.24 0.00 1.48 -0.87 -1.42 118.94 120.03 3gmj s TRP 425 Ca 0.04 0.26 0.09 0.00 -1.06 0.00 0.00 56.10 55.42 3gmj s TRP 425 Cb -0.13 0.38 -0.05 0.00 -1.16 0.00 0.00 33.47 32.50 3gmj s TRP 425 CO -0.06 -0.72 -0.15 0.96 -4.06 0.00 0.00 176.95 172.92 3gmj s ILE 426 N -3.23 2.02 -0.11 0.66 -4.36 -0.19 -0.07 121.20 115.92 3gmj s ILE 426 Ca -0.01 -2.28 0.01 0.00 -0.26 0.00 0.00 60.65 58.11 3gmj s ILE 426 Cb 0.00 -2.20 0.02 0.00 1.25 0.00 0.00 42.46 41.53 3gmj s ILE 426 CO -0.08 -0.48 -0.11 -0.70 0.24 0.00 0.00 174.94 173.80 3gmj s GLU 427 N -3.60 1.85 -0.23 0.37 2.12 0.16 -1.92 118.70 117.45 3gmj s GLU 427 Ca 0.26 -0.40 -0.03 0.00 0.36 0.00 0.00 54.97 55.15 3gmj s GLU 427 Cb -0.02 -1.72 -0.00 0.00 0.26 0.00 0.00 34.13 32.65 3gmj s GLU 427 CO 0.11 -0.17 -0.05 0.42 -0.54 0.00 0.00 175.26 175.03 3gmj s ILE 428 N 1.33 3.26 -0.25 -3.70 1.01 0.46 -1.00 121.20 122.32 3gmj s ILE 428 Ca -0.01 -0.60 -0.10 0.00 0.00 0.00 0.00 60.65 59.94 3gmj s ILE 428 Cb -0.14 -2.51 -0.05 0.00 0.01 0.00 0.00 42.46 39.77 3gmj s ILE 428 CO -0.05 0.38 0.16 -1.00 0.00 0.00 0.00 174.94 174.43 3gmj s HIS 429 N 1.45 3.28 -0.53 3.97 3.76 0.11 -1.08 115.29 126.25 3gmj s HIS 429 Ca 0.05 0.17 -0.21 0.00 -0.15 0.00 0.00 55.06 54.92 3gmj s HIS 429 Cb -0.15 -2.29 0.06 0.00 1.11 0.00 0.00 32.58 31.31 3gmj s HIS 429 CO -0.04 -0.00 0.74 -0.51 -0.85 0.00 0.00 174.74 174.08 3gmj s LEU 430 N 1.22 4.71 0.39 0.89 1.02 -0.02 -1.34 118.68 125.55 3gmj s LEU 430 Ca 0.07 -0.78 0.21 0.00 0.02 0.00 0.00 54.13 53.65 3gmj s LEU 430 Cb -0.14 -2.55 0.69 0.00 0.02 0.00 0.00 46.19 44.21 3gmj s LEU 430 CO 0.06 -1.03 1.73 0.45 0.02 0.00 0.00 176.35 177.58 3gmj h HIS 431 N 9.12 0.00 0.08 0.29 3.86 -1.29 -2.99 115.15 124.22 3gmj h HIS 431 Ca -0.27 0.00 -0.00 0.00 -1.16 0.00 0.00 60.37 58.94 3gmj h HIS 431 Cb 1.09 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 29.55 3gmj h HIS 431 CO 0.81 0.32 -0.12 0.78 0.86 0.00 0.00 177.93 180.58 3gmj h GLY 432 N 2.33 -0.99 -0.13 2.45 0.00 -1.82 -2.63 103.07 102.27 3gmj h GLY 432 Ca -0.00 0.45 0.12 0.00 0.00 0.00 0.00 47.33 47.89 3gmj h GLY 432 CO 0.04 -0.35 -0.12 -2.55 0.00 0.00 0.00 176.54 173.57 3gmj h PRO 433 N -0.21 0.02 -0.97 4.80 0.11 -1.93 -2.50 132.00 131.32 3gmj h PRO 433 Ca -0.01 -0.00 0.10 0.00 0.11 0.00 0.00 66.00 66.20 3gmj h PRO 433 Cb 0.20 -0.00 -0.07 0.00 0.11 0.00 0.00 31.00 31.23 3gmj h PRO 433 CO -0.04 0.01 0.62 -0.07 -0.21 0.00 0.00 178.00 178.31 3gmj h LEU 434 N 0.02 0.90 -0.44 2.35 3.38 -1.54 0.62 115.31 120.61 3gmj h LEU 434 Ca 0.28 0.03 -0.09 0.00 0.09 0.00 0.00 57.88 58.20 3gmj h LEU 434 Cb 0.44 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.02 3gmj h LEU 434 CO -0.58 0.51 -0.06 -0.61 0.09 0.00 0.00 178.44 177.79 3gmj h GLN 435 N 0.98 0.82 -0.37 1.13 4.15 -1.06 0.11 115.11 120.87 3gmj h GLN 435 Ca 0.46 -0.29 -0.13 0.00 0.77 0.00 0.00 58.65 59.46 3gmj h GLN 435 Cb 0.42 -0.06 -0.01 0.00 0.21 0.00 0.00 27.48 28.04 3gmj h GLN 435 CO -0.22 0.91 -0.28 -1.49 -1.93 0.00 0.00 178.83 175.82 3gmj h TRP 436 N 0.65 0.99 -0.49 3.99 6.55 -1.26 -1.30 115.95 125.08 3gmj h TRP 436 Ca 0.12 -0.28 0.04 0.00 0.95 0.00 0.00 58.89 59.73 3gmj h TRP 436 Cb 0.58 -0.22 -0.04 0.00 -0.86 0.00 0.00 29.16 28.62 3gmj h TRP 436 CO 0.04 1.06 0.25 1.25 -1.05 0.00 0.00 178.44 179.99 3gmj h LEU 437 N 0.63 0.35 -0.45 -4.49 5.85 -0.87 -2.59 115.31 113.74 3gmj h LEU 437 Ca 0.07 0.03 0.03 0.00 0.84 0.00 0.00 57.88 58.85 3gmj h LEU 437 Cb 0.85 -0.04 -0.03 0.00 0.37 0.00 0.00 40.66 41.81 3gmj h LEU 437 CO 0.07 0.24 0.25 -0.78 -0.34 0.00 0.00 178.44 177.89 3gmj h ASP 438 N 0.48 0.39 -0.81 1.25 1.82 -0.48 -0.78 116.42 118.29 3gmj h ASP 438 Ca 0.22 0.01 0.15 0.00 -0.39 0.00 0.00 57.03 57.02 3gmj h ASP 438 Cb 0.13 -0.07 -0.10 0.00 0.68 0.00 0.00 39.33 39.98 3gmj h ASP 438 CO -0.16 0.28 0.38 0.11 -1.61 0.00 0.00 179.24 178.24 3gmj h LYS 439 N 0.50 0.52 -0.03 0.28 6.56 -0.88 -2.38 116.57 121.15 3gmj h LYS 439 Ca 0.19 -0.03 -0.01 0.00 -1.06 0.00 0.00 60.65 59.74 3gmj h LYS 439 Cb 0.05 -0.12 -0.00 0.00 -0.57 0.00 0.00 32.23 31.60 3gmj h LYS 439 CO -0.11 0.34 -0.02 0.28 -2.06 0.00 0.00 179.45 177.88 3gmj h VAL 440 N 0.53 1.38 -0.83 0.50 2.07 -1.01 -3.34 116.25 115.56 3gmj h VAL 440 Ca 0.45 -1.17 -0.03 0.00 0.82 0.00 0.00 66.70 66.77 3gmj h VAL 440 Cb 0.67 2.11 -0.04 0.00 -1.52 0.00 0.00 31.29 32.51 3gmj h VAL 440 CO -0.39 0.31 0.39 -0.07 0.02 0.00 0.00 177.57 177.84 3gmj h LEU 441 N -0.40 1.08 -1.21 2.57 3.38 -0.85 -2.08 115.31 117.80 3gmj h LEU 441 Ca 0.00 -0.13 0.00 0.00 0.09 0.00 0.00 57.88 57.84 3gmj h LEU 441 Cb 0.52 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 40.99 3gmj h LEU 441 CO 0.01 0.91 0.00 0.35 0.09 0.00 0.00 178.44 179.80 3gmj n THR 442 N -4.31 1.06 -3.63 0.22 -2.24 -0.92 -2.78 114.28 101.68 3gmj n THR 442 Ca 0.08 0.63 -0.34 0.00 -2.27 0.00 0.00 64.05 62.15 3gmj n THR 442 Cb 0.14 -1.61 -0.07 0.00 -2.10 0.00 0.00 70.33 66.69 3gmj n THR 442 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3gmj n GLN 443 N -2.20 2.59 -0.35 -0.78 6.02 -0.78 -5.01 117.38 116.86 3gmj n GLN 443 Ca -0.01 -4.51 0.00 0.00 -0.01 0.00 0.00 57.00 52.47 3gmj n GLN 443 Cb 0.07 -2.38 0.00 0.00 1.02 0.00 0.00 30.24 28.95 3gmj n GLN 443 CO 0.00 0.00 0.00 -1.33 -1.01 0.00 0.00 177.06 174.72 3gmj n MET 444 N 1.99 0.00 -3.93 -1.09 2.81 -1.12 -4.97 117.12 110.81 3gmj n MET 444 Ca 0.23 0.00 -0.10 0.00 -1.81 0.00 0.00 57.70 56.02 3gmj n MET 444 Cb 0.37 0.00 -0.11 0.00 -0.71 0.00 0.00 33.22 32.77 3gmj n MET 444 CO 0.00 0.00 0.00 0.20 1.51 0.00 0.00 175.97 177.68 3gmj s GLY 445 N -0.96 0.14 1.00 3.03 0.00 -1.26 -5.13 107.32 104.15 3gmj s GLY 445 Ca 0.00 -0.34 -0.16 0.00 0.00 0.00 0.00 44.72 44.22 3gmj s GLY 445 CO 0.00 -0.42 0.02 -1.14 0.00 0.00 0.00 173.10 171.56 3gmj n SER 446 N 1.83 -2.78 -4.45 1.64 3.41 -1.26 -4.82 113.62 107.18 3gmj n SER 446 Ca -0.22 0.18 -0.28 0.00 -0.26 0.00 0.00 58.87 58.29 3gmj n SER 446 Cb 0.56 -1.04 0.26 0.00 -0.26 0.00 0.00 64.21 63.73 3gmj n SER 446 CO 0.00 0.00 0.00 -2.84 -0.16 0.00 0.00 175.04 172.04 3gmj s PRO 447 N -3.26 -1.17 0.00 4.33 0.02 -1.26 -5.02 135.00 128.64 3gmj s PRO 447 Ca 0.53 0.78 0.00 0.00 0.02 0.00 0.00 61.00 62.33 3gmj s PRO 447 Cb -0.17 -1.53 0.00 0.00 0.02 0.00 0.00 34.50 32.83 3gmj s PRO 447 CO 0.69 -3.87 0.00 1.58 -0.33 0.00 0.00 177.00 175.07 3gmj n HIS 448 N -5.01 0.00 -1.50 6.54 -0.00 -1.26 -4.56 115.22 109.42 3gmj n HIS 448 Ca 0.03 0.00 -0.37 0.00 -0.00 0.00 0.00 57.72 57.38 3gmj n HIS 448 Cb 0.54 0.00 -0.15 0.00 -0.00 0.00 0.00 29.99 30.38 3gmj n HIS 448 CO 0.00 0.00 0.00 -1.71 -0.00 0.00 0.00 176.34 174.63 3gmj n ASN 449 N 0.00 0.14 -3.35 0.26 5.15 -1.26 -4.84 115.26 111.35 3gmj n ASN 449 Ca 0.00 -0.02 -0.18 0.00 -0.60 0.00 0.00 54.58 53.78 3gmj n ASN 449 Cb 0.00 -0.91 0.17 0.00 -0.53 0.00 0.00 39.78 38.52 3gmj n ASN 449 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3gmj n ALA 450 N 10.11 -3.12 -2.76 5.20 0.00 -1.26 -4.98 120.51 123.70 3gmj n ALA 450 Ca 0.64 -0.91 -0.27 0.00 0.00 0.00 0.00 53.44 52.91 3gmj n ALA 450 Cb 0.09 -0.08 -0.16 0.00 0.00 0.00 0.00 19.45 19.30 3gmj n ALA 450 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 177.50 176.00 3gmj s ILE 451 N -1.90 1.51 0.48 0.00 2.07 -1.26 -5.12 121.20 116.98 3gmj s ILE 451 Ca 0.40 -0.78 -0.20 0.00 -1.41 0.00 0.00 60.65 58.66 3gmj s ILE 451 Cb -0.07 -1.29 -0.09 0.00 0.13 0.00 0.00 42.46 41.15 3gmj s ILE 451 CO 0.33 0.43 1.01 -0.55 -1.91 0.00 0.00 174.94 174.25 3gmj s SER 452 N -0.12 6.50 0.00 4.50 0.15 -1.26 -4.95 113.70 118.52 3gmj s SER 452 Ca -0.01 1.81 0.23 0.00 0.70 0.00 0.00 55.95 58.68 3gmj s SER 452 Cb -0.11 -2.55 0.03 0.00 -1.71 0.00 0.00 66.02 61.69 3gmj s SER 452 CO 0.01 -0.67 1.09 -1.54 1.20 0.00 0.00 173.24 173.34 3gmj n SER 453 N -1.01 1.41 -0.11 5.45 3.41 -1.26 -4.49 113.62 117.03 3gmj n SER 453 Ca 0.08 -1.15 -0.20 0.00 -0.26 0.00 0.00 58.87 57.33 3gmj n SER 453 Cb 0.53 0.62 -0.08 0.00 -0.26 0.00 0.00 64.21 65.02 3gmj n SER 453 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 3gmj n VAL 454 N -0.76 1.19 1.18 -3.33 0.31 -1.26 -5.39 118.33 110.26 3gmj n VAL 454 Ca 0.07 -0.35 0.09 0.00 -0.01 0.00 0.00 64.34 64.14 3gmj n VAL 454 Cb 0.39 -1.61 0.56 0.00 -0.91 0.00 0.00 33.84 32.27 3gmj n VAL 454 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97