#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1svm s GLN 267 N 0.00 1.40 0.46 1.97 -2.07 -1.26 -5.07 119.66 115.09 1svm s GLN 267 Ca 0.00 -1.26 -0.24 0.00 -1.82 0.00 0.00 55.36 52.04 1svm s GLN 267 Cb 0.00 -1.79 -0.07 0.00 -1.09 0.00 0.00 33.01 30.06 1svm s GLN 267 CO 0.00 0.43 1.29 0.08 -1.32 0.00 0.00 175.29 175.77 1svm s VAL 268 N -1.03 2.56 -0.42 3.63 1.01 -1.26 -4.98 120.40 119.91 1svm s VAL 268 Ca 0.12 0.46 -0.20 0.00 0.00 0.00 0.00 61.98 62.35 1svm s VAL 268 Cb -0.10 -3.25 0.02 0.00 0.00 0.00 0.00 36.38 33.05 1svm s VAL 268 CO 0.05 0.03 0.61 -0.55 0.00 0.00 0.00 175.10 175.24 1svm s SER 269 N -0.95 6.32 0.23 3.32 0.15 -1.26 -4.92 113.70 116.59 1svm s SER 269 Ca 0.63 -0.28 -0.05 0.00 0.70 0.00 0.00 55.95 56.95 1svm s SER 269 Cb -0.36 -2.31 0.23 0.00 -1.71 0.00 0.00 66.02 61.86 1svm s SER 269 CO 0.45 -0.71 1.73 -0.50 1.20 0.00 0.00 173.24 175.40 1svm h TRP 270 N 8.78 1.01 -0.66 3.44 4.06 -1.98 -2.89 115.95 127.71 1svm h TRP 270 Ca -0.26 -0.14 0.04 0.00 2.06 0.00 0.00 58.89 60.59 1svm h TRP 270 Cb 1.10 -0.28 -0.04 0.00 -1.00 0.00 0.00 29.16 28.95 1svm h TRP 270 CO 0.72 0.88 0.44 -0.22 -3.56 0.00 0.00 178.44 176.70 1svm h LYS 271 N 0.88 0.73 -0.52 0.49 1.63 -1.98 -1.50 116.57 116.30 1svm h LYS 271 Ca 0.17 -0.04 -0.10 0.00 -0.85 0.00 0.00 60.65 59.83 1svm h LYS 271 Cb 0.45 -0.16 -0.02 0.00 -0.60 0.00 0.00 32.23 31.90 1svm h LYS 271 CO 0.02 0.48 -0.06 -0.07 -3.45 0.00 0.00 179.45 176.37 1svm h LEU 272 N 0.75 0.96 -0.77 5.20 4.07 -1.93 0.57 115.31 124.15 1svm h LEU 272 Ca 0.27 -0.33 -0.04 0.00 0.08 0.00 0.00 57.88 57.86 1svm h LEU 272 Cb 0.13 -0.26 -0.03 0.00 1.08 0.00 0.00 40.66 41.58 1svm h LEU 272 CO -0.08 1.07 0.33 0.58 -1.08 0.00 0.00 178.44 179.25 1svm h VAL 273 N 0.83 1.26 -0.59 1.22 2.07 -1.38 -1.33 116.25 118.33 1svm h VAL 273 Ca 0.14 -0.78 -0.03 0.00 0.82 0.00 0.00 66.70 66.85 1svm h VAL 273 Cb 0.61 0.32 -0.03 0.00 -1.52 0.00 0.00 31.29 30.68 1svm h VAL 273 CO 0.04 0.32 0.26 0.74 0.02 0.00 0.00 177.57 178.95 1svm h THR 274 N 1.11 1.22 -0.79 2.57 2.02 -0.90 -1.07 112.91 117.07 1svm h THR 274 Ca 0.26 -0.65 0.00 0.00 0.77 0.00 0.00 66.41 66.79 1svm h THR 274 Cb 0.19 0.56 -0.04 0.00 -1.74 0.00 0.00 68.15 67.12 1svm h THR 274 CO -0.02 0.26 0.50 -0.33 0.37 0.00 0.00 175.52 176.29 1svm h GLU 275 N 0.80 1.06 -0.48 6.66 5.08 -0.44 0.66 114.58 127.92 1svm h GLU 275 Ca 0.20 -0.08 -0.01 0.00 -1.00 0.00 0.00 59.36 58.46 1svm h GLU 275 Cb 0.16 -0.23 -0.02 0.00 0.50 0.00 0.00 28.75 29.16 1svm h GLU 275 CO -0.02 0.73 0.25 -0.92 -1.00 0.00 0.00 179.01 178.04 1svm h TYR 276 N 1.08 0.66 -0.47 4.33 3.20 -0.89 0.39 116.97 125.27 1svm h TYR 276 Ca 0.29 -0.02 -0.00 0.00 3.14 0.00 0.00 58.73 62.13 1svm h TYR 276 Cb -0.08 -0.21 -0.02 0.00 1.54 0.00 0.00 36.73 37.96 1svm h TYR 276 CO -0.01 0.51 0.27 0.00 -1.64 0.00 0.00 178.16 177.29 1svm h ALA 277 N 1.09 0.59 -0.18 1.82 0.00 -0.56 -1.52 119.26 120.51 1svm h ALA 277 Ca 0.17 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 1svm h ALA 277 Cb 0.08 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 1svm h ALA 277 CO -0.02 0.09 0.08 0.52 0.00 0.00 0.00 179.25 179.91 1svm h MET 278 N 0.62 0.26 0.00 0.00 2.86 -0.63 0.25 114.93 118.29 1svm h MET 278 Ca 0.17 -0.04 -0.03 0.00 -2.06 0.00 0.00 59.70 57.73 1svm h MET 278 Cb 0.01 -0.04 -0.00 0.00 0.06 0.00 0.00 31.60 31.62 1svm h MET 278 CO -0.03 0.32 -0.15 0.93 1.06 0.00 0.00 176.91 179.04 1svm h GLU 279 N 0.14 0.00 -0.12 1.72 5.08 -0.78 -1.88 114.58 118.75 1svm h GLU 279 Ca 0.06 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.42 1svm h GLU 279 Cb 0.15 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.40 1svm h GLU 279 CO -0.01 0.15 0.00 2.41 -1.00 0.00 0.00 179.01 180.56 1svm n THR 280 N -4.22 0.12 -3.87 1.13 -1.04 -0.58 -4.96 114.28 100.85 1svm n THR 280 Ca -0.02 -0.56 -0.30 0.00 -2.04 0.00 0.00 64.05 61.13 1svm n THR 280 Cb 0.22 1.37 0.02 0.00 -1.82 0.00 0.00 70.33 70.12 1svm n THR 280 CO 0.00 0.00 0.00 0.29 -0.64 0.00 0.00 175.07 174.72 1svm n LYS 281 N 1.38 -5.18 -3.03 -2.82 4.76 0.71 -4.91 118.16 109.07 1svm n LYS 281 Ca 0.15 0.58 -0.42 0.00 -2.87 0.00 0.00 58.31 55.75 1svm n LYS 281 Cb 0.60 -5.45 -0.06 0.00 -1.84 0.00 0.00 35.03 28.28 1svm n LYS 281 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1svm n ASP 283 N 6.31 3.30 -4.26 0.00 5.68 -1.26 -4.63 116.55 121.69 1svm n ASP 283 Ca 0.01 -3.16 -0.37 0.00 -0.50 0.00 0.00 54.79 50.78 1svm n ASP 283 Cb 0.48 -0.53 -0.13 0.00 -1.14 0.00 0.00 41.12 39.80 1svm n ASP 283 CO 0.00 0.00 0.00 -0.62 -1.33 0.00 0.00 177.20 175.25 1svm s ASP 284 N -2.26 5.07 0.20 -1.12 -1.08 -1.26 -5.00 116.67 111.21 1svm s ASP 284 Ca 0.40 -1.05 -0.10 0.00 -0.52 0.00 0.00 52.55 51.28 1svm s ASP 284 Cb 0.34 -1.81 0.23 0.00 -1.46 0.00 0.00 42.92 40.22 1svm s ASP 284 CO 0.06 -0.26 1.79 0.58 0.52 0.00 0.00 175.17 177.86 1svm h VAL 285 N 6.18 0.93 -0.33 1.11 2.07 -1.91 -1.06 116.25 123.25 1svm h VAL 285 Ca -0.25 -0.21 -0.13 0.00 0.82 0.00 0.00 66.70 66.93 1svm h VAL 285 Cb 1.09 0.27 -0.01 0.00 -1.52 0.00 0.00 31.29 31.12 1svm h VAL 285 CO 0.58 0.11 -0.32 -0.07 0.02 0.00 0.00 177.57 177.89 1svm h LEU 286 N 0.61 0.75 -0.45 2.57 3.38 -1.98 -1.38 115.31 118.82 1svm h LEU 286 Ca 0.29 -0.31 -0.05 0.00 0.09 0.00 0.00 57.88 57.90 1svm h LEU 286 Cb 0.21 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.74 1svm h LEU 286 CO -0.20 1.01 0.08 0.25 0.09 0.00 0.00 178.44 179.67 1svm h LEU 287 N 0.61 0.71 -0.04 1.67 6.46 -1.92 -0.86 115.31 121.94 1svm h LEU 287 Ca 0.07 -0.26 -0.00 0.00 -0.12 0.00 0.00 57.88 57.57 1svm h LEU 287 Cb 0.84 -0.19 -0.00 0.00 -0.73 0.00 0.00 40.66 40.58 1svm h LEU 287 CO 0.07 0.79 0.03 0.25 -0.62 0.00 0.00 178.44 178.96 1svm h LEU 288 N 0.61 0.05 -0.17 2.25 5.85 -1.04 -0.47 115.31 122.39 1svm h LEU 288 Ca 0.14 -0.03 0.04 0.00 0.84 0.00 0.00 57.88 58.86 1svm h LEU 288 Cb 0.38 -0.01 -0.04 0.00 0.37 0.00 0.00 40.66 41.35 1svm h LEU 288 CO 0.01 0.07 -0.08 0.25 -0.34 0.00 0.00 178.44 178.34 1svm h LEU 289 N 0.02 -0.28 -1.07 2.25 5.85 -1.15 -0.12 115.31 120.82 1svm h LEU 289 Ca 0.01 0.07 -0.00 0.00 0.84 0.00 0.00 57.88 58.80 1svm h LEU 289 Cb 0.03 0.15 -0.04 0.00 0.37 0.00 0.00 40.66 41.17 1svm h LEU 289 CO -0.00 -0.11 0.51 1.23 -0.34 0.00 0.00 178.44 179.73 1svm h GLY 290 N -0.07 1.23 1.00 3.75 0.00 -0.98 -1.82 103.07 106.18 1svm h GLY 290 Ca 0.09 -0.50 -0.15 0.00 0.00 0.00 0.00 47.33 46.77 1svm h GLY 290 CO -0.21 0.49 -0.44 -0.33 0.00 0.00 0.00 176.54 176.05 1svm h MET 291 N 1.17 0.69 -0.23 4.80 2.86 -0.63 -3.15 114.93 120.43 1svm h MET 291 Ca 0.30 -0.45 -0.11 0.00 -2.06 0.00 0.00 59.70 57.39 1svm h MET 291 Cb -0.05 0.06 -0.01 0.00 0.06 0.00 0.00 31.60 31.65 1svm h MET 291 CO -0.06 1.07 -0.32 -0.92 1.06 0.00 0.00 176.91 177.74 1svm h TYR 292 N 0.40 0.55 0.00 -0.22 3.20 -0.87 -2.51 116.97 117.52 1svm h TYR 292 Ca 0.01 -0.13 -0.01 0.00 3.14 0.00 0.00 58.73 61.73 1svm h TYR 292 Cb 1.05 -0.13 -0.00 0.00 1.54 0.00 0.00 36.73 39.19 1svm h TYR 292 CO 0.09 0.75 -0.07 -0.07 -1.64 0.00 0.00 178.16 177.21 1svm h LEU 293 N 0.41 0.00 -1.38 2.82 3.38 -1.35 -0.83 115.31 118.37 1svm h LEU 293 Ca 0.05 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.00 1svm h LEU 293 Cb 0.76 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.51 1svm h LEU 293 CO 0.06 0.07 -0.08 -0.33 0.09 0.00 0.00 178.44 178.25 1svm h GLU 294 N 0.00 0.00 -0.00 1.13 5.08 -1.40 -2.92 114.58 116.47 1svm h GLU 294 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1svm h GLU 294 Cb 0.24 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.49 1svm h GLU 294 CO 0.01 0.08 -0.02 1.19 -1.00 0.00 0.00 179.01 179.26 1svm n PHE 295 N -3.22 0.00 0.26 4.33 3.72 -0.32 -3.61 117.46 118.63 1svm n PHE 295 Ca 0.00 0.00 0.15 0.00 -0.05 0.00 0.00 57.45 57.56 1svm n PHE 295 Cb 0.34 -0.33 0.62 0.00 -0.94 0.00 0.00 39.48 39.17 1svm n PHE 295 CO 0.00 0.00 0.00 -0.56 -0.05 0.00 0.00 176.76 176.15 1svm h GLN 296 N 0.05 0.00 -6.93 -1.08 3.07 -1.62 -3.38 115.11 105.21 1svm h GLN 296 Ca 0.00 0.00 -0.49 0.00 0.09 0.00 0.00 58.65 58.25 1svm h GLN 296 Cb 0.35 0.00 0.01 0.00 0.08 0.00 0.00 27.48 27.92 1svm h GLN 296 CO 0.00 0.05 0.18 0.71 0.09 0.00 0.00 178.83 179.86 1svm s TYR 297 N -3.66 3.47 0.27 0.06 2.02 -1.24 -4.58 117.35 113.70 1svm s TYR 297 Ca 0.01 1.13 -0.30 0.00 -0.37 0.00 0.00 57.07 57.54 1svm s TYR 297 Cb 0.09 -2.52 -0.13 0.00 -0.40 0.00 0.00 41.96 39.00 1svm s TYR 297 CO 0.57 -0.18 1.45 -1.13 -1.57 0.00 0.00 175.55 174.69 1svm n SER 298 N -1.42 3.10 0.08 2.29 3.41 -1.26 -4.90 113.62 114.91 1svm n SER 298 Ca 0.03 1.15 0.11 0.00 -0.26 0.00 0.00 58.87 59.91 1svm n SER 298 Cb 0.54 -1.49 -0.03 0.00 -0.26 0.00 0.00 64.21 62.97 1svm n SER 298 CO 0.00 0.00 0.00 2.22 -0.16 0.00 0.00 175.04 177.10 1svm n PHE 299 N 1.79 0.76 -0.39 7.33 1.16 -1.26 -4.22 117.46 122.63 1svm n PHE 299 Ca 0.10 0.22 -0.04 0.00 -1.87 0.00 0.00 57.45 55.86 1svm n PHE 299 Cb 0.34 -0.85 0.00 0.00 -1.61 0.00 0.00 39.48 37.35 1svm n PHE 299 CO 0.00 0.00 0.00 0.93 -1.87 0.00 0.00 176.76 175.82 1svm h GLU 300 N 0.00 -0.01 -0.41 3.97 4.39 -2.02 -0.32 114.58 120.19 1svm h GLU 300 Ca 0.00 0.00 -0.04 0.00 0.34 0.00 0.00 59.36 59.66 1svm h GLU 300 Cb 0.99 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 29.62 1svm h GLU 300 CO 0.00 -0.00 0.03 -1.33 -1.16 0.00 0.00 179.01 176.55 1svm n MET 301 N -5.41 3.44 -1.95 2.33 2.81 -1.26 -5.00 117.12 112.08 1svm n MET 301 Ca 0.08 -2.98 -0.43 0.00 -1.81 0.00 0.00 57.70 52.56 1svm n MET 301 Cb 0.36 -2.00 -0.03 0.00 -0.71 0.00 0.00 33.22 30.85 1svm n MET 301 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1svm h LEU 303 N 12.25 0.03 -0.74 0.00 3.38 -1.94 -1.09 115.31 127.20 1svm h LEU 303 Ca -0.37 -0.02 0.02 0.00 0.09 0.00 0.00 57.88 57.60 1svm h LEU 303 Cb 1.18 -0.01 -0.04 0.00 0.09 0.00 0.00 40.66 41.88 1svm h LEU 303 CO 0.99 0.60 0.48 0.11 0.09 0.00 0.00 178.44 180.71 1svm h LYS 304 N 0.02 0.93 0.44 1.13 1.57 -1.96 0.16 116.57 118.87 1svm h LYS 304 Ca -0.01 -0.06 -0.02 0.00 -1.87 0.00 0.00 60.65 58.70 1svm h LYS 304 Cb 1.02 -0.21 0.00 0.00 0.08 0.00 0.00 32.23 33.13 1svm h LYS 304 CO 0.08 0.61 -0.21 0.00 -0.57 0.00 0.00 179.45 179.36 1svm h ILE 306 N -1.05 1.15 -0.06 0.00 -0.00 -1.15 0.09 117.51 116.50 1svm h ILE 306 Ca -0.06 -0.37 0.00 0.00 -0.00 0.00 0.00 64.86 64.43 1svm h ILE 306 Cb 0.54 -0.01 0.00 0.00 -0.00 0.00 0.00 36.82 37.36 1svm h ILE 306 CO 0.10 0.19 0.00 0.29 -0.00 0.00 0.00 178.15 178.73 1svm n LYS 307 N -4.44 1.39 -4.06 0.16 4.76 0.04 -4.95 118.16 111.06 1svm n LYS 307 Ca 0.11 -0.57 -0.44 0.00 -2.87 0.00 0.00 58.31 54.53 1svm n LYS 307 Cb 0.09 -1.40 0.02 0.00 -1.84 0.00 0.00 35.03 31.90 1svm n LYS 307 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 1svm n LYS 308 N -0.25 -0.32 0.09 1.97 5.02 0.02 -4.90 118.16 119.80 1svm n LYS 308 Ca 0.17 0.08 -0.21 0.00 -2.02 0.00 0.00 58.31 56.33 1svm n LYS 308 Cb 0.22 -2.28 -0.12 0.00 -0.02 0.00 0.00 35.03 32.83 1svm n LYS 308 CO 0.00 0.00 0.00 0.93 -0.52 0.00 0.00 177.40 177.81 1svm h GLU 309 N -2.28 0.60 -3.38 1.97 5.08 -1.72 -3.45 114.58 111.39 1svm h GLU 309 Ca -0.68 -0.79 -0.42 0.00 -1.00 0.00 0.00 59.36 56.47 1svm h GLU 309 Cb 1.35 0.26 -0.39 0.00 0.50 0.00 0.00 28.75 30.47 1svm h GLU 309 CO 0.49 1.36 -0.75 -0.65 -1.00 0.00 0.00 179.01 178.45 1svm s GLN 310 N -2.99 0.18 0.38 2.33 -1.52 -1.26 -5.03 119.66 111.75 1svm s GLN 310 Ca -0.09 0.16 0.12 0.00 -1.95 0.00 0.00 55.36 53.60 1svm s GLN 310 Cb 0.06 -1.00 0.90 0.00 -0.22 0.00 0.00 33.01 32.75 1svm s GLN 310 CO 0.93 -0.41 1.87 -1.35 -0.25 0.00 0.00 175.29 176.08 1svm h PRO 311 N 8.39 0.58 0.00 2.91 0.11 -1.97 0.33 132.00 142.35 1svm h PRO 311 Ca -0.15 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.93 1svm h PRO 311 Cb 1.13 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 32.11 1svm h PRO 311 CO 0.22 0.38 0.00 0.43 -0.21 0.00 0.00 178.00 178.82 1svm n SER 312 N -4.55 0.52 -0.02 -2.05 7.64 -1.26 -2.45 113.62 111.44 1svm n SER 312 Ca 0.18 0.69 -0.04 0.00 1.01 0.00 0.00 58.87 60.71 1svm n SER 312 Cb 0.53 -0.78 -0.01 0.00 -1.01 0.00 0.00 64.21 62.94 1svm n SER 312 CO 0.00 0.00 0.00 1.57 -3.01 0.00 0.00 175.04 173.60 1svm n HIS 313 N -2.14 0.00 0.27 1.43 -0.00 0.10 -4.67 115.22 110.21 1svm n HIS 313 Ca 0.00 0.00 0.13 0.00 -0.00 0.00 0.00 57.72 57.85 1svm n HIS 313 Cb 0.10 -0.21 0.77 0.00 -0.00 0.00 0.00 29.99 30.65 1svm n HIS 313 CO 0.00 0.00 0.00 0.10 -0.00 0.00 0.00 176.34 176.44 1svm h TYR 314 N -0.42 0.00 0.00 1.57 -0.00 -1.19 -0.10 116.97 116.83 1svm h TYR 314 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.73 1svm h TYR 314 Cb 0.42 0.00 0.00 0.00 0.00 0.00 0.00 36.73 37.15 1svm h TYR 314 CO -0.18 0.08 0.00 1.63 -0.00 0.00 0.00 178.16 179.69 1svm n LYS 315 N -3.83 0.20 0.00 0.10 5.02 -1.03 -4.24 118.16 114.39 1svm n LYS 315 Ca -0.02 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.27 1svm n LYS 315 Cb 0.18 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 33.69 1svm n LYS 315 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 1svm n TYR 316 N -1.40 0.00 0.01 2.13 4.02 -0.51 -4.83 117.16 116.58 1svm n TYR 316 Ca 0.10 0.00 -0.15 0.00 -0.01 0.00 0.00 57.90 57.85 1svm n TYR 316 Cb 0.29 0.00 -0.10 0.00 -0.02 0.00 0.00 39.34 39.52 1svm n TYR 316 CO 0.00 0.00 0.00 1.25 -1.01 0.00 0.00 176.86 177.10 1svm h HIS 317 N 0.00 -1.55 -0.38 -0.72 2.76 -1.24 -0.05 115.15 113.96 1svm h HIS 317 Ca 0.00 0.06 0.07 0.00 -2.20 0.00 0.00 60.37 58.30 1svm h HIS 317 Cb 0.00 0.69 -0.07 0.00 1.55 0.00 0.00 27.41 29.58 1svm h HIS 317 CO 0.00 -0.53 -0.04 1.49 -1.30 0.00 0.00 177.93 177.54 1svm h GLU 318 N -0.59 0.06 -0.20 5.26 4.22 -1.87 0.16 114.58 121.63 1svm h GLU 318 Ca 0.03 -0.00 -0.04 0.00 0.08 0.00 0.00 59.36 59.42 1svm h GLU 318 Cb 0.67 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.89 1svm h GLU 318 CO -0.40 0.04 -0.05 -0.22 -2.18 0.00 0.00 179.01 176.19 1svm h LYS 319 N 0.06 0.30 -0.17 1.92 3.64 -1.78 -3.00 116.57 117.53 1svm h LYS 319 Ca 0.19 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.51 1svm h LYS 319 Cb 0.28 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 32.05 1svm h LYS 319 CO -0.35 0.37 0.00 0.72 -2.27 0.00 0.00 179.45 177.92 1svm n HIS 320 N -4.32 0.20 0.03 1.91 8.25 -0.07 -4.62 115.22 116.60 1svm n HIS 320 Ca -0.00 -0.10 -0.11 0.00 -0.26 0.00 0.00 57.72 57.24 1svm n HIS 320 Cb 0.22 -0.00 -0.05 0.00 1.12 0.00 0.00 29.99 31.29 1svm n HIS 320 CO 0.00 0.00 0.00 -0.92 0.64 0.00 0.00 176.34 176.06 1svm h TYR 321 N 4.41 -0.86 -0.31 4.41 3.20 -0.55 0.18 116.97 127.46 1svm h TYR 321 Ca 0.00 0.03 0.05 0.00 3.14 0.00 0.00 58.73 61.95 1svm h TYR 321 Cb 0.96 0.39 -0.04 0.00 1.54 0.00 0.00 36.73 39.57 1svm h TYR 321 CO 0.10 -0.40 0.04 0.00 -1.64 0.00 0.00 178.16 176.26 1svm h ALA 322 N 0.36 0.30 -0.43 1.82 0.00 -1.82 0.55 119.26 120.05 1svm h ALA 322 Ca 0.08 0.07 -0.10 0.00 0.00 0.00 0.00 54.91 54.96 1svm h ALA 322 Cb 0.54 0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.42 1svm h ALA 322 CO -0.30 -0.37 -0.13 -0.97 0.00 0.00 0.00 179.25 177.48 1svm h ASN 323 N 0.14 0.79 -0.07 0.00 -0.00 -1.82 -2.98 115.58 111.63 1svm h ASN 323 Ca 0.14 -0.25 -0.10 0.00 -0.00 0.00 0.00 56.30 56.10 1svm h ASN 323 Cb 0.17 -0.21 -0.01 0.00 -0.00 0.00 0.00 38.32 38.26 1svm h ASN 323 CO -0.21 0.93 -0.26 0.00 -0.00 0.00 0.00 177.43 177.89 1svm h ALA 324 N 1.14 1.06 -0.85 1.57 0.00 -0.09 0.16 119.26 122.24 1svm h ALA 324 Ca 0.12 -0.36 -0.03 0.00 0.00 0.00 0.00 54.91 54.64 1svm h ALA 324 Cb 0.62 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 18.25 1svm h ALA 324 CO 0.04 0.57 0.41 0.00 0.00 0.00 0.00 179.25 180.27 1svm h ALA 325 N 1.27 1.10 -0.15 0.00 0.00 -0.76 -0.50 119.26 120.21 1svm h ALA 325 Ca 0.06 -0.16 -0.22 0.00 0.00 0.00 0.00 54.91 54.59 1svm h ALA 325 Cb 0.70 -0.34 0.01 0.00 0.00 0.00 0.00 17.79 18.16 1svm h ALA 325 CO 0.05 0.67 -0.78 0.82 0.00 0.00 0.00 179.25 180.01 1svm h ILE 326 N 1.21 1.28 -0.85 0.00 1.08 -1.39 -3.18 117.51 115.68 1svm h ILE 326 Ca 0.29 -1.98 0.09 0.00 -0.39 0.00 0.00 64.86 62.87 1svm h ILE 326 Cb 0.12 1.99 -0.06 0.00 -3.07 0.00 0.00 36.82 35.80 1svm h ILE 326 CO -0.04 0.63 0.55 0.15 -0.69 0.00 0.00 178.15 178.75 1svm h PHE 327 N 0.53 0.88 0.00 1.37 3.57 -0.48 -0.59 116.94 122.23 1svm h PHE 327 Ca -0.05 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.47 1svm h PHE 327 Cb 1.41 -0.29 0.00 0.00 2.79 0.00 0.00 35.95 39.86 1svm h PHE 327 CO 0.09 0.42 0.00 0.00 -2.23 0.00 0.00 178.31 176.58 1svm h ALA 328 N 1.57 1.00 -0.29 2.41 0.00 -1.08 -1.33 119.26 121.54 1svm h ALA 328 Ca 0.39 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.30 1svm h ALA 328 Cb 0.40 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.19 1svm h ALA 328 CO -0.16 0.00 0.00 -0.25 0.00 0.00 0.00 179.25 178.84 1svm n ASP 329 N -2.66 2.93 -4.82 0.00 8.00 -0.25 -5.00 116.55 114.75 1svm n ASP 329 Ca -0.01 -1.86 -0.33 0.00 0.71 0.00 0.00 54.79 53.31 1svm n ASP 329 Cb 0.14 -0.19 -0.02 0.00 -0.02 0.00 0.00 41.12 41.03 1svm n ASP 329 CO 0.00 0.00 0.00 -0.55 -0.39 0.00 0.00 177.20 176.26 1svm s SER 330 N -1.17 6.28 0.00 -2.24 0.15 -0.51 -4.96 113.70 111.25 1svm s SER 330 Ca 0.28 1.74 0.18 0.00 0.70 0.00 0.00 55.95 58.85 1svm s SER 330 Cb 0.16 -2.53 0.42 0.00 -1.71 0.00 0.00 66.02 62.36 1svm s SER 330 CO 0.22 -0.83 1.34 0.29 1.20 0.00 0.00 173.24 175.47 1svm n LYS 331 N -1.55 2.47 -2.02 5.44 5.02 -1.26 -4.46 118.16 121.80 1svm n LYS 331 Ca 0.08 -2.21 -0.03 0.00 -2.02 0.00 0.00 58.31 54.13 1svm n LYS 331 Cb 0.53 -1.43 0.06 0.00 -0.02 0.00 0.00 35.03 34.17 1svm n LYS 331 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1svm n ASN 332 N 1.18 2.12 -0.14 4.39 4.13 -1.26 -4.93 115.26 120.74 1svm n ASN 332 Ca 0.17 -2.62 -0.03 0.00 1.68 0.00 0.00 54.58 53.78 1svm n ASN 332 Cb 0.53 -0.41 0.04 0.00 -1.54 0.00 0.00 39.78 38.40 1svm n ASN 332 CO 0.00 0.00 0.00 1.56 0.28 0.00 0.00 177.26 179.10 1svm h GLN 333 N 1.88 0.11 -0.35 3.52 4.20 -1.89 -1.19 115.11 121.38 1svm h GLN 333 Ca -0.04 -0.01 0.00 0.00 0.06 0.00 0.00 58.65 58.66 1svm h GLN 333 Cb 1.46 -0.03 -0.02 0.00 0.30 0.00 0.00 27.48 29.19 1svm h GLN 333 CO 0.25 0.07 0.23 -0.22 -0.67 0.00 0.00 178.83 178.49 1svm h LYS 334 N 0.11 0.47 -0.88 1.46 1.63 -1.97 -1.86 116.57 115.53 1svm h LYS 334 Ca 0.23 -0.03 -0.02 0.00 -0.85 0.00 0.00 60.65 59.97 1svm h LYS 334 Cb 0.33 -0.10 -0.04 0.00 -0.60 0.00 0.00 32.23 31.81 1svm h LYS 334 CO -0.37 0.33 0.47 1.15 -3.45 0.00 0.00 179.45 177.57 1svm h THR 335 N 0.47 1.26 -0.20 1.00 2.02 -1.83 -0.30 112.91 115.34 1svm h THR 335 Ca 0.13 -0.66 -0.02 0.00 0.77 0.00 0.00 66.41 66.64 1svm h THR 335 Cb -0.03 0.08 -0.01 0.00 -1.74 0.00 0.00 68.15 66.45 1svm h THR 335 CO -0.03 0.29 0.06 0.40 0.37 0.00 0.00 175.52 176.62 1svm h ILE 336 N 1.24 1.19 0.00 3.11 2.04 -0.96 -2.67 117.51 121.45 1svm h ILE 336 Ca 0.31 -0.61 -0.06 0.00 1.00 0.00 0.00 64.86 65.50 1svm h ILE 336 Cb 0.05 1.22 -0.01 0.00 -0.74 0.00 0.00 36.82 37.34 1svm h ILE 336 CO -0.05 0.19 -0.30 0.00 0.00 0.00 0.00 178.15 177.99 1svm h GLN 338 N 0.00 0.93 -0.48 0.00 1.08 -0.80 0.44 115.11 116.29 1svm h GLN 338 Ca -0.00 -0.28 -0.07 0.00 -1.45 0.00 0.00 58.65 56.84 1svm h GLN 338 Cb 0.59 -0.09 -0.02 0.00 -0.05 0.00 0.00 27.48 27.91 1svm h GLN 338 CO 0.04 0.93 0.01 0.37 -0.95 0.00 0.00 178.83 179.23 1svm h GLN 339 N 0.81 0.78 -0.16 1.46 4.15 -1.26 0.39 115.11 121.26 1svm h GLN 339 Ca 0.16 -0.20 -0.02 0.00 0.77 0.00 0.00 58.65 59.36 1svm h GLN 339 Cb 0.50 -0.09 -0.01 0.00 0.21 0.00 0.00 27.48 28.08 1svm h GLN 339 CO 0.02 0.78 0.04 0.00 -1.93 0.00 0.00 178.83 177.74 1svm h ALA 340 N 1.28 0.22 -0.66 3.38 0.00 -1.09 -1.54 119.26 120.85 1svm h ALA 340 Ca 0.15 -0.15 -0.06 0.00 0.00 0.00 0.00 54.91 54.84 1svm h ALA 340 Cb 0.43 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.13 1svm h ALA 340 CO 0.02 -0.13 0.17 0.28 0.00 0.00 0.00 179.25 179.58 1svm h VAL 341 N 0.07 1.25 -0.33 0.00 2.07 -0.67 -2.04 116.25 116.61 1svm h VAL 341 Ca 0.05 -0.92 -0.02 0.00 0.82 0.00 0.00 66.70 66.63 1svm h VAL 341 Cb 0.28 0.56 -0.02 0.00 -1.52 0.00 0.00 31.29 30.59 1svm h VAL 341 CO 0.00 0.35 0.10 0.44 0.02 0.00 0.00 177.57 178.48 1svm h ASP 342 N 1.00 0.42 -0.18 0.57 3.32 -0.74 -0.47 116.42 120.34 1svm h ASP 342 Ca 0.21 -0.05 -0.10 0.00 0.02 0.00 0.00 57.03 57.11 1svm h ASP 342 Cb 0.34 -0.11 -0.01 0.00 0.22 0.00 0.00 39.33 39.77 1svm h ASP 342 CO -0.00 0.41 -0.23 0.74 -1.72 0.00 0.00 179.24 178.44 1svm h THR 343 N 0.46 1.27 -0.33 0.35 2.02 -0.57 0.65 112.91 116.75 1svm h THR 343 Ca 0.11 -1.29 -0.08 0.00 0.77 0.00 0.00 66.41 65.92 1svm h THR 343 Cb 0.15 1.27 -0.01 0.00 -1.74 0.00 0.00 68.15 67.82 1svm h THR 343 CO -0.01 0.42 -0.11 0.58 0.37 0.00 0.00 175.52 176.77 1svm h VAL 344 N 0.55 1.28 -0.30 3.16 2.07 -0.89 -1.73 116.25 120.40 1svm h VAL 344 Ca 0.08 -1.20 -0.08 0.00 0.82 0.00 0.00 66.70 66.32 1svm h VAL 344 Cb 0.69 1.37 -0.02 0.00 -1.52 0.00 0.00 31.29 31.81 1svm h VAL 344 CO 0.05 0.39 -0.16 -0.07 0.02 0.00 0.00 177.57 177.80 1svm h LEU 345 N 0.44 0.51 -0.68 2.57 3.38 -0.92 -1.83 115.31 118.78 1svm h LEU 345 Ca 0.08 -0.15 -0.09 0.00 0.09 0.00 0.00 57.88 57.81 1svm h LEU 345 Cb 0.63 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 41.22 1svm h LEU 345 CO 0.04 0.69 0.00 0.00 0.09 0.00 0.00 178.44 179.26 1svm h ALA 346 N 1.36 0.89 -0.48 1.53 0.00 -0.66 -1.17 119.26 120.73 1svm h ALA 346 Ca 0.08 -0.30 -0.05 0.00 0.00 0.00 0.00 54.91 54.64 1svm h ALA 346 Cb 0.55 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.10 1svm h ALA 346 CO 0.04 0.66 0.10 -0.22 0.00 0.00 0.00 179.25 179.82 1svm h LYS 347 N 0.94 0.78 -0.34 0.00 1.63 -0.96 -0.64 116.57 117.98 1svm h LYS 347 Ca 0.17 -0.20 -0.04 0.00 -0.85 0.00 0.00 60.65 59.73 1svm h LYS 347 Cb 0.54 -0.10 -0.02 0.00 -0.60 0.00 0.00 32.23 32.05 1svm h LYS 347 CO 0.03 0.77 0.04 0.87 -3.45 0.00 0.00 179.45 177.71 1svm h LYS 348 N 0.66 0.51 -0.02 1.90 1.57 -1.09 -0.65 116.57 119.46 1svm h LYS 348 Ca 0.15 -0.09 -0.00 0.00 -1.87 0.00 0.00 60.65 58.83 1svm h LYS 348 Cb 0.36 -0.08 -0.00 0.00 0.08 0.00 0.00 32.23 32.58 1svm h LYS 348 CO 0.00 0.51 -0.00 -0.09 -0.57 0.00 0.00 179.45 179.30 1svm h ARG 349 N 0.50 0.03 -0.14 3.15 9.65 -0.75 -0.81 114.38 126.01 1svm h ARG 349 Ca 0.11 -0.01 0.02 0.00 -1.10 0.00 0.00 59.98 59.00 1svm h ARG 349 Cb 0.26 -0.00 -0.02 0.00 -1.39 0.00 0.00 29.97 28.82 1svm h ARG 349 CO 0.00 0.36 0.01 0.28 2.80 0.00 0.00 179.97 183.42 1svm h VAL 350 N -0.30 0.92 -0.79 0.20 2.07 -0.85 -2.56 116.25 114.93 1svm h VAL 350 Ca 0.00 -0.02 0.04 0.00 0.82 0.00 0.00 66.70 67.55 1svm h VAL 350 Cb 0.35 0.85 -0.05 0.00 -1.52 0.00 0.00 31.29 30.92 1svm h VAL 350 CO 0.00 0.01 0.50 0.44 0.02 0.00 0.00 177.57 178.54 1svm h ASP 351 N 0.06 0.80 0.22 0.57 3.32 -1.08 0.21 116.42 120.51 1svm h ASP 351 Ca 0.06 0.01 -0.03 0.00 0.02 0.00 0.00 57.03 57.09 1svm h ASP 351 Cb 0.07 -0.16 -0.00 0.00 0.22 0.00 0.00 39.33 39.45 1svm h ASP 351 CO -0.10 0.53 -0.12 0.77 -1.72 0.00 0.00 179.24 178.61 1svm h SER 352 N 0.94 0.00 0.15 6.45 4.64 -0.83 -0.92 113.55 123.98 1svm h SER 352 Ca 0.33 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.65 1svm h SER 352 Cb 0.08 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.17 1svm h SER 352 CO -0.14 0.12 -1.85 0.18 -0.87 0.00 0.00 176.83 174.27 1svm n LEU 353 N -3.97 0.13 -0.00 5.97 4.77 -0.69 -4.67 117.00 118.53 1svm n LEU 353 Ca -0.02 0.05 0.03 0.00 -0.03 0.00 0.00 56.01 56.04 1svm n LEU 353 Cb 0.21 -0.01 -0.05 0.00 -2.33 0.00 0.00 43.42 41.25 1svm n LEU 353 CO 0.32 -0.03 -0.51 0.00 -1.33 0.00 0.00 177.39 175.85 1svm n GLN 354 N -2.33 0.77 -2.96 3.23 6.02 0.64 -5.02 117.38 117.73 1svm n GLN 354 Ca -0.04 -0.05 -0.29 0.00 -0.01 0.00 0.00 57.00 56.62 1svm n GLN 354 Cb 0.57 -1.10 -0.02 0.00 1.02 0.00 0.00 30.24 30.71 1svm n GLN 354 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1svm s LEU 355 N -3.29 3.85 0.66 1.08 1.43 -0.37 -5.04 118.68 117.00 1svm s LEU 355 Ca -0.02 0.92 -0.11 0.00 -1.03 0.00 0.00 54.13 53.89 1svm s LEU 355 Cb 0.04 -3.80 -0.01 0.00 0.03 0.00 0.00 46.19 42.45 1svm s LEU 355 CO 0.26 -0.39 1.05 0.42 0.23 0.00 0.00 176.35 177.92 1svm s THR 356 N -2.39 4.31 0.43 5.49 -4.23 -1.26 -4.90 115.64 113.09 1svm s THR 356 Ca 0.47 0.75 0.17 0.00 -1.18 0.00 0.00 61.69 61.90 1svm s THR 356 Cb -0.10 -3.62 0.19 0.00 1.34 0.00 0.00 72.50 70.31 1svm s THR 356 CO 0.35 -0.98 1.98 0.03 -0.54 0.00 0.00 174.62 175.46 1svm h ARG 357 N -0.54 0.00 -0.39 3.99 3.08 -1.97 -2.28 114.38 116.28 1svm h ARG 357 Ca -0.44 0.00 -0.14 0.00 0.07 0.00 0.00 59.98 59.47 1svm h ARG 357 Cb 1.20 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 31.24 1svm h ARG 357 CO 0.60 0.20 -0.31 1.49 -1.07 0.00 0.00 179.97 180.87 1svm h GLU 358 N 0.00 0.86 -0.51 0.04 4.81 -1.92 -1.96 114.58 115.90 1svm h GLU 358 Ca -0.00 -0.41 -0.04 0.00 -0.13 0.00 0.00 59.36 58.78 1svm h GLU 358 Cb 0.37 -0.01 -0.02 0.00 0.63 0.00 0.00 28.75 29.72 1svm h GLU 358 CO 0.03 1.05 0.14 1.96 -0.73 0.00 0.00 179.01 181.46 1svm h GLN 359 N 0.72 0.76 -0.18 1.92 4.20 -1.80 0.11 115.11 120.85 1svm h GLN 359 Ca 0.08 -0.14 -0.01 0.00 0.06 0.00 0.00 58.65 58.64 1svm h GLN 359 Cb 0.87 -0.12 -0.01 0.00 0.30 0.00 0.00 27.48 28.52 1svm h GLN 359 CO 0.08 0.68 0.09 0.52 -0.67 0.00 0.00 178.83 179.52 1svm h MET 360 N 0.74 0.25 -0.64 1.46 2.86 -1.11 -0.56 114.93 117.93 1svm h MET 360 Ca 0.17 -0.03 -0.07 0.00 -2.06 0.00 0.00 59.70 57.71 1svm h MET 360 Cb 0.24 -0.05 -0.03 0.00 0.06 0.00 0.00 31.60 31.83 1svm h MET 360 CO -0.01 0.27 0.14 1.25 1.06 0.00 0.00 176.91 179.62 1svm h LEU 361 N 0.16 0.97 -0.70 1.22 6.46 -0.94 -2.01 115.31 120.47 1svm h LEU 361 Ca 0.06 -0.20 -0.02 0.00 -0.12 0.00 0.00 57.88 57.59 1svm h LEU 361 Cb 0.10 -0.26 -0.03 0.00 -0.73 0.00 0.00 40.66 39.74 1svm h LEU 361 CO -0.01 0.95 0.35 0.74 -0.62 0.00 0.00 178.44 179.85 1svm h THR 362 N 0.97 1.23 -0.81 1.05 2.02 -0.50 0.44 112.91 117.31 1svm h THR 362 Ca 0.20 -0.61 -0.04 0.00 0.77 0.00 0.00 66.41 66.73 1svm h THR 362 Cb 0.37 0.34 -0.04 0.00 -1.74 0.00 0.00 68.15 67.09 1svm h THR 362 CO 0.00 0.26 0.34 0.78 0.37 0.00 0.00 175.52 177.27 1svm h ASN 363 N 0.97 1.10 -0.35 4.18 2.35 -0.75 -0.73 115.58 122.34 1svm h ASN 363 Ca 0.24 -0.16 -0.02 0.00 -0.55 0.00 0.00 56.30 55.81 1svm h ASN 363 Cb 0.09 -0.28 -0.02 0.00 0.05 0.00 0.00 38.32 38.16 1svm h ASN 363 CO -0.03 0.96 0.14 -0.09 -1.65 0.00 0.00 177.43 176.76 1svm h ARG 364 N 1.17 0.52 -0.93 0.81 9.65 -0.75 -1.84 114.38 123.02 1svm h ARG 364 Ca 0.27 -0.10 -0.00 0.00 -1.10 0.00 0.00 59.98 59.05 1svm h ARG 364 Cb 0.19 -0.08 -0.04 0.00 -1.39 0.00 0.00 29.97 28.64 1svm h ARG 364 CO -0.03 0.52 0.56 0.74 2.80 0.00 0.00 179.97 184.57 1svm h PHE 365 N 0.42 1.22 -0.29 2.20 -1.00 -0.60 -0.70 116.94 118.19 1svm h PHE 365 Ca 0.12 -0.00 -0.05 0.00 2.81 0.00 0.00 57.97 60.85 1svm h PHE 365 Cb 0.19 -0.40 -0.02 0.00 3.61 0.00 0.00 35.95 39.33 1svm h PHE 365 CO -0.00 0.80 -0.03 -0.91 -1.61 0.00 0.00 178.31 176.56 1svm h ASN 366 N 1.28 0.42 -0.18 2.17 2.35 -0.83 0.95 115.58 121.73 1svm h ASN 366 Ca 0.33 -0.08 -0.16 0.00 -0.55 0.00 0.00 56.30 55.85 1svm h ASN 366 Cb -0.06 -0.11 -0.01 0.00 0.05 0.00 0.00 38.32 38.19 1svm h ASN 366 CO -0.06 0.51 -0.45 0.44 -1.65 0.00 0.00 177.43 176.21 1svm h ASP 367 N 0.43 0.80 -0.41 5.81 3.32 -0.44 -1.88 116.42 124.04 1svm h ASP 367 Ca 0.09 -0.39 -0.13 0.00 0.02 0.00 0.00 57.03 56.63 1svm h ASP 367 Cb 0.33 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 39.65 1svm h ASP 367 CO 0.01 1.13 -0.23 -0.07 -1.72 0.00 0.00 179.24 178.36 1svm h LEU 368 N 0.59 0.92 -1.42 1.55 3.38 -0.69 -2.61 115.31 117.04 1svm h LEU 368 Ca 0.04 -0.42 -0.04 0.00 0.09 0.00 0.00 57.88 57.55 1svm h LEU 368 Cb 1.01 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 41.50 1svm h LEU 368 CO 0.10 1.14 -0.02 -0.07 0.09 0.00 0.00 178.44 179.67 1svm h LEU 369 N 0.71 0.33 -0.44 1.67 3.38 -0.70 0.18 115.31 120.43 1svm h LEU 369 Ca 0.09 -0.05 -0.07 0.00 0.09 0.00 0.00 57.88 57.93 1svm h LEU 369 Cb 0.81 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 41.46 1svm h LEU 369 CO 0.07 0.40 -0.00 0.44 0.09 0.00 0.00 178.44 179.44 1svm h ASP 370 N 0.34 0.77 -0.77 -0.43 3.32 -1.17 0.14 116.42 118.62 1svm h ASP 370 Ca 0.08 -0.31 -0.05 0.00 0.02 0.00 0.00 57.03 56.77 1svm h ASP 370 Cb 0.27 -0.21 -0.03 0.00 0.22 0.00 0.00 39.33 39.58 1svm h ASP 370 CO 0.01 0.89 0.29 -0.09 -1.72 0.00 0.00 179.24 178.62 1svm h ARG 371 N 0.63 1.17 -0.55 3.56 2.43 -1.01 -2.68 114.38 117.94 1svm h ARG 371 Ca 0.13 -0.22 -0.08 0.00 -0.81 0.00 0.00 59.98 58.99 1svm h ARG 371 Cb 0.50 -0.19 -0.02 0.00 -0.42 0.00 0.00 29.97 29.84 1svm h ARG 371 CO 0.02 0.96 0.01 0.52 -1.51 0.00 0.00 179.97 179.97 1svm h MET 372 N 1.14 0.96 -0.79 0.20 2.86 -0.55 0.33 114.93 119.08 1svm h MET 372 Ca 0.26 -0.30 0.12 0.00 -2.06 0.00 0.00 59.70 57.72 1svm h MET 372 Cb 0.24 -0.09 -0.08 0.00 0.06 0.00 0.00 31.60 31.73 1svm h MET 372 CO -0.02 0.96 0.40 -0.44 1.06 0.00 0.00 176.91 178.88 1svm h ASP 373 N 0.84 0.51 0.10 1.22 3.32 -0.40 -1.54 116.42 120.46 1svm h ASP 373 Ca 0.16 0.08 -0.00 0.00 0.02 0.00 0.00 57.03 57.28 1svm h ASP 373 Cb 0.52 -0.01 0.00 0.00 0.22 0.00 0.00 39.33 40.07 1svm h ASP 373 CO 0.03 0.26 -0.05 0.40 -1.72 0.00 0.00 179.24 178.15 1svm h ILE 374 N 0.63 1.01 -0.65 0.35 2.04 -1.25 -2.54 117.51 117.11 1svm h ILE 374 Ca 0.41 -1.37 0.13 0.00 1.00 0.00 0.00 64.86 65.04 1svm h ILE 374 Cb 0.50 1.76 -0.12 0.00 -0.74 0.00 0.00 36.82 38.22 1svm h ILE 374 CO -0.31 0.29 -0.12 0.24 0.00 0.00 0.00 178.15 178.24 1svm h MET 375 N -0.87 0.02 -0.64 2.37 2.86 -0.73 -0.14 114.93 117.81 1svm h MET 375 Ca -0.01 -0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.63 1svm h MET 375 Cb 0.57 -0.01 0.00 0.00 0.06 0.00 0.00 31.60 32.22 1svm h MET 375 CO 0.02 0.02 0.00 1.19 1.06 0.00 0.00 176.91 179.20 1svm n PHE 376 N -5.41 1.31 -2.97 -0.22 3.72 -0.60 -1.93 117.46 111.35 1svm n PHE 376 Ca 0.08 -0.51 -0.20 0.00 -0.05 0.00 0.00 57.45 56.78 1svm n PHE 376 Cb 0.35 -0.24 0.06 0.00 -0.94 0.00 0.00 39.48 38.71 1svm n PHE 376 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 1svm s GLY 377 N -0.80 1.75 0.58 1.37 0.00 -0.09 -4.95 107.32 105.19 1svm s GLY 377 Ca 0.43 -2.05 0.28 0.00 0.00 0.00 0.00 44.72 43.39 1svm s GLY 377 CO 0.20 -1.60 2.14 1.48 0.00 0.00 0.00 173.10 175.32 1svm h SER 378 N 0.13 0.00 -0.39 1.64 4.64 -1.86 -0.55 113.55 117.17 1svm h SER 378 Ca -0.32 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.00 1svm h SER 378 Cb 1.28 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.37 1svm h SER 378 CO 0.41 0.00 0.00 0.35 -0.87 0.00 0.00 176.83 176.72 1svm n THR 379 N -3.86 0.56 -2.85 2.95 -2.24 -1.26 -4.97 114.28 102.60 1svm n THR 379 Ca 0.00 -0.78 -0.21 0.00 -2.27 0.00 0.00 64.05 60.79 1svm n THR 379 Cb 0.26 0.92 0.02 0.00 -2.10 0.00 0.00 70.33 69.43 1svm n THR 379 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1svm s GLY 380 N -1.35 1.73 -0.08 3.38 0.00 -0.22 -4.95 107.32 105.83 1svm s GLY 380 Ca 0.36 -1.27 0.12 0.00 0.00 0.00 0.00 44.72 43.93 1svm s GLY 380 CO 0.29 -1.05 1.08 -1.14 0.00 0.00 0.00 173.10 172.29 1svm n SER 381 N -2.16 2.10 -4.88 1.64 3.41 -1.19 -4.82 113.62 107.72 1svm n SER 381 Ca 0.05 -2.66 -0.35 0.00 -0.26 0.00 0.00 58.87 55.65 1svm n SER 381 Cb 0.59 -0.27 -0.05 0.00 -0.26 0.00 0.00 64.21 64.21 1svm n SER 381 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1svm s ALA 382 N -2.11 3.86 -0.39 7.33 0.00 -0.81 -5.07 121.76 124.57 1svm s ALA 382 Ca 0.20 -0.60 -0.13 0.00 0.00 0.00 0.00 51.96 51.43 1svm s ALA 382 Cb 0.17 -2.04 0.02 0.00 0.00 0.00 0.00 23.12 21.28 1svm s ALA 382 CO 0.02 0.65 0.26 0.34 0.00 0.00 0.00 175.76 177.03 1svm s ASP 383 N -1.59 5.96 0.57 0.00 -1.08 -1.26 -4.53 116.67 114.74 1svm s ASP 383 Ca 0.25 -0.90 0.28 0.00 -0.52 0.00 0.00 52.55 51.66 1svm s ASP 383 Cb -0.13 -2.11 1.50 0.00 -1.46 0.00 0.00 42.92 40.73 1svm s ASP 383 CO 0.14 -0.41 1.98 -0.29 0.52 0.00 0.00 175.17 177.11 1svm h ILE 384 N 5.71 0.51 -0.31 4.11 6.09 -1.94 -0.39 117.51 131.29 1svm h ILE 384 Ca -0.27 0.00 -0.15 0.00 -1.37 0.00 0.00 64.86 63.07 1svm h ILE 384 Cb 1.12 0.71 -0.01 0.00 0.47 0.00 0.00 36.82 39.11 1svm h ILE 384 CO 0.70 0.00 -0.42 -0.08 -3.07 0.00 0.00 178.15 175.28 1svm h GLU 385 N 0.00 0.76 -0.14 2.19 4.81 -1.99 -1.36 114.58 118.85 1svm h GLU 385 Ca 0.20 -0.41 -0.10 0.00 -0.13 0.00 0.00 59.36 58.91 1svm h GLU 385 Cb 0.96 0.02 -0.01 0.00 0.63 0.00 0.00 28.75 30.35 1svm h GLU 385 CO -0.00 1.04 -0.37 0.93 -0.73 0.00 0.00 179.01 179.88 1svm h GLU 386 N 0.62 0.30 -0.03 1.92 5.08 -1.50 -1.88 114.58 119.09 1svm h GLU 386 Ca 0.05 -0.13 -0.23 0.00 -1.00 0.00 0.00 59.36 58.05 1svm h GLU 386 Cb 0.98 -0.01 0.01 0.00 0.50 0.00 0.00 28.75 30.23 1svm h GLU 386 CO 0.09 0.63 -0.91 -1.49 -1.00 0.00 0.00 179.01 176.33 1svm h TRP 387 N 0.25 0.74 -0.03 4.33 4.06 -1.30 -2.71 115.95 121.29 1svm h TRP 387 Ca 0.03 -0.38 -0.07 0.00 2.06 0.00 0.00 58.89 60.52 1svm h TRP 387 Cb 0.77 -0.09 -0.01 0.00 -1.00 0.00 0.00 29.16 28.83 1svm h TRP 387 CO 0.02 1.20 -0.33 0.52 -3.56 0.00 0.00 178.44 176.29 1svm h MET 388 N 0.31 0.05 -0.20 0.49 2.86 -1.12 -0.45 114.93 116.86 1svm h MET 388 Ca -0.08 -0.02 -0.04 0.00 -2.06 0.00 0.00 59.70 57.50 1svm h MET 388 Cb 1.54 -0.00 -0.01 0.00 0.06 0.00 0.00 31.60 33.18 1svm h MET 388 CO 0.17 0.37 -0.07 0.00 1.06 0.00 0.00 176.91 178.44 1svm h ALA 389 N 1.63 1.52 -0.42 6.32 0.00 -1.17 -0.82 119.26 126.31 1svm h ALA 389 Ca 0.00 -0.18 -0.14 0.00 0.00 0.00 0.00 54.91 54.59 1svm h ALA 389 Cb 0.60 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.28 1svm h ALA 389 CO 0.04 0.35 -0.27 0.78 0.00 0.00 0.00 179.25 180.15 1svm h GLY 390 N 0.71 1.01 0.90 0.00 0.00 -0.80 -1.82 103.07 103.07 1svm h GLY 390 Ca 0.06 -0.96 0.02 0.00 0.00 0.00 0.00 47.33 46.46 1svm h GLY 390 CO 0.01 0.87 0.39 -2.08 0.00 0.00 0.00 176.54 175.73 1svm h VAL 391 N 0.76 1.09 -0.27 4.60 2.07 -0.54 -0.64 116.25 123.33 1svm h VAL 391 Ca 0.09 -0.26 0.00 0.00 0.82 0.00 0.00 66.70 67.34 1svm h VAL 391 Cb 0.86 0.26 -0.01 0.00 -1.52 0.00 0.00 31.29 30.87 1svm h VAL 391 CO 0.08 0.14 0.17 0.00 0.02 0.00 0.00 177.57 177.97 1svm h ALA 392 N 1.26 0.34 -0.04 1.67 0.00 -0.94 0.72 119.26 122.27 1svm h ALA 392 Ca 0.24 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 55.12 1svm h ALA 392 Cb -0.00 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 17.68 1svm h ALA 392 CO -0.09 -0.17 0.02 2.35 0.00 0.00 0.00 179.25 181.36 1svm h TRP 393 N 0.35 0.06 -0.57 0.00 7.01 -1.09 -2.54 115.95 119.16 1svm h TRP 393 Ca 0.10 -0.00 0.03 0.00 2.11 0.00 0.00 58.89 61.12 1svm h TRP 393 Cb -0.01 -0.02 -0.03 0.00 -2.10 0.00 0.00 29.16 27.01 1svm h TRP 393 CO -0.05 0.17 0.38 -0.07 -2.79 0.00 0.00 178.44 176.08 1svm h LEU 394 N -0.07 0.58 0.00 0.65 3.38 -0.96 -0.05 115.31 118.84 1svm h LEU 394 Ca 0.01 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.98 1svm h LEU 394 Cb 0.14 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 40.75 1svm h LEU 394 CO -0.00 0.41 0.00 1.57 0.09 0.00 0.00 178.44 180.50 1svm n HIS 395 N -4.46 0.00 0.68 1.13 -0.00 0.23 -1.59 115.22 111.21 1svm n HIS 395 Ca 0.07 0.00 0.09 0.00 0.46 0.00 0.00 57.72 58.33 1svm n HIS 395 Cb 0.13 -0.40 0.08 0.00 -0.12 0.00 0.00 29.99 29.67 1svm n HIS 395 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 1svm h LEU 397 N 3.37 0.33 -7.96 0.00 5.85 -1.12 -3.47 115.31 112.31 1svm h LEU 397 Ca 0.00 -0.32 -0.13 0.00 0.84 0.00 0.00 57.88 58.26 1svm h LEU 397 Cb 0.72 -0.11 -0.18 0.00 0.37 0.00 0.00 40.66 41.47 1svm h LEU 397 CO 0.00 1.20 -0.58 -0.76 -0.34 0.00 0.00 178.44 177.96 1svm s LEU 398 N -7.22 1.98 0.47 2.25 1.02 -1.26 -4.85 118.68 111.08 1svm s LEU 398 Ca -0.03 -0.58 -0.23 0.00 0.02 0.00 0.00 54.13 53.31 1svm s LEU 398 Cb 0.08 0.45 -0.07 0.00 0.02 0.00 0.00 46.19 46.67 1svm s LEU 398 CO 0.86 -0.48 1.20 -2.84 0.02 0.00 0.00 176.35 175.11 1svm s PRO 399 N -2.52 3.66 -1.49 1.29 0.02 -1.26 -3.24 135.00 131.45 1svm s PRO 399 Ca -0.06 1.86 -0.01 0.00 0.02 0.00 0.00 61.00 62.81 1svm s PRO 399 Cb -0.02 -2.39 0.00 0.00 0.02 0.00 0.00 34.50 32.12 1svm s PRO 399 CO -0.04 -0.66 0.15 1.63 -0.33 0.00 0.00 177.00 177.74 1svm n LYS 400 N -0.57 -1.63 -0.22 5.54 5.02 -1.26 -4.77 118.16 120.27 1svm n LYS 400 Ca 0.08 0.19 0.02 0.00 -2.02 0.00 0.00 58.31 56.57 1svm n LYS 400 Cb 0.47 -3.84 0.14 0.00 -0.02 0.00 0.00 35.03 31.78 1svm n LYS 400 CO 0.00 0.00 0.00 1.98 -0.52 0.00 0.00 177.40 178.86 1svm h MET 401 N -1.83 0.36 -0.17 1.97 4.05 -1.81 -1.27 114.93 116.24 1svm h MET 401 Ca -0.65 -0.02 -0.01 0.00 -0.28 0.00 0.00 59.70 58.73 1svm h MET 401 Cb 1.39 -0.08 -0.01 0.00 -0.80 0.00 0.00 31.60 32.10 1svm h MET 401 CO 0.68 0.24 0.06 0.38 0.23 0.00 0.00 176.91 178.50 1svm h ASP 402 N 0.38 0.21 0.30 1.39 2.03 -1.92 -0.38 116.42 118.43 1svm h ASP 402 Ca 0.35 -0.01 -0.20 0.00 -0.73 0.00 0.00 57.03 56.44 1svm h ASP 402 Cb 0.49 -0.05 -0.00 0.00 -0.83 0.00 0.00 39.33 38.94 1svm h ASP 402 CO -0.37 0.20 -0.80 0.28 -1.03 0.00 0.00 179.24 177.52 1svm h SER 403 N 0.24 0.48 -0.28 4.15 0.02 -1.63 -1.04 113.55 115.50 1svm h SER 403 Ca 0.06 -0.34 -0.01 0.00 -0.84 0.00 0.00 61.79 60.66 1svm h SER 403 Cb 0.07 -0.14 -0.01 0.00 0.14 0.00 0.00 62.40 62.45 1svm h SER 403 CO -0.01 1.10 0.13 0.58 -1.14 0.00 0.00 176.83 177.49 1svm h VAL 404 N 0.25 1.15 -0.27 2.27 2.07 -0.33 0.15 116.25 121.55 1svm h VAL 404 Ca -0.04 -0.44 -0.01 0.00 0.82 0.00 0.00 66.70 67.03 1svm h VAL 404 Cb 1.40 0.93 -0.01 0.00 -1.52 0.00 0.00 31.29 32.09 1svm h VAL 404 CO 0.14 0.16 0.13 0.58 0.02 0.00 0.00 177.57 178.59 1svm h VAL 405 N 0.31 1.15 -0.26 2.57 2.07 -1.06 -0.22 116.25 120.80 1svm h VAL 405 Ca 0.09 -0.42 0.04 0.00 0.82 0.00 0.00 66.70 67.23 1svm h VAL 405 Cb 0.13 0.93 -0.03 0.00 -1.52 0.00 0.00 31.29 30.80 1svm h VAL 405 CO -0.01 0.15 0.05 0.22 0.02 0.00 0.00 177.57 178.00 1svm h TYR 406 N 0.30 0.09 -0.43 1.57 3.20 -0.95 -0.82 116.97 119.92 1svm h TYR 406 Ca 0.09 0.02 -0.03 0.00 3.14 0.00 0.00 58.73 61.95 1svm h TYR 406 Cb 0.12 -0.00 -0.02 0.00 1.54 0.00 0.00 36.73 38.36 1svm h TYR 406 CO -0.02 0.03 0.14 -0.44 -1.64 0.00 0.00 178.16 176.22 1svm h ASP 407 N 0.16 0.57 -0.17 -2.11 3.32 -0.49 -1.63 116.42 116.06 1svm h ASP 407 Ca 0.12 -0.07 -0.01 0.00 0.02 0.00 0.00 57.03 57.09 1svm h ASP 407 Cb 0.12 -0.15 -0.01 0.00 0.22 0.00 0.00 39.33 39.52 1svm h ASP 407 CO -0.16 0.55 0.08 0.15 -1.72 0.00 0.00 179.24 178.14 1svm h PHE 408 N 0.62 0.26 -0.73 4.55 3.57 -0.18 -0.91 116.94 124.12 1svm h PHE 408 Ca 0.15 -0.02 0.06 0.00 3.53 0.00 0.00 57.97 61.69 1svm h PHE 408 Cb 0.18 -0.08 -0.06 0.00 2.79 0.00 0.00 35.95 38.79 1svm h PHE 408 CO 0.01 0.30 0.43 -0.07 -2.23 0.00 0.00 178.31 176.75 1svm h LEU 409 N 0.14 0.65 -0.69 0.59 3.38 -0.77 -0.34 115.31 118.26 1svm h LEU 409 Ca 0.06 0.03 -0.03 0.00 0.09 0.00 0.00 57.88 58.02 1svm h LEU 409 Cb 0.15 -0.10 -0.03 0.00 0.09 0.00 0.00 40.66 40.77 1svm h LEU 409 CO -0.01 0.41 0.30 0.11 0.09 0.00 0.00 178.44 179.35 1svm h LYS 410 N 0.78 1.02 -0.70 1.13 1.79 -1.02 -0.09 116.57 119.47 1svm h LYS 410 Ca 0.33 -0.17 -0.01 0.00 -2.18 0.00 0.00 60.65 58.62 1svm h LYS 410 Cb 0.19 -0.17 -0.03 0.00 -1.58 0.00 0.00 32.23 30.63 1svm h LYS 410 CO -0.18 0.83 0.41 0.00 -1.08 0.00 0.00 179.45 179.43 1svm h MET 412 N 0.96 0.73 -0.03 0.00 2.86 -0.68 -1.88 114.93 116.88 1svm h MET 412 Ca 0.25 -0.39 -0.02 0.00 -2.06 0.00 0.00 59.70 57.48 1svm h MET 412 Cb -0.01 0.01 0.00 0.00 0.06 0.00 0.00 31.60 31.66 1svm h MET 412 CO -0.05 1.01 -0.06 -0.24 1.06 0.00 0.00 176.91 178.63 1svm h VAL 413 N 0.60 1.43 -0.87 -2.22 3.04 -0.79 -3.23 116.25 114.21 1svm h VAL 413 Ca 0.05 -1.37 0.01 0.00 -1.01 0.00 0.00 66.70 64.38 1svm h VAL 413 Cb 0.96 2.27 -0.04 0.00 -2.01 0.00 0.00 31.29 32.47 1svm h VAL 413 CO 0.09 0.37 0.58 1.88 -1.01 0.00 0.00 177.57 179.47 1svm h TYR 414 N -0.43 1.10 -6.29 3.17 -1.99 -1.05 -3.44 116.97 108.04 1svm h TYR 414 Ca 0.00 0.02 -0.46 0.00 2.00 0.00 0.00 58.73 60.30 1svm h TYR 414 Cb 0.63 -0.37 -0.00 0.00 2.00 0.00 0.00 36.73 38.98 1svm h TYR 414 CO 0.12 0.70 -0.85 -1.71 -0.00 0.00 0.00 178.16 176.41 1svm n ASN 415 N -4.40 -1.02 -4.71 3.88 4.05 -0.71 -4.89 115.26 107.47 1svm n ASN 415 Ca 0.10 -0.90 -0.42 0.00 0.45 0.00 0.00 54.58 53.81 1svm n ASN 415 Cb 0.02 -3.58 -0.03 0.00 1.23 0.00 0.00 39.78 37.42 1svm n ASN 415 CO 0.00 0.00 0.00 -0.63 -3.05 0.00 0.00 177.26 173.58 1svm s ILE 416 N -3.77 3.91 -0.02 -1.44 1.01 -1.26 -4.94 121.20 114.68 1svm s ILE 416 Ca 0.06 1.35 -0.39 0.00 0.00 0.00 0.00 60.65 61.67 1svm s ILE 416 Cb -0.03 -3.87 -0.18 0.00 0.01 0.00 0.00 42.46 38.40 1svm s ILE 416 CO 0.85 0.08 1.35 -2.65 0.00 0.00 0.00 174.94 174.57 1svm n PRO 417 N 4.22 0.81 -1.15 2.79 -0.02 -1.26 -0.65 135.00 139.74 1svm n PRO 417 Ca 0.10 0.29 -0.05 0.00 -2.02 0.00 0.00 63.50 61.82 1svm n PRO 417 Cb 0.45 -1.90 -0.02 0.00 -0.02 0.00 0.00 33.50 32.01 1svm n PRO 417 CO 0.00 0.00 0.00 1.17 1.98 0.00 0.00 175.50 178.65 1svm n LYS 418 N 2.78 -1.76 -2.66 -0.52 4.81 0.81 -4.78 118.16 116.84 1svm n LYS 418 Ca 0.21 0.67 -0.07 0.00 -0.87 0.00 0.00 58.31 58.24 1svm n LYS 418 Cb 0.14 -5.07 0.04 0.00 0.02 0.00 0.00 35.03 30.16 1svm n LYS 418 CO 0.00 0.00 0.00 1.63 1.17 0.00 0.00 177.40 180.20 1svm n LYS 419 N -0.05 1.89 0.00 1.64 5.02 0.18 -4.69 118.16 122.15 1svm n LYS 419 Ca -0.05 -3.58 0.03 0.00 -2.02 0.00 0.00 58.31 52.69 1svm n LYS 419 Cb 0.52 -1.62 -0.02 0.00 -0.02 0.00 0.00 35.03 33.89 1svm n LYS 419 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1svm n ARG 420 N -0.44 3.73 -5.23 1.97 1.74 -1.21 -4.43 116.66 112.79 1svm n ARG 420 Ca 0.14 -0.22 -0.31 0.00 -0.77 0.00 0.00 57.85 56.69 1svm n ARG 420 Cb 0.82 -0.88 -0.16 0.00 -1.02 0.00 0.00 32.46 31.22 1svm n ARG 420 CO 0.00 0.00 0.00 0.71 -1.52 0.00 0.00 177.63 176.82 1svm s TYR 421 N -1.38 2.41 -0.06 -1.55 1.51 -1.25 -2.28 117.35 114.75 1svm s TYR 421 Ca 0.04 -0.47 0.00 0.00 -1.01 0.00 0.00 57.07 55.63 1svm s TYR 421 Cb 0.05 -1.55 -0.03 0.00 -0.11 0.00 0.00 41.96 40.33 1svm s TYR 421 CO 0.23 -0.05 -0.05 -1.58 -1.11 0.00 0.00 175.55 172.99 1svm s TRP 422 N -0.51 3.00 -0.20 2.71 0.52 -0.94 -0.97 118.94 122.55 1svm s TRP 422 Ca 0.07 0.07 -0.05 0.00 0.02 0.00 0.00 56.10 56.20 1svm s TRP 422 Cb -0.11 -1.72 -0.03 0.00 -1.15 0.00 0.00 33.47 30.46 1svm s TRP 422 CO 0.00 0.38 0.01 -1.17 0.02 0.00 0.00 176.95 176.19 1svm s LEU 423 N -0.90 3.34 -0.31 2.99 2.96 0.27 -1.71 118.68 125.32 1svm s LEU 423 Ca 0.13 -0.16 -0.10 0.00 -0.22 0.00 0.00 54.13 53.78 1svm s LEU 423 Cb -0.11 -1.85 -0.02 0.00 0.50 0.00 0.00 46.19 44.72 1svm s LEU 423 CO 0.02 0.08 0.17 -0.36 -1.32 0.00 0.00 176.35 174.95 1svm s PHE 424 N 0.90 3.19 0.03 5.38 0.40 0.92 -0.37 117.98 128.42 1svm s PHE 424 Ca 0.01 -0.40 0.05 0.00 -0.60 0.00 0.00 56.93 56.00 1svm s PHE 424 Cb -0.14 -2.38 -0.02 0.00 0.51 0.00 0.00 43.02 40.99 1svm s PHE 424 CO 0.02 -0.39 -0.15 0.21 0.70 0.00 0.00 175.22 175.61 1svm s LYS 425 N 1.65 1.06 0.00 0.44 2.20 -0.38 -1.15 119.74 123.55 1svm s LYS 425 Ca 0.05 -0.73 0.00 0.00 -0.36 0.00 0.00 55.97 54.93 1svm s LYS 425 Cb -0.17 -1.07 0.00 0.00 -1.51 0.00 0.00 37.83 35.08 1svm s LYS 425 CO 0.08 0.27 0.00 0.41 -0.36 0.00 0.00 175.35 175.75 1svm n GLY 426 N 2.08 0.54 3.61 5.54 0.00 -0.99 -0.57 105.19 115.40 1svm n GLY 426 Ca -0.17 -1.16 -0.29 0.00 0.00 0.00 0.00 46.02 44.40 1svm n GLY 426 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1svm s PRO 427 N -2.00 -0.42 0.33 1.61 0.02 -1.26 -4.08 135.00 129.20 1svm s PRO 427 Ca 0.00 0.35 -0.29 0.00 0.02 0.00 0.00 61.00 61.08 1svm s PRO 427 Cb 0.00 -1.65 -0.11 0.00 0.02 0.00 0.00 34.50 32.76 1svm s PRO 427 CO 0.00 -3.27 1.54 0.42 -0.33 0.00 0.00 177.00 175.36 1svm s ILE 428 N -2.88 2.10 -1.24 2.83 1.01 -1.26 -3.19 121.20 118.57 1svm s ILE 428 Ca 0.67 0.09 -0.01 0.00 0.00 0.00 0.00 60.65 61.40 1svm s ILE 428 Cb -0.17 -3.06 0.00 0.00 0.01 0.00 0.00 42.46 39.25 1svm s ILE 428 CO 0.58 0.02 0.98 0.47 0.00 0.00 0.00 174.94 176.99 1svm n ASP 429 N 1.41 -2.43 -0.43 3.58 8.00 -1.26 -4.92 116.55 120.51 1svm n ASP 429 Ca 0.05 -0.64 0.06 0.00 0.71 0.00 0.00 54.79 54.96 1svm n ASP 429 Cb 0.38 -4.95 0.04 0.00 -0.02 0.00 0.00 41.12 36.58 1svm n ASP 429 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 1svm n SER 430 N -3.10 1.83 0.00 -2.24 3.41 -1.19 -4.62 113.62 107.71 1svm n SER 430 Ca -0.25 -1.42 0.00 0.00 -0.26 0.00 0.00 58.87 56.94 1svm n SER 430 Cb 0.66 0.12 0.00 0.00 -0.26 0.00 0.00 64.21 64.72 1svm n SER 430 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1svm n GLY 431 N 0.75 0.81 0.34 5.00 0.00 -1.26 -4.21 105.19 106.61 1svm n GLY 431 Ca 0.06 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.93 1svm n GLY 431 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1svm h LYS 432 N 3.98 -0.65 -0.66 1.61 1.57 -1.94 -1.93 116.57 118.55 1svm h LYS 432 Ca 0.00 0.04 -0.07 0.00 -1.87 0.00 0.00 60.65 58.75 1svm h LYS 432 Cb 0.00 0.15 -0.03 0.00 0.08 0.00 0.00 32.23 32.43 1svm h LYS 432 CO 0.00 -0.43 0.13 1.15 -0.57 0.00 0.00 179.45 179.72 1svm h THR 433 N -0.68 1.26 -0.27 -0.16 2.02 -1.98 -1.29 112.91 111.82 1svm h THR 433 Ca -0.03 -1.00 0.05 0.00 0.77 0.00 0.00 66.41 66.20 1svm h THR 433 Cb 0.60 0.64 -0.04 0.00 -1.74 0.00 0.00 68.15 67.60 1svm h THR 433 CO -0.02 0.38 -0.00 0.74 0.37 0.00 0.00 175.52 176.98 1svm h THR 434 N 0.99 0.81 -0.13 3.16 2.02 -1.90 0.17 112.91 118.03 1svm h THR 434 Ca 0.20 -0.03 -0.20 0.00 0.77 0.00 0.00 66.41 67.15 1svm h THR 434 Cb 0.41 0.72 0.00 0.00 -1.74 0.00 0.00 68.15 67.54 1svm h THR 434 CO 0.01 0.01 -0.74 0.25 0.37 0.00 0.00 175.52 175.43 1svm h LEU 435 N 0.08 0.73 -0.72 2.58 5.85 -1.27 -2.64 115.31 119.92 1svm h LEU 435 Ca 0.13 -0.47 -0.10 0.00 0.84 0.00 0.00 57.88 58.27 1svm h LEU 435 Cb 0.17 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 40.96 1svm h LEU 435 CO -0.21 1.24 -0.14 0.00 -0.34 0.00 0.00 178.44 178.98 1svm h ALA 436 N 0.75 0.91 -0.57 1.25 0.00 -0.98 -0.89 119.26 119.74 1svm h ALA 436 Ca -0.04 -0.34 -0.08 0.00 0.00 0.00 0.00 54.91 54.45 1svm h ALA 436 Cb 1.34 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.93 1svm h ALA 436 CO 0.14 0.63 0.05 0.00 0.00 0.00 0.00 179.25 180.07 1svm h ALA 437 N 1.09 0.76 -0.63 0.00 0.00 -0.68 -0.45 119.26 119.35 1svm h ALA 437 Ca 0.12 -0.28 -0.07 0.00 0.00 0.00 0.00 54.91 54.68 1svm h ALA 437 Cb 0.65 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 18.20 1svm h ALA 437 CO 0.05 0.55 0.12 0.00 0.00 0.00 0.00 179.25 179.96 1svm h ALA 438 N 0.99 0.84 -0.18 0.00 0.00 -1.10 -2.07 119.26 117.73 1svm h ALA 438 Ca 0.17 -0.26 -0.13 0.00 0.00 0.00 0.00 54.91 54.69 1svm h ALA 438 Cb 0.48 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 1svm h ALA 438 CO 0.02 0.58 -0.46 -0.07 0.00 0.00 0.00 179.25 179.33 1svm h LEU 439 N 0.95 0.49 -0.29 0.00 3.38 -0.99 -0.77 115.31 118.07 1svm h LEU 439 Ca 0.19 -0.23 -0.01 0.00 0.09 0.00 0.00 57.88 57.92 1svm h LEU 439 Cb 0.41 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.01 1svm h LEU 439 CO 0.01 0.88 0.13 0.25 0.09 0.00 0.00 178.44 179.80 1svm h LEU 440 N 0.37 0.39 -0.72 1.67 5.85 -0.84 -1.83 115.31 120.20 1svm h LEU 440 Ca 0.02 -0.14 -0.12 0.00 0.84 0.00 0.00 57.88 58.48 1svm h LEU 440 Cb 0.95 -0.10 -0.01 0.00 0.37 0.00 0.00 40.66 41.86 1svm h LEU 440 CO 0.08 0.43 -0.29 -0.08 -0.34 0.00 0.00 178.44 178.23 1svm h GLU 441 N 0.33 0.65 -0.78 1.25 4.81 -1.27 0.68 114.58 120.26 1svm h GLU 441 Ca 0.10 -0.28 0.01 0.00 -0.13 0.00 0.00 59.36 59.06 1svm h GLU 441 Cb 0.15 -0.02 -0.04 0.00 0.63 0.00 0.00 28.75 29.47 1svm h GLU 441 CO -0.01 0.87 0.52 1.25 -0.73 0.00 0.00 179.01 180.91 1svm h LEU 442 N 0.56 0.89 0.00 1.64 5.85 -0.83 -3.25 115.31 120.17 1svm h LEU 442 Ca 0.07 -0.02 -0.11 0.00 0.84 0.00 0.00 57.88 58.66 1svm h LEU 442 Cb 0.79 -0.22 -0.02 0.00 0.37 0.00 0.00 40.66 41.58 1svm h LEU 442 CO 0.06 0.64 -2.08 0.00 -0.34 0.00 0.00 178.44 176.72 1svm n GLY 444 N 1.40 -0.77 0.00 0.00 0.00 0.24 -4.85 105.19 101.21 1svm n GLY 444 Ca -0.12 -1.38 0.00 0.00 0.00 0.00 0.00 46.02 44.52 1svm n GLY 444 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1svm n GLY 445 N 0.20 -0.30 3.08 -0.02 0.00 -1.25 -3.43 105.19 103.48 1svm n GLY 445 Ca 0.00 -1.27 -0.12 0.00 0.00 0.00 0.00 46.02 44.63 1svm n GLY 445 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1svm s LYS 446 N -2.00 0.59 -0.16 1.61 -0.14 -0.97 -4.99 119.74 113.68 1svm s LYS 446 Ca 0.00 -0.91 -0.07 0.00 -1.36 0.00 0.00 55.97 53.63 1svm s LYS 446 Cb 0.00 -0.20 -0.04 0.00 -1.68 0.00 0.00 37.83 35.91 1svm s LYS 446 CO 0.00 0.01 0.08 0.00 -0.76 0.00 0.00 175.35 174.68 1svm s ALA 447 N -2.10 3.54 -0.01 5.17 0.00 -1.26 -1.27 121.76 125.83 1svm s ALA 447 Ca -0.04 -0.72 0.07 0.00 0.00 0.00 0.00 51.96 51.26 1svm s ALA 447 Cb -0.05 -1.90 -0.03 0.00 0.00 0.00 0.00 23.12 21.14 1svm s ALA 447 CO -0.02 0.33 -0.21 -0.51 0.00 0.00 0.00 175.76 175.36 1svm s LEU 448 N -0.13 2.39 -0.34 0.00 1.43 0.72 -4.91 118.68 117.84 1svm s LEU 448 Ca 0.08 -0.40 -0.09 0.00 -1.03 0.00 0.00 54.13 52.69 1svm s LEU 448 Cb -0.12 -1.43 0.02 0.00 0.03 0.00 0.00 46.19 44.69 1svm s LEU 448 CO 0.01 0.30 0.16 0.21 0.23 0.00 0.00 176.35 177.26 1svm s ASN 449 N -0.92 5.54 -0.16 2.29 3.04 -1.26 -2.68 114.94 120.79 1svm s ASN 449 Ca 0.12 -0.88 0.16 0.00 0.04 0.00 0.00 52.86 52.29 1svm s ASN 449 Cb -0.10 -1.97 0.56 0.00 -1.54 0.00 0.00 41.25 38.19 1svm s ASN 449 CO 0.01 -0.31 1.47 0.55 -3.04 0.00 0.00 177.10 175.78 1svm n VAL 450 N 4.94 2.14 0.71 -5.21 3.14 -1.26 -4.39 118.33 118.40 1svm n VAL 450 Ca -0.13 -1.63 0.12 0.00 -2.96 0.00 0.00 64.34 59.75 1svm n VAL 450 Cb 0.47 -0.12 0.25 0.00 -1.06 0.00 0.00 33.84 33.38 1svm n VAL 450 CO 0.00 0.00 0.00 0.59 -6.46 0.00 0.00 176.83 170.96 1svm n ASN 451 N -0.05 0.61 -4.89 6.55 3.02 -1.26 -4.11 115.26 115.12 1svm n ASN 451 Ca 0.21 0.11 -0.29 0.00 -0.03 0.00 0.00 54.58 54.58 1svm n ASN 451 Cb 0.87 0.04 0.04 0.00 -0.61 0.00 0.00 39.78 40.12 1svm n ASN 451 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1svm s LEU 452 N -3.87 3.02 0.25 3.41 1.43 -1.26 -4.64 118.68 117.02 1svm s LEU 452 Ca 0.08 1.01 -0.29 0.00 -1.03 0.00 0.00 54.13 53.91 1svm s LEU 452 Cb 0.15 -3.83 -0.15 0.00 0.03 0.00 0.00 46.19 42.39 1svm s LEU 452 CO 0.69 -1.23 0.93 -2.65 0.23 0.00 0.00 176.35 174.32 1svm n PRO 453 N -2.86 1.03 0.25 1.29 -0.02 -1.26 -4.85 135.00 128.58 1svm n PRO 453 Ca 0.06 0.36 0.17 0.00 -2.02 0.00 0.00 63.50 62.07 1svm n PRO 453 Cb 0.57 -1.68 0.80 0.00 -0.02 0.00 0.00 33.50 33.18 1svm n PRO 453 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 1svm h LEU 454 N 2.00 0.00 -1.02 2.45 4.07 -1.94 -2.72 115.31 118.15 1svm h LEU 454 Ca -0.38 0.00 0.05 0.00 0.08 0.00 0.00 57.88 57.63 1svm h LEU 454 Cb 1.36 0.00 -0.06 0.00 1.08 0.00 0.00 40.66 43.04 1svm h LEU 454 CO 0.61 0.00 0.65 0.44 -1.08 0.00 0.00 178.44 179.07 1svm h ASP 455 N 0.00 1.07 -0.37 -0.43 3.45 -2.04 -1.72 116.42 116.38 1svm h ASP 455 Ca 0.00 -0.00 -0.14 0.00 0.43 0.00 0.00 57.03 57.32 1svm h ASP 455 Cb 0.21 -0.23 -0.08 0.00 -0.56 0.00 0.00 39.33 38.66 1svm h ASP 455 CO 0.00 0.71 0.01 0.54 -1.57 0.00 0.00 179.24 178.93 1svm n ARG 456 N -4.47 2.29 0.06 3.56 1.74 -1.03 -4.59 116.66 114.22 1svm n ARG 456 Ca 0.15 -3.05 -0.21 0.00 -0.77 0.00 0.00 57.85 53.97 1svm n ARG 456 Cb 0.14 -1.86 -0.12 0.00 -1.02 0.00 0.00 32.46 29.60 1svm n ARG 456 CO 0.00 0.00 0.00 1.25 -1.52 0.00 0.00 177.63 177.36 1svm h LEU 457 N 1.32 0.83 -1.64 0.55 5.85 -1.22 -3.24 115.31 117.75 1svm h LEU 457 Ca 0.17 -0.80 0.03 0.00 0.84 0.00 0.00 57.88 58.12 1svm h LEU 457 Cb 1.68 -0.26 -0.02 0.00 0.37 0.00 0.00 40.66 42.43 1svm h LEU 457 CO 0.39 1.53 0.28 0.78 -0.34 0.00 0.00 178.44 181.08 1svm h ASN 458 N 0.23 0.40 -0.06 1.25 2.35 -1.81 -0.21 115.58 117.73 1svm h ASN 458 Ca -0.16 -0.01 -0.00 0.00 -0.55 0.00 0.00 56.30 55.59 1svm h ASN 458 Cb 1.76 -0.09 -0.00 0.00 0.05 0.00 0.00 38.32 40.04 1svm h ASN 458 CO 0.21 0.28 0.03 -0.26 -1.65 0.00 0.00 177.43 176.04 1svm h PHE 459 N 0.47 0.09 -0.53 1.19 0.05 -1.82 -1.83 116.94 114.55 1svm h PHE 459 Ca 0.17 -0.00 -0.07 0.00 3.82 0.00 0.00 57.97 61.89 1svm h PHE 459 Cb 0.10 -0.03 -0.02 0.00 2.00 0.00 0.00 35.95 38.00 1svm h PHE 459 CO -0.00 0.14 0.08 1.49 -0.18 0.00 0.00 178.31 179.84 1svm h GLU 460 N 0.01 0.89 0.00 1.51 4.57 -1.37 -2.65 114.58 117.53 1svm h GLU 460 Ca 0.02 -0.24 -0.02 0.00 -1.18 0.00 0.00 59.36 57.94 1svm h GLU 460 Cb 0.09 -0.10 -0.00 0.00 -0.16 0.00 0.00 28.75 28.57 1svm h GLU 460 CO -0.00 0.87 -0.08 -0.07 -1.18 0.00 0.00 179.01 178.55 1svm h LEU 461 N 0.77 0.00 -2.04 1.64 3.38 -0.91 -2.21 115.31 115.94 1svm h LEU 461 Ca 0.16 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.12 1svm h LEU 461 Cb 0.42 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.17 1svm h LEU 461 CO 0.01 0.08 -0.07 1.23 0.09 0.00 0.00 178.44 179.78 1svm h GLY 462 N 0.35 0.00 2.00 0.83 0.00 -0.95 -2.41 103.07 102.89 1svm h GLY 462 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1svm h GLY 462 CO 0.01 0.00 0.00 -0.39 0.00 0.00 0.00 176.54 176.16 1svm h VAL 463 N 0.00 0.00 0.00 4.60 -1.51 -1.48 -2.41 116.25 115.44 1svm h VAL 463 Ca -0.00 -0.21 0.00 0.00 -1.23 0.00 0.00 66.70 65.26 1svm h VAL 463 Cb 0.30 0.94 0.00 0.00 -2.13 0.00 0.00 31.29 30.40 1svm h VAL 463 CO 0.01 0.00 0.00 0.00 -1.23 0.00 0.00 177.57 176.35 1svm n ALA 464 N -1.83 2.19 -1.68 5.19 0.00 -0.91 -4.79 120.51 118.68 1svm n ALA 464 Ca 0.01 -0.11 -0.45 0.00 0.00 0.00 0.00 53.44 52.89 1svm n ALA 464 Cb 0.19 -1.38 -0.03 0.00 0.00 0.00 0.00 19.45 18.23 1svm n ALA 464 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 1svm n ILE 465 N -1.31 0.37 -1.28 0.00 5.41 -0.91 -1.52 119.36 120.12 1svm n ILE 465 Ca 0.10 -0.09 -0.10 0.00 1.00 0.00 0.00 62.75 63.66 1svm n ILE 465 Cb 0.20 -1.61 -0.04 0.00 -0.71 0.00 0.00 39.64 37.48 1svm n ILE 465 CO 0.00 0.00 0.00 0.47 0.00 0.00 0.00 176.55 177.02 1svm n ASP 466 N 2.99 -5.50 -4.83 4.38 8.00 -1.26 -4.97 116.55 115.36 1svm n ASP 466 Ca 0.15 0.26 -0.35 0.00 0.71 0.00 0.00 54.79 55.55 1svm n ASP 466 Cb 0.31 -4.04 -0.06 0.00 -0.02 0.00 0.00 41.12 37.31 1svm n ASP 466 CO 0.00 0.00 0.00 -1.10 -0.39 0.00 0.00 177.20 175.71 1svm s GLN 467 N -2.83 4.10 0.13 -1.24 -1.52 -0.58 -4.95 119.66 112.77 1svm s GLN 467 Ca 0.00 0.68 -0.14 0.00 -1.95 0.00 0.00 55.36 53.95 1svm s GLN 467 Cb 0.00 -2.86 -0.03 0.00 -0.22 0.00 0.00 33.01 29.90 1svm s GLN 467 CO 0.00 0.41 1.53 0.35 -0.25 0.00 0.00 175.29 177.32 1svm h PHE 468 N 3.35 0.87 -3.58 0.91 3.57 -1.89 -3.43 116.94 116.74 1svm h PHE 468 Ca -0.48 -0.19 -0.05 0.00 3.53 0.00 0.00 57.97 60.77 1svm h PHE 468 Cb 1.19 -0.21 -0.10 0.00 2.79 0.00 0.00 35.95 39.62 1svm h PHE 468 CO 0.64 0.91 -0.12 -0.48 -2.23 0.00 0.00 178.31 177.04 1svm s LEU 469 N -9.23 0.40 0.02 0.59 0.05 -1.22 -4.25 118.68 105.04 1svm s LEU 469 Ca -0.12 -0.75 0.02 0.00 0.05 0.00 0.00 54.13 53.32 1svm s LEU 469 Cb 0.10 1.76 -0.01 0.00 -2.05 0.00 0.00 46.19 45.99 1svm s LEU 469 CO 0.82 -1.05 -0.06 -0.69 -0.55 0.00 0.00 176.35 174.82 1svm s VAL 470 N -3.95 0.46 -0.19 1.48 1.01 -0.55 -2.29 120.40 116.38 1svm s VAL 470 Ca 0.16 -0.60 0.00 0.00 0.00 0.00 0.00 61.98 61.54 1svm s VAL 470 Cb 0.00 -0.46 0.02 0.00 0.00 0.00 0.00 36.38 35.94 1svm s VAL 470 CO 0.02 -0.11 -0.18 -0.69 0.00 0.00 0.00 175.10 174.15 1svm s VAL 471 N -0.68 2.26 -0.64 2.92 1.01 -0.40 -1.38 120.40 123.50 1svm s VAL 471 Ca -0.03 -0.87 -0.22 0.00 0.00 0.00 0.00 61.98 60.86 1svm s VAL 471 Cb -0.06 -1.96 0.08 0.00 0.00 0.00 0.00 36.38 34.44 1svm s VAL 471 CO 0.00 0.52 0.90 -0.36 0.00 0.00 0.00 175.10 176.16 1svm s PHE 472 N 1.31 2.76 0.16 5.22 0.08 0.89 -0.20 117.98 128.20 1svm s PHE 472 Ca 0.05 -0.62 -0.29 0.00 0.12 0.00 0.00 56.93 56.18 1svm s PHE 472 Cb -0.13 -4.21 -0.07 0.00 -0.57 0.00 0.00 43.02 38.04 1svm s PHE 472 CO -0.11 -1.55 0.93 -1.21 -0.10 0.00 0.00 175.22 173.18 1svm s GLU 473 N 3.72 4.74 -0.94 0.44 0.41 -1.09 -1.84 118.70 124.13 1svm s GLU 473 Ca 0.20 1.42 -0.14 0.00 -0.41 0.00 0.00 54.97 56.04 1svm s GLU 473 Cb -0.18 -3.33 0.02 0.00 -1.78 0.00 0.00 34.13 28.85 1svm s GLU 473 CO 0.10 0.36 0.60 -3.47 -0.49 0.00 0.00 175.26 172.36 1svm n ASP 474 N 2.21 -4.25 -4.70 -0.19 -0.08 -1.05 -4.76 116.55 103.73 1svm n ASP 474 Ca -0.00 -1.06 -0.42 0.00 -1.51 0.00 0.00 54.79 51.79 1svm n ASP 474 Cb 0.48 -1.50 -0.03 0.00 2.34 0.00 0.00 41.12 42.42 1svm n ASP 474 CO 0.00 0.00 0.00 -0.69 0.12 0.00 0.00 177.20 176.63 1svm s VAL 475 N -3.21 4.75 -0.09 5.18 1.01 -0.42 -4.92 120.40 122.70 1svm s VAL 475 Ca 0.19 1.99 -0.12 0.00 0.00 0.00 0.00 61.98 64.05 1svm s VAL 475 Cb -0.11 -4.28 -0.05 0.00 0.00 0.00 0.00 36.38 31.95 1svm s VAL 475 CO 0.88 0.08 0.28 -0.54 0.00 0.00 0.00 175.10 175.80 1svm s LYS 476 N 1.52 3.85 0.00 2.72 1.02 -1.26 -4.42 119.74 123.16 1svm s LYS 476 Ca 0.51 0.12 0.00 0.00 0.02 0.00 0.00 55.97 56.62 1svm s LYS 476 Cb -0.21 -3.27 0.00 0.00 -0.52 0.00 0.00 37.83 33.84 1svm s LYS 476 CO 0.23 0.59 0.00 0.41 -0.92 0.00 0.00 175.35 175.67 1svm n GLY 477 N 2.33 4.07 0.64 -3.33 0.00 -1.26 -1.30 105.19 106.34 1svm n GLY 477 Ca -0.16 -1.93 -0.03 0.00 0.00 0.00 0.00 46.02 43.90 1svm n GLY 477 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1svm n THR 478 N 0.00 0.17 -2.15 2.61 -2.24 -1.26 0.45 114.28 111.87 1svm n THR 478 Ca 0.00 -0.05 -0.30 0.00 -2.27 0.00 0.00 64.05 61.43 1svm n THR 478 Cb 0.00 -1.27 -0.05 0.00 -2.10 0.00 0.00 70.33 66.91 1svm n THR 478 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1svm s GLY 479 N -4.83 0.40 0.00 3.38 0.00 -1.26 -4.31 107.32 100.70 1svm s GLY 479 Ca -0.04 -2.12 0.00 0.00 0.00 0.00 0.00 44.72 42.56 1svm s GLY 479 CO 0.06 3.40 0.41 0.61 0.00 0.00 0.00 173.10 177.58 1svm n GLY 480 N 6.03 -0.05 0.37 0.20 0.00 -1.26 -3.55 105.19 106.92 1svm n GLY 480 Ca 0.44 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.45 1svm n GLY 480 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1svm h GLU 481 N 0.00 1.21 -0.94 1.61 3.07 -1.75 0.15 114.58 117.94 1svm h GLU 481 Ca 0.00 -0.07 0.13 0.00 -0.50 0.00 0.00 59.36 58.92 1svm h GLU 481 Cb 1.07 -0.27 -0.09 0.00 -0.84 0.00 0.00 28.75 28.61 1svm h GLU 481 CO 0.00 0.80 0.56 1.03 -1.40 0.00 0.00 179.01 180.00 1svm h SER 482 N 1.25 0.77 -0.52 1.42 0.87 -1.91 -1.07 113.55 114.37 1svm h SER 482 Ca 0.38 0.07 0.00 0.00 -1.23 0.00 0.00 61.79 61.01 1svm h SER 482 Cb -0.03 -0.08 0.00 0.00 -0.44 0.00 0.00 62.40 61.86 1svm h SER 482 CO -0.12 0.37 0.00 0.54 -0.53 0.00 0.00 176.83 177.10 1svm n ARG 483 N -4.72 4.41 -2.50 2.24 5.12 -0.84 -4.90 116.66 115.46 1svm n ARG 483 Ca 0.18 -2.79 -0.19 0.00 -1.93 0.00 0.00 57.85 53.13 1svm n ARG 483 Cb 0.40 -2.16 -0.00 0.00 -1.16 0.00 0.00 32.46 29.53 1svm n ARG 483 CO 0.00 0.00 0.00 -0.25 -1.93 0.00 0.00 177.63 175.45 1svm n ASP 484 N 0.59 -5.33 -4.68 0.55 10.43 -0.40 -4.95 116.55 112.75 1svm n ASP 484 Ca 0.25 0.00 -0.38 0.00 2.57 0.00 0.00 54.79 57.23 1svm n ASP 484 Cb 1.08 -4.44 -0.08 0.00 1.84 0.00 0.00 41.12 39.52 1svm n ASP 484 CO 0.00 0.00 0.00 -0.76 -1.07 0.00 0.00 177.20 175.37 1svm s LEU 485 N -6.01 4.16 0.34 0.64 1.43 0.47 -5.01 118.68 114.71 1svm s LEU 485 Ca 0.04 0.43 -0.29 0.00 -1.03 0.00 0.00 54.13 53.29 1svm s LEU 485 Cb -0.02 -2.41 -0.10 0.00 0.03 0.00 0.00 46.19 43.69 1svm s LEU 485 CO 0.05 -0.02 1.33 -2.84 0.23 0.00 0.00 176.35 175.10 1svm s PRO 486 N 1.13 4.32 0.61 1.29 0.02 -1.26 -4.03 135.00 137.07 1svm s PRO 486 Ca 0.16 2.26 -0.15 0.00 0.02 0.00 0.00 61.00 63.30 1svm s PRO 486 Cb -0.14 -3.06 -0.03 0.00 0.02 0.00 0.00 34.50 31.29 1svm s PRO 486 CO 0.07 -0.23 1.05 -1.12 -0.33 0.00 0.00 177.00 176.43 1svm s SER 487 N -0.45 5.78 0.38 2.53 0.01 -1.26 -4.64 113.70 116.05 1svm s SER 487 Ca 0.49 1.75 -0.15 0.00 1.31 0.00 0.00 55.95 59.35 1svm s SER 487 Cb -0.41 -2.52 0.05 0.00 0.21 0.00 0.00 66.02 63.36 1svm s SER 487 CO 0.54 -1.17 0.78 -0.83 0.41 0.00 0.00 173.24 172.97 1svm s GLY 488 N -3.04 0.40 0.00 3.44 0.00 0.17 -4.93 107.32 103.36 1svm s GLY 488 Ca 0.62 -0.77 0.19 0.00 0.00 0.00 0.00 44.72 44.76 1svm s GLY 488 CO 0.40 -0.33 1.09 -1.06 0.00 0.00 0.00 173.10 173.20 1svm n GLN 489 N -0.53 1.69 -0.15 2.90 1.13 -1.25 -4.28 117.38 116.88 1svm n GLN 489 Ca -0.08 -1.51 -0.04 0.00 -1.94 0.00 0.00 57.00 53.42 1svm n GLN 489 Cb 0.60 -1.37 0.02 0.00 0.11 0.00 0.00 30.24 29.60 1svm n GLN 489 CO 0.00 0.00 0.00 0.78 -1.44 0.00 0.00 177.06 176.40 1svm h GLY 490 N 3.89 0.12 0.86 1.08 0.00 -1.42 0.20 103.07 107.80 1svm h GLY 490 Ca 0.00 0.29 -0.02 0.00 0.00 0.00 0.00 47.33 47.60 1svm h GLY 490 CO 0.00 -0.21 0.05 -2.22 0.00 0.00 0.00 176.54 174.16 1svm h ILE 491 N -0.11 1.20 -0.94 2.60 5.03 -1.47 -0.83 117.51 122.99 1svm h ILE 491 Ca 0.23 -0.63 0.05 0.00 -0.12 0.00 0.00 64.86 64.38 1svm h ILE 491 Cb 0.47 1.24 -0.06 0.00 -3.03 0.00 0.00 36.82 35.44 1svm h ILE 491 CO -0.56 0.20 0.61 0.78 -0.68 0.00 0.00 178.15 178.50 1svm h ASN 492 N 0.15 0.99 -0.25 1.72 2.35 -1.73 0.25 115.58 119.06 1svm h ASN 492 Ca 0.06 -0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.80 1svm h ASN 492 Cb 0.25 -0.22 -0.01 0.00 0.05 0.00 0.00 38.32 38.40 1svm h ASN 492 CO -0.00 0.66 0.12 0.78 -1.65 0.00 0.00 177.43 177.34 1svm h ASN 493 N 1.14 0.33 -0.72 5.81 -0.26 -0.30 -2.28 115.58 119.30 1svm h ASN 493 Ca 0.39 -0.12 -0.02 0.00 -0.56 0.00 0.00 56.30 55.99 1svm h ASN 493 Cb 0.09 -0.08 -0.03 0.00 -1.06 0.00 0.00 38.32 37.24 1svm h ASN 493 CO -0.13 0.35 0.37 -0.07 -1.06 0.00 0.00 177.43 176.89 1svm h LEU 494 N 0.28 0.92 -1.94 1.61 3.38 -0.34 -1.71 115.31 117.51 1svm h LEU 494 Ca 0.09 -0.09 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1svm h LEU 494 Cb 0.11 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 40.63 1svm h LEU 494 CO -0.01 0.76 0.00 -0.78 0.09 0.00 0.00 178.44 178.50 1svm h ASP 495 N 1.03 0.00 0.10 -0.43 1.82 -0.57 0.41 116.42 118.77 1svm h ASP 495 Ca 0.26 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.90 1svm h ASP 495 Cb 0.07 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.08 1svm h ASP 495 CO -0.04 0.00 -0.10 0.59 -1.61 0.00 0.00 179.24 178.09 1svm n ASN 496 N -2.92 1.22 -2.05 2.28 3.02 -0.65 -4.07 115.26 112.09 1svm n ASN 496 Ca -0.01 -1.21 -0.25 0.00 -0.03 0.00 0.00 54.58 53.08 1svm n ASN 496 Cb 0.19 0.04 0.04 0.00 -0.61 0.00 0.00 39.78 39.44 1svm n ASN 496 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1svm n LEU 497 N -0.22 5.45 -0.33 3.41 4.77 0.13 -4.80 117.00 125.41 1svm n LEU 497 Ca 0.16 -4.63 -0.01 0.00 -0.03 0.00 0.00 56.01 51.51 1svm n LEU 497 Cb 0.34 -0.48 0.12 0.00 -2.33 0.00 0.00 43.42 41.07 1svm n LEU 497 CO 0.20 1.95 1.23 0.03 -1.33 0.00 0.00 177.39 179.48 1svm h ARG 498 N 2.10 1.08 0.00 3.23 3.08 -1.71 -1.15 114.38 121.02 1svm h ARG 498 Ca 0.41 -0.07 -0.01 0.00 0.07 0.00 0.00 59.98 60.38 1svm h ARG 498 Cb 1.39 -0.24 -0.00 0.00 0.08 0.00 0.00 29.97 31.19 1svm h ARG 498 CO 0.91 0.72 -0.07 0.38 -1.07 0.00 0.00 179.97 180.84 1svm h ASP 499 N 1.12 0.00 0.01 7.04 2.03 -1.94 0.22 116.42 124.89 1svm h ASP 499 Ca 0.36 0.00 -0.04 0.00 -0.73 0.00 0.00 57.03 56.61 1svm h ASP 499 Cb 0.01 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.51 1svm h ASP 499 CO -0.12 0.07 -0.17 1.88 -1.03 0.00 0.00 179.24 179.87 1svm h TYR 500 N 0.00 0.16 -0.46 4.15 -1.99 -1.59 -3.20 116.97 114.05 1svm h TYR 500 Ca -0.00 -0.09 -0.11 0.00 2.00 0.00 0.00 58.73 60.53 1svm h TYR 500 Cb 0.45 -0.02 -0.02 0.00 2.00 0.00 0.00 36.73 39.15 1svm h TYR 500 CO 0.00 0.93 -0.16 -0.07 -0.00 0.00 0.00 178.16 178.86 1svm h LEU 501 N -0.66 0.88 -0.65 3.88 3.38 -1.08 -3.20 115.31 117.86 1svm h LEU 501 Ca -0.02 -0.30 -0.00 0.00 0.09 0.00 0.00 57.88 57.65 1svm h LEU 501 Cb 0.98 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 41.46 1svm h LEU 501 CO 0.03 1.03 0.39 0.44 0.09 0.00 0.00 178.44 180.43 1svm h ASP 502 N 0.77 0.78 -1.07 -0.43 3.32 -1.08 -3.42 116.42 115.29 1svm h ASP 502 Ca 0.12 -0.06 -0.19 0.00 0.02 0.00 0.00 57.03 56.91 1svm h ASP 502 Cb 0.69 -0.20 -0.03 0.00 0.22 0.00 0.00 39.33 40.01 1svm h ASP 502 CO 0.05 0.61 -0.22 0.61 -1.72 0.00 0.00 179.24 178.57 1svm n GLY 503 N -1.16 0.33 0.11 2.75 0.00 -1.21 -0.14 105.19 105.88 1svm n GLY 503 Ca 0.05 -0.52 -0.21 0.00 0.00 0.00 0.00 46.02 45.33 1svm n GLY 503 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1svm n SER 504 N 0.27 1.88 -4.87 1.61 7.64 -1.26 -4.71 113.62 114.19 1svm n SER 504 Ca -0.11 0.42 -0.24 0.00 1.01 0.00 0.00 58.87 59.95 1svm n SER 504 Cb 0.50 -0.91 -0.04 0.00 -1.01 0.00 0.00 64.21 62.75 1svm n SER 504 CO 0.00 0.00 0.00 0.68 -3.01 0.00 0.00 175.04 172.71 1svm s VAL 505 N -2.41 4.80 0.31 0.44 -7.23 -1.26 -5.07 120.40 109.98 1svm s VAL 505 Ca -0.30 -1.04 -0.27 0.00 -1.81 0.00 0.00 61.98 58.55 1svm s VAL 505 Cb 0.08 -3.51 -0.09 0.00 0.56 0.00 0.00 36.38 33.41 1svm s VAL 505 CO 0.51 -0.19 1.02 -0.54 -0.31 0.00 0.00 175.10 175.59 1svm s LYS 506 N -3.43 4.55 0.39 4.82 1.02 -1.26 -4.64 119.74 121.19 1svm s LYS 506 Ca 0.33 1.57 0.08 0.00 0.02 0.00 0.00 55.97 57.96 1svm s LYS 506 Cb -0.10 -2.96 -0.02 0.00 -0.52 0.00 0.00 37.83 34.23 1svm s LYS 506 CO 0.26 0.20 0.34 0.14 -0.92 0.00 0.00 175.35 175.37 1svm s VAL 507 N -1.39 2.89 -0.41 3.17 -7.23 0.87 -4.80 120.40 113.49 1svm s VAL 507 Ca 0.48 -1.37 -0.07 0.00 -1.81 0.00 0.00 61.98 59.21 1svm s VAL 507 Cb -0.25 -3.05 0.09 0.00 0.56 0.00 0.00 36.38 33.73 1svm s VAL 507 CO 0.32 -0.05 0.24 0.20 -0.31 0.00 0.00 175.10 175.50 1svm s ASN 508 N -4.08 5.51 -0.13 4.85 0.01 -1.26 -1.45 114.94 118.39 1svm s ASN 508 Ca 0.46 -1.62 -0.08 0.00 -0.71 0.00 0.00 52.86 50.90 1svm s ASN 508 Cb -0.04 -1.94 -0.04 0.00 0.41 0.00 0.00 41.25 39.64 1svm s ASN 508 CO 0.27 -0.53 0.16 -0.76 -1.51 0.00 0.00 177.10 174.73 1svm s LEU 509 N 1.35 4.35 -0.14 0.60 1.43 0.40 -4.95 118.68 121.71 1svm s LEU 509 Ca 0.04 0.45 0.02 0.00 -1.03 0.00 0.00 54.13 53.60 1svm s LEU 509 Cb -0.23 -2.12 0.01 0.00 0.03 0.00 0.00 46.19 43.89 1svm s LEU 509 CO 0.00 0.34 -0.19 -1.83 0.23 0.00 0.00 176.35 174.90 1svm s GLU 510 N -0.67 2.75 -0.92 1.70 -1.05 -1.26 -0.02 118.70 119.24 1svm s GLU 510 Ca 0.14 -0.75 0.00 0.00 -0.15 0.00 0.00 54.97 54.21 1svm s GLU 510 Cb -0.12 -2.30 0.31 0.00 -0.44 0.00 0.00 34.13 31.58 1svm s GLU 510 CO 0.03 -0.09 1.43 1.17 0.95 0.00 0.00 175.26 178.75 1svm n LYS 511 N 4.29 4.38 -0.67 -4.83 4.81 -0.03 -4.16 118.16 121.96 1svm n LYS 511 Ca -0.20 -4.67 0.09 0.00 -0.87 0.00 0.00 58.31 52.67 1svm n LYS 511 Cb 0.51 -2.42 -0.02 0.00 0.02 0.00 0.00 35.03 33.12 1svm n LYS 511 CO 0.00 0.00 0.00 1.63 1.17 0.00 0.00 177.40 180.20 1svm n LYS 512 N 0.46 -1.35 -0.64 1.64 4.76 -1.26 -3.69 118.16 118.09 1svm n LYS 512 Ca 0.35 0.89 -0.13 0.00 -2.87 0.00 0.00 58.31 56.56 1svm n LYS 512 Cb 0.32 -1.64 -0.07 0.00 -1.84 0.00 0.00 35.03 31.81 1svm n LYS 512 CO 0.00 0.00 0.00 -2.39 -1.37 0.00 0.00 177.40 173.64 1svm n HIS 513 N -2.51 0.52 -0.87 2.13 1.44 -1.26 -3.08 115.22 111.59 1svm n HIS 513 Ca 0.00 -1.28 0.00 0.00 -2.01 0.00 0.00 57.72 54.43 1svm n HIS 513 Cb 0.30 -1.31 0.00 0.00 0.12 0.00 0.00 29.99 29.11 1svm n HIS 513 CO 0.00 0.00 0.00 1.47 -2.81 0.00 0.00 176.34 175.00 1svm n LEU 514 N 3.28 0.00 -2.87 2.39 -0.00 -1.26 -5.08 117.00 113.46 1svm n LEU 514 Ca 0.32 0.00 -0.04 0.00 -0.00 0.00 0.00 56.01 56.30 1svm n LEU 514 Cb 0.37 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.80 1svm n LEU 514 CO 0.38 0.10 0.10 0.21 -0.00 0.00 0.00 177.39 178.18 1svm s ASN 515 N 0.00 -1.38 0.54 1.45 3.04 -1.18 -5.05 114.94 112.36 1svm s ASN 515 Ca 0.00 -1.58 -0.04 0.00 0.04 0.00 0.00 52.86 51.28 1svm s ASN 515 Cb 0.00 1.85 0.01 0.00 -1.54 0.00 0.00 41.25 41.57 1svm s ASN 515 CO 0.00 -0.08 0.82 -0.54 -3.04 0.00 0.00 177.10 174.26 1svm s LYS 516 N 1.05 2.95 -0.30 0.43 3.01 -1.26 -0.85 119.74 124.77 1svm s LYS 516 Ca 0.27 -0.19 -0.16 0.00 -1.01 0.00 0.00 55.97 54.88 1svm s LYS 516 Cb -0.01 -2.37 0.16 0.00 -1.01 0.00 0.00 37.83 34.60 1svm s LYS 516 CO -0.06 -0.56 1.01 0.50 0.51 0.00 0.00 175.35 176.75 1svm s ARG 517 N -4.84 0.30 -0.35 1.68 6.06 0.98 -4.92 118.95 117.86 1svm s ARG 517 Ca 0.52 0.65 -0.14 0.00 -2.50 0.00 0.00 55.73 54.27 1svm s ARG 517 Cb -0.10 0.28 -0.01 0.00 0.06 0.00 0.00 34.95 35.17 1svm s ARG 517 CO 0.42 -0.09 0.28 0.99 -2.50 0.00 0.00 175.30 174.41 1svm s THR 518 N 1.97 5.25 0.23 4.11 2.01 -1.26 -0.46 115.64 127.50 1svm s THR 518 Ca -0.05 -0.20 -0.15 0.00 0.31 0.00 0.00 61.69 61.60 1svm s THR 518 Cb -0.05 -3.77 0.01 0.00 0.01 0.00 0.00 72.50 68.70 1svm s THR 518 CO -0.16 -0.07 0.50 0.00 -0.69 0.00 0.00 174.62 174.21 1svm s GLN 519 N 1.79 1.50 0.09 4.92 -2.07 -0.53 -4.90 119.66 120.47 1svm s GLN 519 Ca 0.07 -1.11 -0.30 0.00 -1.82 0.00 0.00 55.36 52.19 1svm s GLN 519 Cb -0.17 0.49 -0.06 0.00 -1.09 0.00 0.00 33.01 32.18 1svm s GLN 519 CO 0.11 -0.63 1.20 -1.50 -1.32 0.00 0.00 175.29 173.15 1svm s ILE 520 N -3.96 3.93 0.58 3.63 2.07 -1.26 -0.09 121.20 126.10 1svm s ILE 520 Ca 0.17 1.43 -0.20 0.00 -1.41 0.00 0.00 60.65 60.65 1svm s ILE 520 Cb -0.01 -3.92 -0.04 0.00 0.13 0.00 0.00 42.46 38.63 1svm s ILE 520 CO 0.05 0.13 1.26 0.12 -1.91 0.00 0.00 174.94 174.59 1svm s PHE 521 N 0.84 2.33 0.66 3.50 5.36 -1.26 -4.92 117.98 124.49 1svm s PHE 521 Ca 0.58 1.48 -0.15 0.00 -0.96 0.00 0.00 56.93 57.87 1svm s PHE 521 Cb -0.30 -3.60 -0.00 0.00 -0.34 0.00 0.00 43.02 38.78 1svm s PHE 521 CO 0.30 -2.48 1.13 -2.14 -1.46 0.00 0.00 175.22 170.57 1svm s PRO 522 N -3.19 2.76 0.88 10.12 0.02 -1.26 -4.81 135.00 139.52 1svm s PRO 522 Ca 0.76 1.47 -0.13 0.00 0.02 0.00 0.00 61.00 63.13 1svm s PRO 522 Cb -0.34 -1.94 0.20 0.00 0.02 0.00 0.00 34.50 32.44 1svm s PRO 522 CO 0.38 -1.30 1.20 -0.35 -0.33 0.00 0.00 177.00 176.60 1svm n PRO 523 N -2.34 -1.03 0.00 5.54 -0.04 -1.26 -4.67 135.00 131.20 1svm n PRO 523 Ca 0.11 -2.04 0.00 0.00 -0.04 0.00 0.00 63.50 61.52 1svm n PRO 523 Cb 0.52 -1.18 0.00 0.00 -0.04 0.00 0.00 33.50 32.80 1svm n PRO 523 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1svm n GLY 524 N -3.03 -0.65 3.12 0.55 0.00 -0.97 -1.48 105.19 102.74 1svm n GLY 524 Ca 0.16 -0.39 -0.13 0.00 0.00 0.00 0.00 46.02 45.65 1svm n GLY 524 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1svm s ILE 525 N -4.00 0.71 -0.06 -0.61 1.01 -0.48 -2.22 121.20 115.56 1svm s ILE 525 Ca 0.00 -1.41 0.02 0.00 0.00 0.00 0.00 60.65 59.25 1svm s ILE 525 Cb 0.00 -1.05 0.02 0.00 0.01 0.00 0.00 42.46 41.43 1svm s ILE 525 CO 0.00 -0.52 -0.09 -0.69 0.00 0.00 0.00 174.94 173.65 1svm s VAL 526 N -2.10 0.88 0.00 2.92 1.01 -0.69 -0.08 120.40 122.34 1svm s VAL 526 Ca -0.01 -0.32 0.06 0.00 0.00 0.00 0.00 61.98 61.72 1svm s VAL 526 Cb -0.05 -0.85 -0.03 0.00 0.00 0.00 0.00 36.38 35.46 1svm s VAL 526 CO -0.01 0.30 -0.19 0.42 0.00 0.00 0.00 175.10 175.63 1svm s THR 527 N 0.86 2.66 0.17 3.92 -4.23 -0.77 -0.06 115.64 118.20 1svm s THR 527 Ca -0.11 -1.05 -0.24 0.00 -1.18 0.00 0.00 61.69 59.11 1svm s THR 527 Cb -0.15 -2.05 0.06 0.00 1.34 0.00 0.00 72.50 71.70 1svm s THR 527 CO 0.01 0.47 0.71 0.00 -0.54 0.00 0.00 174.62 175.27 1svm s MET 528 N -1.04 1.34 -0.34 3.99 0.23 -0.30 -1.30 119.30 121.89 1svm s MET 528 Ca 0.12 -0.61 -0.03 0.00 -1.03 0.00 0.00 55.69 54.15 1svm s MET 528 Cb -0.10 0.55 0.06 0.00 -1.53 0.00 0.00 34.83 33.80 1svm s MET 528 CO 0.02 -0.60 2.66 0.09 -2.03 0.00 0.00 175.02 175.17 1svm n ASN 529 N -0.39 6.27 -3.44 -1.18 5.03 -1.26 -2.35 115.26 117.94 1svm n ASN 529 Ca -0.11 -3.04 -0.21 0.00 0.87 0.00 0.00 54.58 52.08 1svm n ASN 529 Cb 0.62 -1.21 0.08 0.00 -1.02 0.00 0.00 39.78 38.26 1svm n ASN 529 CO 0.00 0.00 0.00 -0.62 -1.83 0.00 0.00 177.26 174.81 1svm n GLU 530 N 0.98 -7.34 -2.53 3.52 1.02 -1.26 -4.87 120.64 110.17 1svm n GLU 530 Ca 0.41 0.80 -0.24 0.00 -0.02 0.00 0.00 57.16 58.12 1svm n GLU 530 Cb 0.61 -5.75 0.09 0.00 -0.02 0.00 0.00 31.44 26.37 1svm n GLU 530 CO 0.00 0.00 0.00 0.71 1.18 0.00 0.00 177.13 179.02 1svm s TYR 531 N -3.32 2.00 0.27 -0.32 1.51 -1.26 -4.93 117.35 111.31 1svm s TYR 531 Ca 0.42 -0.12 -0.29 0.00 -1.01 0.00 0.00 57.07 56.07 1svm s TYR 531 Cb -0.18 -3.02 -0.09 0.00 -0.11 0.00 0.00 41.96 38.56 1svm s TYR 531 CO 0.70 -1.54 0.96 0.45 -1.11 0.00 0.00 175.55 175.01 1svm s SER 532 N -4.65 7.50 -0.22 2.29 0.15 -1.23 -5.04 113.70 112.50 1svm s SER 532 Ca 0.64 1.95 0.02 0.00 0.70 0.00 0.00 55.95 59.26 1svm s SER 532 Cb -0.07 -2.60 0.04 0.00 -1.71 0.00 0.00 66.02 61.68 1svm s SER 532 CO 0.43 0.05 -0.15 -0.69 1.20 0.00 0.00 173.24 174.08 1svm s VAL 533 N -1.31 2.06 0.39 4.45 1.01 -1.26 -4.80 120.40 120.93 1svm s VAL 533 Ca 0.44 -1.26 -0.25 0.00 0.00 0.00 0.00 61.98 60.92 1svm s VAL 533 Cb -0.24 -2.03 -0.12 0.00 0.00 0.00 0.00 36.38 33.99 1svm s VAL 533 CO 0.30 0.24 0.88 -2.65 0.00 0.00 0.00 175.10 173.88 1svm n PRO 534 N 4.54 1.12 0.24 2.72 -0.02 -1.26 -4.67 135.00 137.67 1svm n PRO 534 Ca -0.17 0.40 0.08 0.00 -2.02 0.00 0.00 63.50 61.78 1svm n PRO 534 Cb 0.46 -1.84 0.61 0.00 -0.02 0.00 0.00 33.50 32.71 1svm n PRO 534 CO 0.00 0.00 0.00 1.57 1.98 0.00 0.00 175.50 179.05 1svm h LYS 535 N 1.43 0.04 -0.39 -0.52 2.10 -1.99 0.12 116.57 117.37 1svm h LYS 535 Ca -0.42 -0.00 -0.09 0.00 -2.00 0.00 0.00 60.65 58.14 1svm h LYS 535 Cb 1.36 -0.01 -0.02 0.00 -0.90 0.00 0.00 32.23 32.66 1svm h LYS 535 CO 0.56 0.04 -0.12 1.79 -2.00 0.00 0.00 179.45 179.72 1svm h THR 536 N 0.04 1.25 0.15 0.07 1.35 -2.01 -2.26 112.91 111.50 1svm h THR 536 Ca 0.01 -1.15 -0.30 0.00 -0.55 0.00 0.00 66.41 64.43 1svm h THR 536 Cb 0.01 1.08 0.03 0.00 -1.73 0.00 0.00 68.15 67.55 1svm h THR 536 CO -0.00 0.39 -1.25 0.25 -0.25 0.00 0.00 175.52 174.66 1svm h LEU 537 N 0.64 0.84 -2.04 3.87 5.85 -1.49 -3.25 115.31 119.74 1svm h LEU 537 Ca 0.11 -0.85 0.02 0.00 0.84 0.00 0.00 57.88 58.00 1svm h LEU 537 Cb 0.58 -0.27 -0.00 0.00 0.37 0.00 0.00 40.66 41.33 1svm h LEU 537 CO 0.04 1.61 0.04 -0.61 -0.34 0.00 0.00 178.44 179.18 1svm h GLN 538 N 0.20 0.00 0.00 1.25 5.75 -0.95 -0.86 115.11 120.51 1svm h GLN 538 Ca -0.20 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.30 1svm h GLN 538 Cb 1.93 0.00 0.00 0.00 1.07 0.00 0.00 27.48 30.48 1svm h GLN 538 CO 0.24 0.00 0.00 0.00 -2.65 0.00 0.00 178.83 176.42 1svm h ALA 539 N 1.97 1.00 -0.00 3.38 0.00 -1.44 -1.89 119.26 122.27 1svm h ALA 539 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1svm h ALA 539 Cb 0.11 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.90 1svm h ALA 539 CO -0.00 0.00 -0.41 0.54 0.00 0.00 0.00 179.25 179.38 1svm n ARG 540 N -2.69 0.46 -3.48 0.00 3.00 -0.33 -4.80 116.66 108.81 1svm n ARG 540 Ca -0.01 -0.28 -0.42 0.00 -0.01 0.00 0.00 57.85 57.13 1svm n ARG 540 Cb 0.14 -1.49 -0.10 0.00 0.00 0.00 0.00 32.46 31.01 1svm n ARG 540 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.63 177.57 1svm s PHE 541 N -2.74 3.24 0.25 -1.55 2.99 -0.71 -3.74 117.98 115.71 1svm s PHE 541 Ca 0.18 -0.49 0.02 0.00 0.00 0.00 0.00 56.93 56.63 1svm s PHE 541 Cb 0.18 -2.55 0.30 0.00 0.00 0.00 0.00 43.02 40.95 1svm s PHE 541 CO 0.62 -0.53 1.63 -0.39 -0.00 0.00 0.00 175.22 176.55 1svm h VAL 542 N 5.60 1.31 -3.72 -0.44 -1.51 -1.33 -3.45 116.25 112.71 1svm h VAL 542 Ca -0.28 -1.58 -0.21 0.00 -1.23 0.00 0.00 66.70 63.40 1svm h VAL 542 Cb 1.13 1.63 -0.26 0.00 -2.13 0.00 0.00 31.29 31.66 1svm h VAL 542 CO 0.70 0.49 -0.68 -0.75 -1.23 0.00 0.00 177.57 176.10 1svm s LYS 543 N -4.17 0.12 -0.13 5.19 2.20 -1.24 -5.07 119.74 116.63 1svm s LYS 543 Ca -0.06 -0.12 0.02 0.00 -0.36 0.00 0.00 55.97 55.44 1svm s LYS 543 Cb 0.13 0.05 0.02 0.00 -1.51 0.00 0.00 37.83 36.51 1svm s LYS 543 CO 0.80 -0.02 -0.18 -1.14 -0.36 0.00 0.00 175.35 174.46 1svm s GLN 544 N -0.38 2.55 -0.18 4.03 0.74 -1.26 -0.56 119.66 124.59 1svm s GLN 544 Ca -0.04 -0.67 -0.03 0.00 0.05 0.00 0.00 55.36 54.67 1svm s GLN 544 Cb -0.03 -2.16 -0.01 0.00 1.10 0.00 0.00 33.01 31.91 1svm s GLN 544 CO -0.00 -0.09 -0.06 0.42 -0.55 0.00 0.00 175.29 175.00 1svm s ILE 545 N 1.06 3.40 -0.32 -2.34 1.09 0.50 -4.96 121.20 119.63 1svm s ILE 545 Ca -0.04 -0.51 -0.14 0.00 -1.10 0.00 0.00 60.65 58.87 1svm s ILE 545 Cb -0.15 -2.50 -0.03 0.00 -1.06 0.00 0.00 42.46 38.73 1svm s ILE 545 CO -0.04 0.46 0.30 -1.81 -0.10 0.00 0.00 174.94 173.75 1svm s ASP 546 N 0.94 6.13 0.18 3.58 1.01 -1.26 -1.25 116.67 125.99 1svm s ASP 546 Ca -0.01 -0.15 -0.16 0.00 0.71 0.00 0.00 52.55 52.94 1svm s ASP 546 Cb -0.15 -2.17 -0.07 0.00 1.01 0.00 0.00 42.92 41.54 1svm s ASP 546 CO 0.00 -0.23 0.62 -0.36 0.21 0.00 0.00 175.17 175.42 1svm s PHE 547 N 1.90 3.62 -0.04 4.23 0.40 0.26 -4.98 117.98 123.36 1svm s PHE 547 Ca 0.10 1.19 0.03 0.00 -0.60 0.00 0.00 56.93 57.65 1svm s PHE 547 Cb -0.17 -2.47 0.00 0.00 0.51 0.00 0.00 43.02 40.90 1svm s PHE 547 CO 0.11 0.38 -0.12 1.03 0.70 0.00 0.00 175.22 177.32 1svm s ARG 548 N -2.00 1.34 0.56 0.44 0.52 -1.26 -4.28 118.95 114.27 1svm s ARG 548 Ca 0.40 -0.41 -0.20 0.00 -0.52 0.00 0.00 55.73 55.00 1svm s ARG 548 Cb -0.15 -1.19 -0.04 0.00 0.52 0.00 0.00 34.95 34.08 1svm s ARG 548 CO 0.20 0.13 1.26 -2.14 0.02 0.00 0.00 175.30 174.77 1svm s PRO 549 N 0.27 3.13 -0.05 3.54 0.02 -1.26 -4.88 135.00 135.76 1svm s PRO 549 Ca -0.06 1.99 -0.01 0.00 0.02 0.00 0.00 61.00 62.94 1svm s PRO 549 Cb -0.11 -2.12 0.03 0.00 0.02 0.00 0.00 34.50 32.32 1svm s PRO 549 CO 0.02 -1.13 0.01 0.15 -0.33 0.00 0.00 177.00 175.72 1svm s LYS 550 N -3.07 0.41 0.25 5.54 1.02 -1.26 -5.04 119.74 117.59 1svm s LYS 550 Ca 0.74 0.13 -0.04 0.00 0.02 0.00 0.00 55.97 56.82 1svm s LYS 550 Cb -0.34 -0.74 0.39 0.00 -0.52 0.00 0.00 37.83 36.62 1svm s LYS 550 CO 0.39 -0.24 1.85 0.38 -0.92 0.00 0.00 175.35 176.80 1svm h ASP 551 N 7.97 0.86 0.01 2.83 3.04 -1.99 -2.10 116.42 127.03 1svm h ASP 551 Ca -0.26 0.03 -0.08 0.00 -3.24 0.00 0.00 57.03 53.48 1svm h ASP 551 Cb 1.13 -0.15 -0.01 0.00 -1.04 0.00 0.00 39.33 39.26 1svm h ASP 551 CO 0.31 0.52 -0.24 0.10 -2.04 0.00 0.00 179.24 177.89 1svm h TYR 552 N 0.98 0.42 -0.66 4.15 -0.00 -1.89 0.18 116.97 120.14 1svm h TYR 552 Ca 0.41 -0.08 -0.07 0.00 0.00 0.00 0.00 58.73 58.98 1svm h TYR 552 Cb 0.26 -0.11 -0.03 0.00 0.00 0.00 0.00 36.73 36.85 1svm h TYR 552 CO -0.03 0.60 0.13 -0.07 -0.00 0.00 0.00 178.16 178.78 1svm h LEU 553 N 0.34 1.03 0.07 0.10 3.38 -1.63 0.80 115.31 119.41 1svm h LEU 553 Ca 0.05 -0.25 -0.00 0.00 0.09 0.00 0.00 57.88 57.77 1svm h LEU 553 Cb 0.61 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 41.09 1svm h LEU 553 CO 0.04 1.02 -0.04 0.50 0.09 0.00 0.00 178.44 180.06 1svm h LYS 554 N 1.00 -0.10 -0.31 1.13 3.64 -0.87 -2.49 116.57 118.58 1svm h LYS 554 Ca 0.20 0.01 -0.04 0.00 -1.27 0.00 0.00 60.65 59.55 1svm h LYS 554 Cb 0.41 0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 32.24 1svm h LYS 554 CO 0.01 0.20 0.03 0.45 -2.27 0.00 0.00 179.45 177.87 1svm h HIS 555 N -0.39 0.47 0.06 1.91 3.86 -0.55 -2.06 115.15 118.46 1svm h HIS 555 Ca -0.01 -0.03 -0.00 0.00 -1.16 0.00 0.00 60.37 59.16 1svm h HIS 555 Cb 0.34 -0.14 0.00 0.00 1.06 0.00 0.00 27.41 28.67 1svm h HIS 555 CO 0.02 0.45 -0.03 0.00 0.86 0.00 0.00 177.93 179.23 1svm h LEU 557 N -0.18 0.62 -2.38 0.00 3.38 -1.11 0.47 115.31 116.12 1svm h LEU 557 Ca -0.01 -0.01 -0.00 0.00 0.09 0.00 0.00 57.88 57.95 1svm h LEU 557 Cb 0.15 -0.15 -0.00 0.00 0.09 0.00 0.00 40.66 40.75 1svm h LEU 557 CO 0.01 0.45 -0.00 -0.33 0.09 0.00 0.00 178.44 178.66 1svm h GLU 558 N 0.73 0.00 -0.35 1.13 5.08 -1.18 -1.11 114.58 118.89 1svm h GLU 558 Ca 0.20 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.56 1svm h GLU 558 Cb -0.06 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.19 1svm h GLU 558 CO -0.05 0.00 0.00 0.54 -1.00 0.00 0.00 179.01 178.51 1svm n ARG 559 N -3.96 2.90 -2.72 2.33 1.74 0.02 -4.52 116.66 112.46 1svm n ARG 559 Ca -0.03 -2.23 -0.09 0.00 -0.77 0.00 0.00 57.85 54.73 1svm n ARG 559 Cb 0.09 -1.39 0.04 0.00 -1.02 0.00 0.00 32.46 30.18 1svm n ARG 559 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54 1svm n SER 560 N 0.38 0.67 -0.31 0.55 7.64 -0.42 -4.30 113.62 117.82 1svm n SER 560 Ca 0.14 -2.72 0.25 0.00 1.01 0.00 0.00 58.87 57.56 1svm n SER 560 Cb 0.52 -0.19 0.57 0.00 -1.01 0.00 0.00 64.21 64.10 1svm n SER 560 CO 0.00 0.00 0.00 -0.33 -3.01 0.00 0.00 175.04 171.70 1svm h GLU 561 N 2.81 0.28 -0.25 1.43 3.07 -1.71 -1.24 114.58 118.97 1svm h GLU 561 Ca -0.11 -0.02 0.07 0.00 -0.50 0.00 0.00 59.36 58.80 1svm h GLU 561 Cb 1.18 -0.06 -0.01 0.00 -0.84 0.00 0.00 28.75 29.02 1svm h GLU 561 CO 0.38 0.19 0.23 0.27 -1.40 0.00 0.00 179.01 178.69 1svm h PHE 562 N 0.29 0.00 0.00 4.33 -5.15 -1.93 0.07 116.94 114.55 1svm h PHE 562 Ca 0.58 0.00 -0.03 0.00 -0.20 0.00 0.00 57.97 58.32 1svm h PHE 562 Cb 1.66 0.00 -0.00 0.00 0.22 0.00 0.00 35.95 37.83 1svm h PHE 562 CO -0.00 0.00 -0.13 -0.07 -2.00 0.00 0.00 178.31 176.11 1svm h LEU 563 N 0.00 0.00 0.02 2.10 3.38 -1.59 -0.18 115.31 119.04 1svm h LEU 563 Ca 0.12 0.00 -0.38 0.00 0.09 0.00 0.00 57.88 57.71 1svm h LEU 563 Cb 0.59 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.28 1svm h LEU 563 CO -0.00 0.13 -2.20 0.18 0.09 0.00 0.00 178.44 176.64 1svm n LEU 564 N -4.21 2.39 -0.00 1.67 4.77 -0.13 -1.37 117.00 120.12 1svm n LEU 564 Ca -0.02 0.18 0.04 0.00 -0.03 0.00 0.00 56.01 56.18 1svm n LEU 564 Cb 0.21 -0.93 0.43 0.00 -2.33 0.00 0.00 43.42 40.80 1svm n LEU 564 CO 0.34 0.69 1.16 -0.33 -1.33 0.00 0.00 177.39 177.93 1svm h GLU 565 N -0.49 0.53 -0.58 3.23 5.08 -1.14 -0.89 114.58 120.33 1svm h GLU 565 Ca -0.55 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 57.78 1svm h GLU 565 Cb 1.73 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 30.86 1svm h GLU 565 CO -0.19 0.35 0.00 1.63 -1.00 0.00 0.00 179.01 179.81 1svm n LYS 566 N -4.48 2.59 -3.86 2.33 5.02 -0.08 -4.97 118.16 114.71 1svm n LYS 566 Ca 0.03 -2.45 -0.24 0.00 -2.02 0.00 0.00 58.31 53.64 1svm n LYS 566 Cb 0.07 -1.54 -0.00 0.00 -0.02 0.00 0.00 35.03 33.54 1svm n LYS 566 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1svm n ARG 567 N 1.54 -3.81 -0.05 1.97 1.74 -0.34 -4.93 116.66 112.78 1svm n ARG 567 Ca 0.22 0.48 -0.20 0.00 -0.77 0.00 0.00 57.85 57.58 1svm n ARG 567 Cb 0.60 -4.74 -0.13 0.00 -1.02 0.00 0.00 32.46 27.18 1svm n ARG 567 CO 0.00 0.00 0.00 0.82 -1.52 0.00 0.00 177.63 176.93 1svm h ILE 568 N -1.85 1.10 0.00 0.55 2.04 -1.46 -3.33 117.51 114.56 1svm h ILE 568 Ca -0.62 -2.29 0.00 0.00 1.00 0.00 0.00 64.86 62.94 1svm h ILE 568 Cb 1.37 2.62 0.00 0.00 -0.74 0.00 0.00 36.82 40.07 1svm h ILE 568 CO 0.60 0.53 0.00 2.30 0.00 0.00 0.00 178.15 181.58 1svm n ILE 569 N -4.25 0.89 -0.36 -0.67 -5.35 -1.19 -1.85 119.36 106.59 1svm n ILE 569 Ca -0.26 0.24 0.09 0.00 -0.27 0.00 0.00 62.75 62.56 1svm n ILE 569 Cb 0.74 -1.12 0.27 0.00 -1.74 0.00 0.00 39.64 37.78 1svm n ILE 569 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1svm n GLN 570 N -2.00 2.92 -3.48 6.28 0.00 -1.26 -4.74 117.38 115.09 1svm n GLN 570 Ca 0.02 -2.50 -0.37 0.00 0.00 0.00 0.00 57.00 54.15 1svm n GLN 570 Cb 0.21 -1.52 -0.06 0.00 0.00 0.00 0.00 30.24 28.87 1svm n GLN 570 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.06 177.51 1svm s SER 571 N -1.02 6.81 0.51 2.61 0.15 -0.77 -2.40 113.70 119.59 1svm s SER 571 Ca 0.41 0.97 0.29 0.00 0.70 0.00 0.00 55.95 58.32 1svm s SER 571 Cb 0.22 -2.25 1.29 0.00 -1.71 0.00 0.00 66.02 63.57 1svm s SER 571 CO 0.26 0.28 1.97 1.23 1.20 0.00 0.00 173.24 178.18 1svm h GLY 572 N 4.45 0.00 1.54 9.45 0.00 -1.82 -2.38 103.07 114.31 1svm h GLY 572 Ca -0.51 0.00 -0.12 0.00 0.00 0.00 0.00 47.33 46.70 1svm h GLY 572 CO 0.63 0.00 -0.38 -2.22 0.00 0.00 0.00 176.54 174.57 1svm h ILE 573 N 0.00 1.30 -0.48 2.60 1.08 -1.92 -0.20 117.51 119.89 1svm h ILE 573 Ca -0.00 -1.52 -0.11 0.00 -0.39 0.00 0.00 64.86 62.85 1svm h ILE 573 Cb 0.53 1.54 -0.02 0.00 -3.07 0.00 0.00 36.82 35.80 1svm h ILE 573 CO 0.01 0.48 -0.12 0.00 -0.69 0.00 0.00 178.15 177.83 1svm h ALA 574 N 1.17 0.88 -0.27 1.87 0.00 -1.68 -0.43 119.26 120.80 1svm h ALA 574 Ca 0.04 -0.34 -0.15 0.00 0.00 0.00 0.00 54.91 54.46 1svm h ALA 574 Cb 0.85 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.46 1svm h ALA 574 CO 0.07 0.64 -0.45 -0.07 0.00 0.00 0.00 179.25 179.44 1svm h LEU 575 N 0.79 0.76 -0.65 0.00 3.38 -1.35 -1.08 115.31 117.17 1svm h LEU 575 Ca 0.13 -0.37 -0.08 0.00 0.09 0.00 0.00 57.88 57.65 1svm h LEU 575 Cb 0.65 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 41.16 1svm h LEU 575 CO 0.05 1.10 0.08 0.25 0.09 0.00 0.00 178.44 180.01 1svm h LEU 576 N 0.56 1.05 -1.04 1.67 5.85 -0.75 -0.53 115.31 122.12 1svm h LEU 576 Ca 0.04 -0.27 -0.05 0.00 0.84 0.00 0.00 57.88 58.43 1svm h LEU 576 Cb 1.00 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 41.73 1svm h LEU 576 CO 0.09 1.06 0.11 -0.07 -0.34 0.00 0.00 178.44 179.29 1svm h LEU 577 N 1.00 0.74 -0.37 2.25 3.38 -0.95 -1.23 115.31 120.14 1svm h LEU 577 Ca 0.19 -0.14 -0.02 0.00 0.09 0.00 0.00 57.88 58.01 1svm h LEU 577 Cb 0.47 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 41.01 1svm h LEU 577 CO 0.02 0.74 0.17 -0.03 0.09 0.00 0.00 178.44 179.43 1svm h MET 578 N 0.77 0.54 -0.67 1.13 4.05 -0.44 -0.79 114.93 119.52 1svm h MET 578 Ca 0.17 -0.08 -0.04 0.00 -0.28 0.00 0.00 59.70 59.46 1svm h MET 578 Cb 0.31 -0.09 -0.03 0.00 -0.80 0.00 0.00 31.60 30.98 1svm h MET 578 CO 0.00 0.49 0.24 -0.07 0.23 0.00 0.00 176.91 177.81 1svm h LEU 579 N 0.46 0.92 -0.59 3.39 3.38 -0.78 -0.61 115.31 121.48 1svm h LEU 579 Ca 0.13 -0.14 -0.09 0.00 0.09 0.00 0.00 57.88 57.86 1svm h LEU 579 Cb 0.14 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.63 1svm h LEU 579 CO -0.01 0.83 0.01 0.40 0.09 0.00 0.00 178.44 179.76 1svm h ILE 580 N 0.97 1.26 -0.09 1.22 2.04 -0.94 0.69 117.51 122.66 1svm h ILE 580 Ca 0.22 -1.12 -0.06 0.00 1.00 0.00 0.00 64.86 64.90 1svm h ILE 580 Cb 0.22 0.82 0.00 0.00 -0.74 0.00 0.00 36.82 37.12 1svm h ILE 580 CO -0.02 0.41 -0.19 -0.25 0.00 0.00 0.00 178.15 178.10 1svm h TRP 581 N 0.92 0.37 0.11 1.37 2.91 -0.84 -3.39 115.95 117.40 1svm h TRP 581 Ca 0.17 -0.13 -0.35 0.00 1.13 0.00 0.00 58.89 59.71 1svm h TRP 581 Cb 0.53 -0.07 -0.02 0.00 -0.51 0.00 0.00 29.16 29.09 1svm h TRP 581 CO 0.04 0.79 -1.89 1.88 -1.03 0.00 0.00 178.44 178.23 1svm h TYR 582 N -0.16 0.41 -3.68 2.65 -1.99 -1.14 -3.49 116.97 109.57 1svm h TYR 582 Ca 0.00 -0.30 -0.50 0.00 2.00 0.00 0.00 58.73 59.94 1svm h TYR 582 Cb 0.77 -0.02 -0.03 0.00 2.00 0.00 0.00 36.73 39.46 1svm h TYR 582 CO 0.11 1.60 0.19 1.03 -0.00 0.00 0.00 178.16 181.08 1svm s ARG 583 N -2.57 4.36 0.32 4.88 1.81 0.23 -5.04 118.95 122.94 1svm s ARG 583 Ca -0.17 1.02 -0.29 0.00 -1.72 0.00 0.00 55.73 54.57 1svm s ARG 583 Cb 0.07 -2.84 -0.10 0.00 -0.45 0.00 0.00 34.95 31.62 1svm s ARG 583 CO 0.79 0.35 1.29 -2.14 -0.68 0.00 0.00 175.30 174.91 1svm s PRO 584 N -2.02 4.38 0.31 3.54 0.02 -1.26 -4.81 135.00 135.15 1svm s PRO 584 Ca 0.46 2.18 0.07 0.00 0.02 0.00 0.00 61.00 63.72 1svm s PRO 584 Cb -0.17 -3.09 0.78 0.00 0.02 0.00 0.00 34.50 32.04 1svm s PRO 584 CO 0.22 -0.16 1.77 0.28 -0.33 0.00 0.00 177.00 178.78 1svm h VAL 585 N 3.07 0.68 -0.64 3.83 2.07 -1.95 -1.32 116.25 121.99 1svm h VAL 585 Ca -0.49 -0.25 0.18 0.00 0.82 0.00 0.00 66.70 66.97 1svm h VAL 585 Cb 1.22 -0.11 -0.03 0.00 -1.52 0.00 0.00 31.29 30.86 1svm h VAL 585 CO 0.66 0.13 0.49 0.00 0.02 0.00 0.00 177.57 178.87 1svm h ALA 586 N 1.66 2.54 0.00 1.67 0.00 -1.99 -0.50 119.26 122.63 1svm h ALA 586 Ca 0.59 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.47 1svm h ALA 586 Cb 0.96 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.80 1svm h ALA 586 CO -0.39 -0.82 0.00 0.93 0.00 0.00 0.00 179.25 178.98 1svm h GLU 587 N 0.00 0.00 -7.01 0.00 5.08 -1.61 -3.45 114.58 107.59 1svm h GLU 587 Ca 0.30 0.00 -0.49 0.00 -1.00 0.00 0.00 59.36 58.17 1svm h GLU 587 Cb 1.28 0.00 0.04 0.00 0.50 0.00 0.00 28.75 30.57 1svm h GLU 587 CO -0.00 0.00 0.16 -0.06 -1.00 0.00 0.00 179.01 178.11 1svm s PHE 588 N -3.36 3.57 0.44 4.33 0.40 -0.20 -5.02 117.98 118.13 1svm s PHE 588 Ca 0.05 0.89 -0.25 0.00 -0.60 0.00 0.00 56.93 57.01 1svm s PHE 588 Cb 0.09 -2.38 -0.08 0.00 0.51 0.00 0.00 43.02 41.16 1svm s PHE 588 CO 0.51 -0.36 1.36 0.00 0.70 0.00 0.00 175.22 177.43 1svm s ALA 589 N -2.82 3.22 0.27 5.36 0.00 -1.26 -4.82 121.76 121.71 1svm s ALA 589 Ca 0.49 1.34 0.00 0.00 0.00 0.00 0.00 51.96 53.79 1svm s ALA 589 Cb -0.10 -3.54 0.64 0.00 0.00 0.00 0.00 23.12 20.12 1svm s ALA 589 CO 0.46 -1.02 1.68 1.96 0.00 0.00 0.00 175.76 178.84 1svm h GLN 590 N 2.42 0.29 0.00 0.00 1.08 -1.94 -1.80 115.11 115.17 1svm h GLN 590 Ca -0.50 -0.02 0.00 0.00 -1.45 0.00 0.00 58.65 56.68 1svm h GLN 590 Cb 1.26 -0.07 0.00 0.00 -0.05 0.00 0.00 27.48 28.62 1svm h GLN 590 CO 0.61 0.19 0.00 0.66 -0.95 0.00 0.00 178.83 179.35 1svm h SER 591 N 0.30 0.00 0.00 1.46 4.64 -2.02 -3.12 113.55 114.81 1svm h SER 591 Ca 0.51 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.83 1svm h SER 591 Cb 0.96 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.05 1svm h SER 591 CO -0.56 0.00 -1.25 0.00 -0.87 0.00 0.00 176.83 174.15 1svm n ILE 592 N -2.99 0.00 -0.27 0.95 3.06 -0.72 -4.61 119.36 114.78 1svm n ILE 592 Ca -0.00 -0.25 0.08 0.00 -2.50 0.00 0.00 62.75 60.08 1svm n ILE 592 Cb 0.24 0.57 0.22 0.00 0.54 0.00 0.00 39.64 41.22 1svm n ILE 592 CO 0.00 0.00 0.00 1.56 -2.50 0.00 0.00 176.55 175.61 1svm h GLN 593 N 0.00 0.30 -1.00 9.51 4.20 -1.38 0.81 115.11 127.54 1svm h GLN 593 Ca 0.00 -0.02 0.09 0.00 0.06 0.00 0.00 58.65 58.78 1svm h GLN 593 Cb 0.56 -0.07 -0.08 0.00 0.30 0.00 0.00 27.48 28.20 1svm h GLN 593 CO 0.00 0.20 0.63 1.03 -0.67 0.00 0.00 178.83 180.02 1svm h SER 594 N 0.31 0.97 -0.08 1.46 0.87 -1.82 0.30 113.55 115.57 1svm h SER 594 Ca 0.47 0.03 -0.20 0.00 -1.23 0.00 0.00 61.79 60.86 1svm h SER 594 Cb 0.83 -0.17 0.00 0.00 -0.44 0.00 0.00 62.40 62.63 1svm h SER 594 CO -0.53 0.57 -0.69 -0.09 -0.53 0.00 0.00 176.83 175.56 1svm h ARG 595 N 1.07 0.71 -0.34 2.24 2.43 -1.21 -2.82 114.38 116.46 1svm h ARG 595 Ca 0.46 -0.53 -0.05 0.00 -0.81 0.00 0.00 59.98 59.05 1svm h ARG 595 Cb 0.33 0.10 -0.02 0.00 -0.42 0.00 0.00 29.97 29.96 1svm h ARG 595 CO -0.22 1.15 -0.00 0.82 -1.51 0.00 0.00 179.97 180.21 1svm h ILE 596 N 0.51 1.20 -0.53 1.20 1.08 -0.21 -2.19 117.51 118.56 1svm h ILE 596 Ca -0.03 -0.79 -0.05 0.00 -0.39 0.00 0.00 64.86 63.61 1svm h ILE 596 Cb 1.29 0.94 -0.02 0.00 -3.07 0.00 0.00 36.82 35.96 1svm h ILE 596 CO 0.14 0.27 0.14 0.58 -0.69 0.00 0.00 178.15 178.59 1svm h VAL 597 N 0.51 1.24 -0.41 1.67 2.07 -0.88 -0.32 116.25 120.13 1svm h VAL 597 Ca 0.11 -0.83 0.04 0.00 0.82 0.00 0.00 66.70 66.84 1svm h VAL 597 Cb 0.33 0.78 -0.04 0.00 -1.52 0.00 0.00 31.29 30.84 1svm h VAL 597 CO 0.01 0.30 0.18 -0.33 0.02 0.00 0.00 177.57 177.75 1svm h GLU 598 N 0.73 0.36 -0.19 1.57 5.08 -1.16 -1.38 114.58 119.58 1svm h GLU 598 Ca 0.17 -0.02 -0.09 0.00 -1.00 0.00 0.00 59.36 58.41 1svm h GLU 598 Cb 0.31 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.47 1svm h GLU 598 CO -0.00 0.24 -0.29 -1.49 -1.00 0.00 0.00 179.01 176.46 1svm h TRP 599 N 0.37 0.42 -0.37 4.33 4.06 -1.14 -1.38 115.95 122.24 1svm h TRP 599 Ca 0.18 -0.09 -0.06 0.00 2.06 0.00 0.00 58.89 60.98 1svm h TRP 599 Cb 0.13 -0.10 -0.02 0.00 -1.00 0.00 0.00 29.16 28.17 1svm h TRP 599 CO -0.12 0.64 -0.03 0.87 -3.56 0.00 0.00 178.44 176.23 1svm h LYS 600 N 0.33 0.59 -0.20 0.49 1.57 -0.46 -0.29 116.57 118.60 1svm h LYS 600 Ca 0.05 -0.15 -0.19 0.00 -1.87 0.00 0.00 60.65 58.49 1svm h LYS 600 Cb 0.69 -0.08 0.00 0.00 0.08 0.00 0.00 32.23 32.92 1svm h LYS 600 CO 0.05 0.64 -0.63 0.93 -0.57 0.00 0.00 179.45 179.87 1svm h GLU 601 N 0.56 0.71 -0.36 3.15 5.08 -0.79 -1.75 114.58 121.17 1svm h GLU 601 Ca 0.11 -0.50 -0.03 0.00 -1.00 0.00 0.00 59.36 57.95 1svm h GLU 601 Cb 0.40 0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.71 1svm h GLU 601 CO 0.02 1.12 0.12 -0.09 -1.00 0.00 0.00 179.01 179.18 1svm h ARG 602 N 0.53 0.55 -0.58 2.33 9.65 -0.85 -0.76 114.38 125.25 1svm h ARG 602 Ca -0.01 -0.11 -0.09 0.00 -1.10 0.00 0.00 59.98 58.67 1svm h ARG 602 Cb 1.22 -0.08 -0.02 0.00 -1.39 0.00 0.00 29.97 29.70 1svm h ARG 602 CO 0.13 0.56 0.01 -0.07 2.80 0.00 0.00 179.97 183.40 1svm h LEU 603 N 0.43 0.99 -1.26 3.80 4.07 -1.03 -2.10 115.31 120.22 1svm h LEU 603 Ca 0.12 -0.30 -0.07 0.00 0.08 0.00 0.00 57.88 57.70 1svm h LEU 603 Cb 0.23 -0.27 -0.01 0.00 1.08 0.00 0.00 40.66 41.70 1svm h LEU 603 CO -0.01 1.05 -0.30 0.44 -1.08 0.00 0.00 178.44 178.55 1svm h ASP 604 N 0.90 0.12 0.47 -0.43 3.45 -1.19 0.29 116.42 120.04 1svm h ASP 604 Ca 0.17 -0.04 -0.14 0.00 0.43 0.00 0.00 57.03 57.45 1svm h ASP 604 Cb 0.54 -0.03 -0.01 0.00 -0.56 0.00 0.00 39.33 39.26 1svm h ASP 604 CO 0.03 0.42 -0.61 0.50 -1.57 0.00 0.00 179.24 178.01 1svm h LYS 605 N 0.11 0.13 0.00 3.56 1.63 -0.77 -3.29 116.57 117.94 1svm h LYS 605 Ca 0.02 -0.09 -0.18 0.00 -0.85 0.00 0.00 60.65 59.54 1svm h LYS 605 Cb 0.58 0.01 -0.03 0.00 -0.60 0.00 0.00 32.23 32.20 1svm h LYS 605 CO 0.04 0.70 -1.83 0.39 -3.45 0.00 0.00 179.45 175.30 1svm n GLU 606 N -3.85 0.65 -3.77 1.90 1.02 -0.82 -4.89 120.64 110.88 1svm n GLU 606 Ca -0.02 0.05 -0.26 0.00 -0.02 0.00 0.00 57.16 56.92 1svm n GLU 606 Cb 0.61 -1.66 -0.17 0.00 -0.02 0.00 0.00 31.44 30.21 1svm n GLU 606 CO 0.00 0.00 0.00 -0.06 1.18 0.00 0.00 177.13 178.25 1svm s PHE 607 N -2.95 0.97 0.78 -0.32 0.40 0.97 -5.06 117.98 112.77 1svm s PHE 607 Ca -0.06 -0.60 -0.11 0.00 -0.60 0.00 0.00 56.93 55.55 1svm s PHE 607 Cb 0.09 -0.98 0.06 0.00 0.51 0.00 0.00 43.02 42.70 1svm s PHE 607 CO 0.84 -0.50 1.09 -1.54 0.70 0.00 0.00 175.22 175.82 1svm s SER 608 N 1.87 4.69 0.17 1.36 1.04 -1.26 -4.41 113.70 117.16 1svm s SER 608 Ca 0.02 1.30 -0.15 0.00 0.48 0.00 0.00 55.95 57.61 1svm s SER 608 Cb -0.15 -2.06 0.10 0.00 0.10 0.00 0.00 66.02 64.02 1svm s SER 608 CO -0.07 -1.84 1.77 0.25 0.98 0.00 0.00 173.24 174.33 1svm h LEU 609 N -1.00 0.24 -1.00 2.42 5.85 -1.97 -2.20 115.31 117.64 1svm h LEU 609 Ca -0.46 0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.29 1svm h LEU 609 Cb 1.26 -0.00 -0.05 0.00 0.37 0.00 0.00 40.66 42.24 1svm h LEU 609 CO 0.60 0.18 0.61 0.77 -0.34 0.00 0.00 178.44 180.25 1svm h SER 610 N 0.38 1.13 -0.73 1.25 4.64 -1.98 0.23 113.55 118.48 1svm h SER 610 Ca 0.19 -0.05 -0.05 0.00 -0.47 0.00 0.00 61.79 61.41 1svm h SER 610 Cb 0.14 -0.28 -0.03 0.00 -0.31 0.00 0.00 62.40 61.92 1svm h SER 610 CO -0.17 0.84 0.26 0.58 -0.87 0.00 0.00 176.83 177.48 1svm h VAL 611 N 1.32 1.26 -0.10 0.95 2.07 -1.82 0.11 116.25 120.02 1svm h VAL 611 Ca 0.35 -0.85 -0.11 0.00 0.82 0.00 0.00 66.70 66.91 1svm h VAL 611 Cb -0.10 0.41 0.00 0.00 -1.52 0.00 0.00 31.29 30.08 1svm h VAL 611 CO -0.07 0.34 -0.35 0.22 0.02 0.00 0.00 177.57 177.73 1svm h TYR 612 N 1.08 0.55 -0.34 1.57 3.20 -0.90 -3.08 116.97 119.06 1svm h TYR 612 Ca 0.24 -0.23 0.06 0.00 3.14 0.00 0.00 58.73 61.95 1svm h TYR 612 Cb 0.26 -0.09 -0.02 0.00 1.54 0.00 0.00 36.73 38.42 1svm h TYR 612 CO 0.02 0.96 0.24 1.96 -1.64 0.00 0.00 178.16 179.70 1svm h GLN 613 N -0.01 0.19 -0.10 1.82 4.20 -0.31 0.45 115.11 121.35 1svm h GLN 613 Ca -0.01 -0.01 -0.05 0.00 0.06 0.00 0.00 58.65 58.63 1svm h GLN 613 Cb 0.98 -0.04 -0.01 0.00 0.30 0.00 0.00 27.48 28.71 1svm h GLN 613 CO 0.07 0.13 -0.16 -0.22 -0.67 0.00 0.00 178.83 177.98 1svm h LYS 614 N 0.20 0.16 -0.23 1.46 1.63 -0.70 -0.27 116.57 118.83 1svm h LYS 614 Ca 0.15 -0.04 -0.10 0.00 -0.85 0.00 0.00 60.65 59.82 1svm h LYS 614 Cb 0.36 -0.02 -0.00 0.00 -0.60 0.00 0.00 32.23 31.96 1svm h LYS 614 CO -0.03 0.33 -0.23 0.52 -3.45 0.00 0.00 179.45 176.59 1svm h MET 615 N 0.15 0.56 -0.38 1.90 2.86 -0.88 -1.74 114.93 117.41 1svm h MET 615 Ca 0.03 -0.30 -0.04 0.00 -2.06 0.00 0.00 59.70 57.33 1svm h MET 615 Cb 0.38 0.01 -0.02 0.00 0.06 0.00 0.00 31.60 32.04 1svm h MET 615 CO 0.02 0.89 0.06 0.87 1.06 0.00 0.00 176.91 179.82 1svm h LYS 616 N 0.26 0.57 0.04 1.72 1.79 -1.24 -1.33 116.57 118.38 1svm h LYS 616 Ca 0.04 -0.10 -0.00 0.00 -2.18 0.00 0.00 60.65 58.40 1svm h LYS 616 Cb 0.79 -0.09 0.00 0.00 -1.58 0.00 0.00 32.23 31.35 1svm h LYS 616 CO 0.06 0.54 -0.02 0.35 -1.08 0.00 0.00 179.45 179.30 1svm h PHE 617 N 0.55 -0.05 -0.98 -1.35 3.57 -0.89 -0.97 116.94 116.83 1svm h PHE 617 Ca 0.13 -0.00 0.04 0.00 3.53 0.00 0.00 57.97 61.66 1svm h PHE 617 Cb 0.26 0.02 -0.06 0.00 2.79 0.00 0.00 35.95 38.95 1svm h PHE 617 CO 0.01 0.10 0.64 -0.91 -2.23 0.00 0.00 178.31 175.92 1svm h ASN 618 N -0.18 1.06 0.27 0.41 2.35 -0.90 -0.50 115.58 118.09 1svm h ASN 618 Ca -0.01 -0.01 -0.01 0.00 -0.55 0.00 0.00 56.30 55.72 1svm h ASN 618 Cb 0.17 -0.24 0.00 0.00 0.05 0.00 0.00 38.32 38.30 1svm h ASN 618 CO 0.01 0.72 -0.13 0.58 -1.65 0.00 0.00 177.43 176.96 1svm h VAL 619 N 1.23 0.77 -0.57 2.81 2.07 -1.02 -0.02 116.25 121.52 1svm h VAL 619 Ca 0.40 -0.22 0.09 0.00 0.82 0.00 0.00 66.70 67.78 1svm h VAL 619 Cb 0.02 0.89 -0.03 0.00 -1.52 0.00 0.00 31.29 30.65 1svm h VAL 619 CO -0.13 0.05 0.38 0.00 0.02 0.00 0.00 177.57 177.89 1svm h ALA 620 N 0.23 1.98 -0.00 1.67 0.00 -0.78 0.43 119.26 122.78 1svm h ALA 620 Ca -0.04 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1svm h ALA 620 Cb 0.35 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.05 1svm h ALA 620 CO 0.06 -0.09 -0.12 -1.33 0.00 0.00 0.00 179.25 177.76 1svm n MET 621 N -4.47 0.80 -2.08 0.00 2.00 -0.23 -4.88 117.12 108.26 1svm n MET 621 Ca 0.09 -0.32 -0.06 0.00 0.00 0.00 0.00 57.70 57.40 1svm n MET 621 Cb 0.33 -1.49 -0.00 0.00 0.00 0.00 0.00 33.22 32.05 1svm n MET 621 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1svm n GLY 622 N 1.27 0.14 3.76 3.03 0.00 0.14 -5.00 105.19 108.54 1svm n GLY 622 Ca 0.15 -0.63 -0.33 0.00 0.00 0.00 0.00 46.02 45.21 1svm n GLY 622 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1svm s ILE 623 N -2.31 1.22 -0.10 -0.61 -4.36 -0.13 -3.50 121.20 111.41 1svm s ILE 623 Ca 0.00 -1.98 -0.36 0.00 -0.26 0.00 0.00 60.65 58.05 1svm s ILE 623 Cb 0.00 -2.20 -0.13 0.00 1.25 0.00 0.00 42.46 41.38 1svm s ILE 623 CO 0.00 0.00 1.79 0.61 0.24 0.00 0.00 174.94 177.58 1svm n GLY 624 N -1.27 1.23 0.43 6.27 0.00 -1.26 -4.37 105.19 106.22 1svm n GLY 624 Ca -0.18 0.85 0.24 0.00 0.00 0.00 0.00 46.02 46.93 1svm n GLY 624 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 1svm h VAL 625 N 5.11 0.60 -0.69 1.61 -1.51 -1.81 -0.69 116.25 118.87 1svm h VAL 625 Ca -0.48 -0.08 -0.18 0.00 -1.23 0.00 0.00 66.70 64.73 1svm h VAL 625 Cb 1.28 0.35 -0.11 0.00 -2.13 0.00 0.00 31.29 30.68 1svm h VAL 625 CO 0.94 0.04 0.23 0.18 -1.23 0.00 0.00 177.57 177.73 1svm n LEU 626 N -4.42 5.90 0.00 4.19 4.77 -1.26 -4.48 117.00 121.69 1svm n LEU 626 Ca 0.20 -3.06 0.15 0.00 -0.03 0.00 0.00 56.01 53.27 1svm n LEU 626 Cb 0.84 -0.73 0.89 0.00 -2.33 0.00 0.00 43.42 42.09 1svm n LEU 626 CO 0.33 0.76 1.06 0.47 -1.33 0.00 0.00 177.39 178.68