#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 3.19 0.39 1.97 2.00 -1.26 -5.07 119.66 120.88 1svm s GLN 267 Ca 0.00 -0.65 -0.27 0.00 -2.00 0.00 0.00 55.36 52.44 1svm s GLN 267 Cb 0.00 -2.61 -0.09 0.00 0.80 0.00 0.00 33.01 31.11 1svm s GLN 267 CO 0.00 0.34 1.31 0.14 -0.50 0.00 0.00 175.29 176.58 1svm s VAL 268 N 0.03 2.61 -0.49 1.34 -7.23 -1.26 -4.97 120.40 110.43 1svm s VAL 268 Ca -0.04 0.57 -0.19 0.00 -1.81 0.00 0.00 61.98 60.51 1svm s VAL 268 Cb -0.14 -3.34 0.05 0.00 0.56 0.00 0.00 36.38 33.51 1svm s VAL 268 CO 0.04 0.10 0.60 -0.55 -0.31 0.00 0.00 175.10 174.98 1svm s SER 269 N -0.65 6.22 0.27 4.85 0.15 -1.26 -4.91 113.70 118.37 1svm s SER 269 Ca 0.55 -0.89 -0.03 0.00 0.70 0.00 0.00 55.95 56.28 1svm s SER 269 Cb -0.39 -2.28 0.35 0.00 -1.71 0.00 0.00 66.02 61.99 1svm s SER 269 CO 0.51 -0.85 1.83 -0.50 1.20 0.00 0.00 173.24 175.42 1svm h TRP 270 N 8.96 0.95 -0.67 3.44 4.06 -1.97 -2.69 115.95 128.02 1svm h TRP 270 Ca -0.27 -0.08 0.04 0.00 2.06 0.00 0.00 58.89 60.64 1svm h TRP 270 Cb 1.10 -0.28 -0.04 0.00 -1.00 0.00 0.00 29.16 28.94 1svm h TRP 270 CO 0.73 0.76 0.44 -0.22 -3.56 0.00 0.00 178.44 176.59 1svm h LYS 271 N 0.90 0.76 -0.26 0.49 3.64 -1.98 -1.61 116.57 118.52 1svm h LYS 271 Ca 0.20 -0.05 -0.13 0.00 -1.27 0.00 0.00 60.65 59.41 1svm h LYS 271 Cb 0.25 -0.17 -0.01 0.00 -0.41 0.00 0.00 32.23 31.89 1svm h LYS 271 CO -0.01 0.50 -0.38 -0.07 -2.27 0.00 0.00 179.45 177.23 1svm h LEU 272 N 0.79 0.61 -0.25 5.20 3.38 -1.90 0.73 115.31 123.87 1svm h LEU 272 Ca 0.27 -0.26 -0.04 0.00 0.09 0.00 0.00 57.88 57.94 1svm h LEU 272 Cb 0.09 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.66 1svm h LEU 272 CO -0.08 0.93 -0.00 0.58 0.09 0.00 0.00 178.44 179.96 1svm h VAL 273 N 0.48 1.26 -0.57 1.22 2.07 -1.33 -1.57 116.25 117.82 1svm h VAL 273 Ca 0.05 -0.91 0.05 0.00 0.82 0.00 0.00 66.70 66.70 1svm h VAL 273 Cb 0.87 1.37 -0.05 0.00 -1.52 0.00 0.00 31.29 31.97 1svm h VAL 273 CO 0.07 0.29 0.30 0.74 0.02 0.00 0.00 177.57 178.99 1svm h THR 274 N 0.21 0.96 -0.47 2.57 2.02 -1.12 -0.17 112.91 116.90 1svm h THR 274 Ca 0.07 -0.19 0.07 0.00 0.77 0.00 0.00 66.41 67.12 1svm h THR 274 Cb 0.42 0.34 -0.06 0.00 -1.74 0.00 0.00 68.15 67.11 1svm h THR 274 CO 0.01 0.10 0.15 -0.08 0.37 0.00 0.00 175.52 176.08 1svm h GLU 275 N 0.57 0.31 -0.49 6.66 4.81 -0.57 0.22 114.58 126.09 1svm h GLU 275 Ca 0.25 -0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 59.46 1svm h GLU 275 Cb 0.15 -0.07 -0.02 0.00 0.63 0.00 0.00 28.75 29.44 1svm h GLU 275 CO -0.17 0.20 0.28 -0.92 -0.73 0.00 0.00 179.01 177.67 1svm h TYR 276 N 0.32 0.66 -0.65 0.92 3.20 -0.49 0.63 116.97 121.57 1svm h TYR 276 Ca 0.23 -0.01 0.01 0.00 3.14 0.00 0.00 58.73 62.10 1svm h TYR 276 Cb 0.25 -0.21 -0.03 0.00 1.54 0.00 0.00 36.73 38.27 1svm h TYR 276 CO -0.17 0.48 0.42 0.00 -1.64 0.00 0.00 178.16 177.26 1svm h ALA 277 N 1.12 0.83 -0.47 1.82 0.00 -0.14 -1.58 119.26 120.83 1svm h ALA 277 Ca 0.17 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 55.01 1svm h ALA 277 Cb 0.03 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.56 1svm h ALA 277 CO -0.03 0.23 0.15 0.52 0.00 0.00 0.00 179.25 180.12 1svm h MET 278 N 0.85 0.73 -0.35 0.00 2.86 -0.21 0.30 114.93 119.11 1svm h MET 278 Ca 0.24 -0.16 -0.01 0.00 -2.06 0.00 0.00 59.70 57.71 1svm h MET 278 Cb -0.07 -0.11 -0.02 0.00 0.06 0.00 0.00 31.60 31.47 1svm h MET 278 CO -0.07 0.69 0.15 0.93 1.06 0.00 0.00 176.91 179.68 1svm h GLU 279 N 0.63 0.49 -0.26 1.72 4.39 -0.46 -2.32 114.58 118.77 1svm h GLU 279 Ca 0.15 -0.05 0.00 0.00 0.34 0.00 0.00 59.36 59.80 1svm h GLU 279 Cb 0.26 -0.10 0.00 0.00 -0.10 0.00 0.00 28.75 28.82 1svm h GLU 279 CO -0.01 0.40 0.00 0.25 -1.16 0.00 0.00 179.01 178.49 1svm n THR 280 N -4.41 0.41 -4.02 1.13 -2.24 -0.63 -4.97 114.28 99.55 1svm n THR 280 Ca 0.02 -0.70 -0.29 0.00 -2.27 0.00 0.00 64.05 60.80 1svm n THR 280 Cb 0.13 1.03 -0.01 0.00 -2.10 0.00 0.00 70.33 69.38 1svm n THR 280 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1svm n LYS 281 N 1.14 -3.75 -2.97 -0.78 5.02 0.82 -4.90 118.16 112.74 1svm n LYS 281 Ca 0.15 0.44 -0.43 0.00 -2.02 0.00 0.00 58.31 56.45 1svm n LYS 281 Cb 0.51 -4.92 -0.05 0.00 -0.02 0.00 0.00 35.03 30.54 1svm n LYS 281 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1svm n ASP 283 N 6.57 2.67 -4.12 0.00 5.68 -1.26 -4.63 116.55 121.45 1svm n ASP 283 Ca 0.02 -3.62 -0.33 0.00 -0.50 0.00 0.00 54.79 50.35 1svm n ASP 283 Cb 0.48 -0.61 -0.15 0.00 -1.14 0.00 0.00 41.12 39.71 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 -2.48 4.47 0.21 -1.12 -1.08 -1.26 -5.02 116.67 110.39 1svm s ASP 284 Ca 0.43 -1.23 -0.09 0.00 -0.52 0.00 0.00 52.55 51.14 1svm s ASP 284 Cb 0.39 -1.61 0.21 0.00 -1.46 0.00 0.00 42.92 40.45 1svm s ASP 284 CO 0.01 -0.19 1.84 0.58 0.52 0.00 0.00 175.17 177.93 1svm h VAL 285 N 6.52 1.07 -0.46 1.11 2.07 -1.90 -0.58 116.25 124.07 1svm h VAL 285 Ca -0.24 -0.29 -0.13 0.00 0.82 0.00 0.00 66.70 66.87 1svm h VAL 285 Cb 1.06 0.16 -0.01 0.00 -1.52 0.00 0.00 31.29 30.98 1svm h VAL 285 CO 0.51 0.15 -0.21 -0.07 0.02 0.00 0.00 177.57 177.97 1svm h LEU 286 N 0.84 0.95 -0.40 2.57 3.38 -1.97 -1.16 115.31 119.52 1svm h LEU 286 Ca 0.29 -0.35 -0.02 0.00 0.09 0.00 0.00 57.88 57.89 1svm h LEU 286 Cb 0.07 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.54 1svm h LEU 286 CO -0.13 1.13 0.17 0.25 0.09 0.00 0.00 178.44 179.95 1svm h LEU 287 N 0.81 0.54 -0.24 1.67 5.85 -1.90 -0.27 115.31 121.77 1svm h LEU 287 Ca 0.11 -0.15 0.01 0.00 0.84 0.00 0.00 57.88 58.69 1svm h LEU 287 Cb 0.77 -0.14 -0.02 0.00 0.37 0.00 0.00 40.66 41.65 1svm h LEU 287 CO 0.06 0.54 0.13 0.25 -0.34 0.00 0.00 178.44 179.09 1svm h LEU 288 N 0.50 0.21 -0.40 2.25 5.85 -0.95 0.55 115.31 123.32 1svm h LEU 288 Ca 0.14 0.00 0.03 0.00 0.84 0.00 0.00 57.88 58.89 1svm h LEU 288 Cb 0.16 -0.04 -0.03 0.00 0.37 0.00 0.00 40.66 41.12 1svm h LEU 288 CO -0.01 0.16 0.19 0.25 -0.34 0.00 0.00 178.44 178.69 1svm h LEU 289 N 0.28 0.28 -0.51 2.25 5.85 -0.99 -0.46 115.31 121.99 1svm h LEU 289 Ca 0.09 0.02 -0.05 0.00 0.84 0.00 0.00 57.88 58.78 1svm h LEU 289 Cb 0.00 -0.03 -0.02 0.00 0.37 0.00 0.00 40.66 40.98 1svm h LEU 289 CO -0.05 0.20 0.12 1.23 -0.34 0.00 0.00 178.44 179.60 1svm h GLY 290 N 0.40 0.89 0.87 3.75 0.00 -0.73 -2.21 103.07 106.04 1svm h GLY 290 Ca 0.17 -0.56 -0.03 0.00 0.00 0.00 0.00 47.33 46.91 1svm h GLY 290 CO -0.12 0.53 0.05 -0.33 0.00 0.00 0.00 176.54 176.66 1svm h MET 291 N 0.72 0.42 -0.36 4.80 2.86 -0.60 -3.06 114.93 119.70 1svm h MET 291 Ca 0.16 -0.11 -0.07 0.00 -2.06 0.00 0.00 59.70 57.63 1svm h MET 291 Cb 0.34 -0.05 -0.02 0.00 0.06 0.00 0.00 31.60 31.93 1svm h MET 291 CO 0.00 0.53 -0.06 -0.92 1.06 0.00 0.00 176.91 177.52 1svm h TYR 292 N 0.24 0.63 0.00 -0.22 3.20 -1.05 -2.36 116.97 117.41 1svm h TYR 292 Ca 0.08 -0.09 -0.03 0.00 3.14 0.00 0.00 58.73 61.83 1svm h TYR 292 Cb 0.30 -0.17 -0.00 0.00 1.54 0.00 0.00 36.73 38.40 1svm h TYR 292 CO 0.02 0.65 -0.13 -0.07 -1.64 0.00 0.00 178.16 176.98 1svm h LEU 293 N 0.56 0.00 -1.64 2.82 3.38 -1.35 -1.41 115.31 117.67 1svm h LEU 293 Ca 0.11 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.08 1svm h LEU 293 Cb 0.45 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.20 1svm h LEU 293 CO 0.02 0.13 -0.00 -0.33 0.09 0.00 0.00 178.44 178.35 1svm h GLU 294 N 0.00 0.00 -0.00 1.13 5.08 -1.32 -2.71 114.58 116.76 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 0.38 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.63 1svm h GLU 294 CO 0.02 0.00 -0.15 1.19 -1.00 0.00 0.00 179.01 179.07 1svm n PHE 295 N -3.09 0.00 0.27 4.33 3.72 -0.53 -3.86 117.46 118.29 1svm n PHE 295 Ca 0.00 0.00 0.14 0.00 -0.05 0.00 0.00 57.45 57.55 1svm n PHE 295 Cb 0.28 -0.39 0.73 0.00 -0.94 0.00 0.00 39.48 39.16 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 0.06 0.00 -6.70 -1.08 3.07 -1.58 -3.39 115.11 105.49 1svm h GLN 296 Ca 0.00 0.00 -0.50 0.00 0.09 0.00 0.00 58.65 58.24 1svm h GLN 296 Cb 0.47 0.00 -0.01 0.00 0.08 0.00 0.00 27.48 28.02 1svm h GLN 296 CO 0.00 0.10 0.04 0.71 0.09 0.00 0.00 178.83 179.77 1svm s TYR 297 N -3.97 3.44 -0.08 0.06 2.02 -1.25 -4.49 117.35 113.09 1svm s TYR 297 Ca -0.02 1.00 -0.41 0.00 -0.37 0.00 0.00 57.07 57.28 1svm s TYR 297 Cb 0.12 -2.38 -0.19 0.00 -0.40 0.00 0.00 41.96 39.10 1svm s TYR 297 CO 0.56 0.05 1.23 0.45 -1.57 0.00 0.00 175.55 176.27 1svm n SER 298 N -0.83 0.56 0.14 2.29 2.88 -1.26 -4.85 113.62 112.55 1svm n SER 298 Ca 0.02 1.15 0.07 0.00 -1.33 0.00 0.00 58.87 58.78 1svm n SER 298 Cb 0.53 -0.97 0.05 0.00 -0.75 0.00 0.00 64.21 63.07 1svm n SER 298 CO 0.00 0.00 0.00 2.19 -1.23 0.00 0.00 175.04 176.00 1svm h PHE 299 N 3.75 0.00 -0.57 0.66 -5.15 -1.92 -3.19 116.94 110.52 1svm h PHE 299 Ca -0.49 0.00 -0.06 0.00 -0.20 0.00 0.00 57.97 57.21 1svm h PHE 299 Cb 1.40 0.00 -0.02 0.00 0.22 0.00 0.00 35.95 37.55 1svm h PHE 299 CO 0.60 0.24 0.10 0.93 -2.00 0.00 0.00 178.31 178.18 1svm h GLU 300 N 0.00 0.92 -0.75 6.09 4.39 -2.00 -3.01 114.58 120.21 1svm h GLU 300 Ca -0.03 -0.22 -0.49 0.00 0.34 0.00 0.00 59.36 58.96 1svm h GLU 300 Cb 1.21 -0.12 -0.29 0.00 -0.10 0.00 0.00 28.75 29.45 1svm h GLU 300 CO 0.03 0.85 0.05 -1.33 -1.16 0.00 0.00 179.01 177.45 1svm n MET 301 N -4.24 2.72 -3.54 2.33 2.81 -1.23 -4.99 117.12 110.98 1svm n MET 301 Ca 0.04 -3.53 -0.40 0.00 -1.81 0.00 0.00 57.70 52.00 1svm n MET 301 Cb 0.26 -2.15 -0.11 0.00 -0.71 0.00 0.00 33.22 30.52 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 8.46 0.00 -1.11 0.00 3.38 -1.92 -2.07 115.31 122.05 1svm h LEU 303 Ca -0.32 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.60 1svm h LEU 303 Cb 1.17 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.90 1svm h LEU 303 CO 0.61 0.53 0.07 0.11 0.09 0.00 0.00 178.44 179.85 1svm h LYS 304 N 0.00 0.70 0.01 1.13 1.57 -1.97 0.12 116.57 118.13 1svm h LYS 304 Ca -0.01 -0.14 -0.14 0.00 -1.87 0.00 0.00 60.65 58.49 1svm h LYS 304 Cb 1.06 -0.10 0.01 0.00 0.08 0.00 0.00 32.23 33.27 1svm h LYS 304 CO 0.07 0.66 -0.54 0.00 -0.57 0.00 0.00 179.45 179.07 1svm h ILE 306 N -0.23 1.25 -0.00 0.00 2.04 -1.19 -1.96 117.51 117.41 1svm h ILE 306 Ca -0.07 -0.73 0.00 0.00 1.00 0.00 0.00 64.86 65.06 1svm h ILE 306 Cb 1.28 0.23 0.00 0.00 -0.74 0.00 0.00 36.82 37.59 1svm h ILE 306 CO 0.11 0.31 -0.01 0.29 0.00 0.00 0.00 178.15 178.84 1svm n LYS 307 N -4.33 1.05 -4.07 2.37 4.76 0.38 -4.93 118.16 113.39 1svm n LYS 307 Ca 0.08 -0.22 -0.37 0.00 -2.87 0.00 0.00 58.31 54.93 1svm n LYS 307 Cb 0.14 -1.50 -0.02 0.00 -1.84 0.00 0.00 35.03 31.82 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 -0.78 -1.08 0.08 1.97 4.76 -0.74 -4.89 118.16 117.48 1svm n LYS 308 Ca 0.21 0.19 -0.22 0.00 -2.87 0.00 0.00 58.31 55.62 1svm n LYS 308 Cb 0.19 -3.39 -0.14 0.00 -1.84 0.00 0.00 35.03 29.85 1svm n LYS 308 CO 0.00 0.00 0.00 0.93 -1.37 0.00 0.00 177.40 176.96 1svm h GLU 309 N -2.16 0.47 -3.62 1.97 5.08 -1.80 -3.45 114.58 111.06 1svm h GLU 309 Ca -0.68 -0.70 -0.44 0.00 -1.00 0.00 0.00 59.36 56.55 1svm h GLU 309 Cb 1.39 0.24 -0.38 0.00 0.50 0.00 0.00 28.75 30.50 1svm h GLU 309 CO 0.59 1.31 -0.76 -0.65 -1.00 0.00 0.00 179.01 178.50 1svm s GLN 310 N -2.74 0.51 0.27 2.33 -1.52 -1.26 -5.02 119.66 112.23 1svm s GLN 310 Ca -0.11 0.09 -0.01 0.00 -1.95 0.00 0.00 55.36 53.38 1svm s GLN 310 Cb 0.03 -1.03 0.47 0.00 -0.22 0.00 0.00 33.01 32.26 1svm s GLN 310 CO 0.89 -0.34 1.86 -1.35 -0.25 0.00 0.00 175.29 176.09 1svm h PRO 311 N 8.34 1.05 0.00 2.91 0.11 -1.97 0.21 132.00 142.64 1svm h PRO 311 Ca -0.18 -0.06 0.00 0.00 0.11 0.00 0.00 66.00 65.86 1svm h PRO 311 Cb 1.12 -0.24 0.00 0.00 0.11 0.00 0.00 31.00 32.00 1svm h PRO 311 CO 0.25 0.69 0.00 -1.13 -0.21 0.00 0.00 178.00 177.61 1svm n SER 312 N -4.56 0.17 -0.02 -2.05 3.41 -1.26 -2.09 113.62 107.22 1svm n SER 312 Ca 0.17 0.57 -0.04 0.00 -0.26 0.00 0.00 58.87 59.31 1svm n SER 312 Cb 0.27 -0.60 -0.01 0.00 -0.26 0.00 0.00 64.21 63.61 1svm n SER 312 CO 0.00 0.00 0.00 1.57 -0.16 0.00 0.00 175.04 176.45 1svm n HIS 313 N -1.72 0.00 0.26 7.33 -0.00 0.54 -4.67 115.22 116.97 1svm n HIS 313 Ca 0.00 0.00 0.12 0.00 -0.00 0.00 0.00 57.72 57.85 1svm n HIS 313 Cb 0.05 -0.22 0.72 0.00 -0.00 0.00 0.00 29.99 30.55 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 -0.44 0.00 0.00 1.57 -0.00 -1.06 0.00 116.97 117.05 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 0.44 0.00 0.00 0.00 0.00 0.00 0.00 36.73 37.17 1svm h TYR 314 CO -0.19 0.11 0.00 1.63 -0.00 0.00 0.00 178.16 179.71 1svm n LYS 315 N -3.70 0.45 0.00 0.10 5.02 -0.89 -4.16 118.16 114.99 1svm n LYS 315 Ca -0.02 0.01 0.00 0.00 -2.02 0.00 0.00 58.31 56.28 1svm n LYS 315 Cb 0.23 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 33.74 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 -1.27 0.00 -0.25 2.13 4.02 -0.64 -4.90 117.16 116.25 1svm n TYR 316 Ca 0.15 0.00 -0.06 0.00 -0.01 0.00 0.00 57.90 57.98 1svm n TYR 316 Cb 0.23 0.00 -0.00 0.00 -0.02 0.00 0.00 39.34 39.55 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 -1.11 -0.28 -0.72 2.76 -1.19 -2.15 115.15 112.45 1svm h HIS 317 Ca 0.00 0.08 0.03 0.00 -2.20 0.00 0.00 60.37 58.29 1svm h HIS 317 Cb 0.02 0.58 -0.03 0.00 1.55 0.00 0.00 27.41 29.53 1svm h HIS 317 CO 0.00 -0.40 0.08 1.49 -1.30 0.00 0.00 177.93 177.80 1svm h GLU 318 N -0.15 0.19 -0.17 5.26 4.81 -1.87 0.11 114.58 122.75 1svm h GLU 318 Ca 0.23 -0.01 -0.05 0.00 -0.13 0.00 0.00 59.36 59.40 1svm h GLU 318 Cb 0.56 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.89 1svm h GLU 318 CO -0.75 0.12 -0.14 -0.22 -0.73 0.00 0.00 179.01 177.30 1svm h LYS 319 N 0.19 0.28 -0.02 1.92 3.64 -1.83 -3.08 116.57 117.66 1svm h LYS 319 Ca 0.13 -0.07 0.00 0.00 -1.27 0.00 0.00 60.65 59.44 1svm h LYS 319 Cb 0.11 -0.04 0.00 0.00 -0.41 0.00 0.00 32.23 31.90 1svm h LYS 319 CO -0.15 0.42 -0.16 0.72 -2.27 0.00 0.00 179.45 178.02 1svm n HIS 320 N -4.25 0.00 -0.04 1.91 8.25 -0.84 -4.61 115.22 115.64 1svm n HIS 320 Ca -0.00 0.00 -0.11 0.00 -0.26 0.00 0.00 57.72 57.34 1svm n HIS 320 Cb 0.28 -0.01 -0.05 0.00 1.12 0.00 0.00 29.99 31.33 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 3.67 -1.18 -0.44 4.41 3.20 -0.70 0.58 116.97 126.51 1svm h TYR 321 Ca 0.00 0.05 0.02 0.00 3.14 0.00 0.00 58.73 61.94 1svm h TYR 321 Cb 0.86 0.55 -0.03 0.00 1.54 0.00 0.00 36.73 39.65 1svm h TYR 321 CO 0.00 -0.46 0.25 0.00 -1.64 0.00 0.00 178.16 176.32 1svm h ALA 322 N 0.24 0.55 -0.21 1.82 0.00 -1.81 -1.02 119.26 118.83 1svm h ALA 322 Ca 0.10 -0.01 -0.10 0.00 0.00 0.00 0.00 54.91 54.90 1svm h ALA 322 Cb 0.61 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.26 1svm h ALA 322 CO -0.44 -0.07 -0.29 -0.97 0.00 0.00 0.00 179.25 177.47 1svm h ASN 323 N 0.51 0.41 -0.42 0.00 -1.24 -1.81 -2.95 115.58 110.09 1svm h ASN 323 Ca 0.18 -0.15 -0.14 0.00 0.71 0.00 0.00 56.30 56.90 1svm h ASN 323 Cb 0.02 -0.11 -0.01 0.00 0.73 0.00 0.00 38.32 38.94 1svm h ASN 323 CO -0.09 0.70 -0.27 0.00 -1.29 0.00 0.00 177.43 176.49 1svm h ALA 324 N 1.33 0.69 -0.69 1.57 0.00 -0.46 0.46 119.26 122.16 1svm h ALA 324 Ca 0.05 -0.41 0.05 0.00 0.00 0.00 0.00 54.91 54.60 1svm h ALA 324 Cb 0.70 -0.15 -0.05 0.00 0.00 0.00 0.00 17.79 18.29 1svm h ALA 324 CO 0.05 0.67 0.40 0.00 0.00 0.00 0.00 179.25 180.37 1svm h ALA 325 N 0.88 0.92 -0.28 0.00 0.00 -1.04 0.98 119.26 120.73 1svm h ALA 325 Ca 0.09 0.01 -0.12 0.00 0.00 0.00 0.00 54.91 54.89 1svm h ALA 325 Cb 0.84 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.48 1svm h ALA 325 CO 0.07 0.10 -0.29 0.82 0.00 0.00 0.00 179.25 179.95 1svm h ILE 326 N 0.74 1.30 -0.94 0.00 2.04 -1.37 -3.01 117.51 116.27 1svm h ILE 326 Ca 0.30 -1.46 0.14 0.00 1.00 0.00 0.00 64.86 64.85 1svm h ILE 326 Cb 0.16 1.61 -0.08 0.00 -0.74 0.00 0.00 36.82 37.77 1svm h ILE 326 CO -0.17 0.46 0.60 0.15 0.00 0.00 0.00 178.15 179.19 1svm h PHE 327 N 0.42 0.96 -0.02 1.37 3.57 -0.10 0.86 116.94 124.00 1svm h PHE 327 Ca 0.04 0.03 0.01 0.00 3.53 0.00 0.00 57.97 61.58 1svm h PHE 327 Cb 0.85 -0.30 -0.00 0.00 2.79 0.00 0.00 35.95 39.29 1svm h PHE 327 CO 0.07 0.35 0.03 0.00 -2.23 0.00 0.00 178.31 176.53 1svm h ALA 328 N 1.58 1.51 -0.03 2.41 0.00 -0.69 -0.78 119.26 123.26 1svm h ALA 328 Ca 0.48 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.39 1svm h ALA 328 Cb 0.65 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.45 1svm h ALA 328 CO -0.24 -0.04 -0.05 -0.25 0.00 0.00 0.00 179.25 178.67 1svm n ASP 329 N -3.76 2.65 -4.79 0.00 8.00 0.28 -4.99 116.55 113.94 1svm n ASP 329 Ca -0.02 -1.86 -0.33 0.00 0.71 0.00 0.00 54.79 53.28 1svm n ASP 329 Cb 0.11 0.05 0.02 0.00 -0.02 0.00 0.00 41.12 41.28 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 -2.06 5.63 0.00 -2.24 0.15 -0.30 -4.96 113.70 109.92 1svm s SER 330 Ca 0.28 1.93 0.22 0.00 0.70 0.00 0.00 55.95 59.08 1svm s SER 330 Cb 0.20 -2.55 0.22 0.00 -1.71 0.00 0.00 66.02 62.18 1svm s SER 330 CO 0.34 -1.27 1.22 0.29 1.20 0.00 0.00 173.24 175.01 1svm n LYS 331 N -1.93 2.09 -1.76 5.44 5.02 -1.26 -4.43 118.16 121.33 1svm n LYS 331 Ca 0.10 -1.88 -0.07 0.00 -2.02 0.00 0.00 58.31 54.43 1svm n LYS 331 Cb 0.52 -1.43 0.08 0.00 -0.02 0.00 0.00 35.03 34.18 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 1.25 2.84 -0.12 4.39 4.13 -1.26 -4.91 115.26 121.58 1svm n ASN 332 Ca 0.14 -3.18 -0.05 0.00 1.68 0.00 0.00 54.58 53.17 1svm n ASN 332 Cb 0.55 -0.41 0.01 0.00 -1.54 0.00 0.00 39.78 38.39 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 1.80 -0.07 -0.51 3.52 4.20 -1.90 -1.13 115.11 121.03 1svm h GLN 333 Ca 0.08 0.00 -0.02 0.00 0.06 0.00 0.00 58.65 58.78 1svm h GLN 333 Cb 1.39 0.02 -0.02 0.00 0.30 0.00 0.00 27.48 29.17 1svm h GLN 333 CO 0.35 -0.04 0.26 -0.22 -0.67 0.00 0.00 178.83 178.50 1svm h LYS 334 N -0.07 0.73 -0.69 1.46 3.64 -1.97 -1.92 116.57 117.76 1svm h LYS 334 Ca 0.20 -0.10 0.01 0.00 -1.27 0.00 0.00 60.65 59.48 1svm h LYS 334 Cb 0.37 -0.14 -0.03 0.00 -0.41 0.00 0.00 32.23 32.02 1svm h LYS 334 CO -0.45 0.60 0.45 1.15 -2.27 0.00 0.00 179.45 178.93 1svm h THR 335 N 0.69 1.17 -0.48 1.00 2.02 -1.81 0.58 112.91 116.07 1svm h THR 335 Ca 0.18 -0.32 -0.01 0.00 0.77 0.00 0.00 66.41 67.03 1svm h THR 335 Cb 0.10 0.16 -0.02 0.00 -1.74 0.00 0.00 68.15 66.65 1svm h THR 335 CO -0.02 0.17 0.28 0.40 0.37 0.00 0.00 175.52 176.71 1svm h ILE 336 N 0.93 1.16 -0.05 3.11 2.04 -0.99 -2.26 117.51 121.44 1svm h ILE 336 Ca 0.25 -0.38 -0.08 0.00 1.00 0.00 0.00 64.86 65.66 1svm h ILE 336 Cb -0.10 0.54 -0.01 0.00 -0.74 0.00 0.00 36.82 36.51 1svm h ILE 336 CO -0.06 0.16 -0.32 0.00 0.00 0.00 0.00 178.15 177.94 1svm h GLN 338 N 0.09 0.48 -0.47 0.00 1.08 -0.35 0.41 115.11 116.36 1svm h GLN 338 Ca 0.01 -0.09 -0.07 0.00 -1.45 0.00 0.00 58.65 57.05 1svm h GLN 338 Cb 0.61 -0.08 -0.02 0.00 -0.05 0.00 0.00 27.48 27.95 1svm h GLN 338 CO 0.04 0.49 -0.00 0.37 -0.95 0.00 0.00 178.83 178.79 1svm h GLN 339 N 0.37 0.78 -0.11 1.46 4.15 -1.27 -0.31 115.11 120.18 1svm h GLN 339 Ca 0.11 -0.21 -0.01 0.00 0.77 0.00 0.00 58.65 59.31 1svm h GLN 339 Cb 0.19 -0.09 -0.00 0.00 0.21 0.00 0.00 27.48 27.79 1svm h GLN 339 CO -0.01 0.79 0.04 0.00 -1.93 0.00 0.00 178.83 177.72 1svm h ALA 340 N 1.27 0.14 -0.74 3.38 0.00 -1.05 -1.69 119.26 120.58 1svm h ALA 340 Ca 0.14 -0.11 -0.04 0.00 0.00 0.00 0.00 54.91 54.91 1svm h ALA 340 Cb 0.45 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.16 1svm h ALA 340 CO 0.02 -0.26 0.31 0.28 0.00 0.00 0.00 179.25 179.61 1svm h VAL 341 N 0.00 1.24 -0.64 0.00 2.07 -0.71 -2.23 116.25 115.99 1svm h VAL 341 Ca 0.04 -0.74 -0.01 0.00 0.82 0.00 0.00 66.70 66.81 1svm h VAL 341 Cb 0.20 0.34 -0.03 0.00 -1.52 0.00 0.00 31.29 30.28 1svm h VAL 341 CO -0.00 0.30 0.37 0.44 0.02 0.00 0.00 177.57 178.71 1svm h ASP 342 N 1.06 0.76 -0.62 0.57 3.32 -0.84 -0.65 116.42 120.02 1svm h ASP 342 Ca 0.25 -0.04 -0.06 0.00 0.02 0.00 0.00 57.03 57.19 1svm h ASP 342 Cb 0.17 -0.19 -0.03 0.00 0.22 0.00 0.00 39.33 39.50 1svm h ASP 342 CO -0.03 0.59 0.16 0.74 -1.72 0.00 0.00 179.24 178.99 1svm h THR 343 N 0.88 1.25 -0.43 0.35 2.02 -0.72 0.17 112.91 116.43 1svm h THR 343 Ca 0.23 -0.92 -0.09 0.00 0.77 0.00 0.00 66.41 66.40 1svm h THR 343 Cb -0.02 0.58 -0.01 0.00 -1.74 0.00 0.00 68.15 66.96 1svm h THR 343 CO -0.04 0.35 -0.09 0.58 0.37 0.00 0.00 175.52 176.68 1svm h VAL 344 N 0.97 1.27 -0.68 3.16 2.07 -0.92 -0.55 116.25 121.58 1svm h VAL 344 Ca 0.21 -1.19 -0.05 0.00 0.82 0.00 0.00 66.70 66.48 1svm h VAL 344 Cb 0.34 1.17 -0.03 0.00 -1.52 0.00 0.00 31.29 31.25 1svm h VAL 344 CO 0.00 0.40 0.22 -0.07 0.02 0.00 0.00 177.57 178.15 1svm h LEU 345 N 0.64 0.96 -0.38 2.57 3.38 -0.84 -1.45 115.31 120.19 1svm h LEU 345 Ca 0.11 -0.16 -0.03 0.00 0.09 0.00 0.00 57.88 57.89 1svm h LEU 345 Cb 0.63 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 41.11 1svm h LEU 345 CO 0.04 0.89 0.13 0.00 0.09 0.00 0.00 178.44 179.58 1svm h ALA 346 N 1.24 0.50 -0.74 1.53 0.00 -0.37 -0.97 119.26 120.45 1svm h ALA 346 Ca 0.22 -0.16 0.02 0.00 0.00 0.00 0.00 54.91 54.99 1svm h ALA 346 Cb 0.26 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 17.86 1svm h ALA 346 CO -0.01 0.14 0.48 -0.22 0.00 0.00 0.00 179.25 179.64 1svm h LYS 347 N 0.47 0.94 -0.62 0.00 1.63 -0.76 -0.23 116.57 118.00 1svm h LYS 347 Ca 0.12 -0.06 -0.04 0.00 -0.85 0.00 0.00 60.65 59.83 1svm h LYS 347 Cb 0.24 -0.21 -0.03 0.00 -0.60 0.00 0.00 32.23 31.63 1svm h LYS 347 CO -0.01 0.62 0.22 0.87 -3.45 0.00 0.00 179.45 177.71 1svm h LYS 348 N 0.97 0.92 -0.49 1.90 1.79 -0.98 -0.20 116.57 120.48 1svm h LYS 348 Ca 0.29 -0.16 -0.09 0.00 -2.18 0.00 0.00 60.65 58.50 1svm h LYS 348 Cb -0.05 -0.15 -0.02 0.00 -1.58 0.00 0.00 32.23 30.43 1svm h LYS 348 CO -0.08 0.78 -0.05 -0.09 -1.08 0.00 0.00 179.45 178.92 1svm h ARG 349 N 0.90 0.90 -0.05 3.15 9.65 -0.19 -0.70 114.38 128.05 1svm h ARG 349 Ca 0.21 -0.32 -0.01 0.00 -1.10 0.00 0.00 59.98 58.77 1svm h ARG 349 Cb 0.22 -0.07 -0.00 0.00 -1.39 0.00 0.00 29.97 28.73 1svm h ARG 349 CO -0.01 0.96 0.01 0.28 2.80 0.00 0.00 179.97 184.01 1svm h VAL 350 N 0.76 1.19 -0.91 0.20 2.07 -0.75 -2.78 116.25 116.04 1svm h VAL 350 Ca 0.13 -0.57 0.05 0.00 0.82 0.00 0.00 66.70 67.14 1svm h VAL 350 Cb 0.59 1.47 -0.06 0.00 -1.52 0.00 0.00 31.29 31.77 1svm h VAL 350 CO 0.04 0.16 0.59 0.44 0.02 0.00 0.00 177.57 178.82 1svm h ASP 351 N -0.13 0.94 0.04 0.57 3.32 -0.92 0.14 116.42 120.37 1svm h ASP 351 Ca 0.02 0.00 -0.04 0.00 0.02 0.00 0.00 57.03 57.03 1svm h ASP 351 Cb 0.24 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 39.58 1svm h ASP 351 CO 0.00 0.62 -0.11 0.28 -1.72 0.00 0.00 179.24 178.31 1svm h SER 352 N 1.07 0.16 0.51 6.45 0.02 -0.99 -1.38 113.55 119.39 1svm h SER 352 Ca 0.38 -0.03 -0.23 0.00 -0.84 0.00 0.00 61.79 61.08 1svm h SER 352 Cb 0.13 -0.04 -0.04 0.00 0.14 0.00 0.00 62.40 62.59 1svm h SER 352 CO -0.13 0.29 -1.66 0.18 -1.14 0.00 0.00 176.83 174.37 1svm n LEU 353 N -4.32 0.72 -0.00 5.07 4.77 -0.65 -4.64 117.00 117.94 1svm n LEU 353 Ca -0.01 0.33 0.05 0.00 -0.03 0.00 0.00 56.01 56.34 1svm n LEU 353 Cb 0.23 0.16 -0.06 0.00 -2.33 0.00 0.00 43.42 41.41 1svm n LEU 353 CO 0.37 0.26 -0.38 0.00 -1.33 0.00 0.00 177.39 176.31 1svm n GLN 354 N -2.89 1.72 -3.01 3.23 6.02 0.39 -5.01 117.38 117.82 1svm n GLN 354 Ca -0.15 -0.05 -0.29 0.00 -0.01 0.00 0.00 57.00 56.50 1svm n GLN 354 Cb 0.94 -1.11 -0.03 0.00 1.02 0.00 0.00 30.24 31.06 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 -3.18 3.89 0.55 1.08 1.43 -0.53 -5.05 118.68 116.87 1svm s LEU 355 Ca -0.01 0.91 -0.15 0.00 -1.03 0.00 0.00 54.13 53.86 1svm s LEU 355 Cb 0.06 -3.79 -0.06 0.00 0.03 0.00 0.00 46.19 42.43 1svm s LEU 355 CO 0.38 -0.35 1.00 0.42 0.23 0.00 0.00 176.35 178.03 1svm s THR 356 N -2.33 4.55 0.46 5.49 -4.23 -1.26 -4.91 115.64 113.41 1svm s THR 356 Ca 0.47 1.09 0.18 0.00 -1.18 0.00 0.00 61.69 62.25 1svm s THR 356 Cb -0.10 -3.75 0.22 0.00 1.34 0.00 0.00 72.50 70.21 1svm s THR 356 CO 0.33 -0.82 2.03 0.03 -0.54 0.00 0.00 174.62 175.65 1svm h ARG 357 N 0.50 0.00 -0.60 3.99 3.08 -1.97 -1.25 114.38 118.13 1svm h ARG 357 Ca -0.46 0.00 -0.09 0.00 0.07 0.00 0.00 59.98 59.50 1svm h ARG 357 Cb 1.19 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 31.22 1svm h ARG 357 CO 0.61 0.15 0.01 1.49 -1.07 0.00 0.00 179.97 181.17 1svm h GLU 358 N 0.00 1.04 -0.26 0.04 4.81 -1.91 -1.88 114.58 116.41 1svm h GLU 358 Ca -0.00 -0.31 -0.07 0.00 -0.13 0.00 0.00 59.36 58.84 1svm h GLU 358 Cb 0.28 -0.10 -0.01 0.00 0.63 0.00 0.00 28.75 29.54 1svm h GLU 358 CO 0.02 1.01 -0.14 1.96 -0.73 0.00 0.00 179.01 181.13 1svm h GLN 359 N 0.95 0.44 -0.18 1.92 4.20 -1.63 -0.95 115.11 119.87 1svm h GLN 359 Ca 0.17 -0.12 -0.01 0.00 0.06 0.00 0.00 58.65 58.75 1svm h GLN 359 Cb 0.53 -0.05 -0.01 0.00 0.30 0.00 0.00 27.48 28.25 1svm h GLN 359 CO 0.03 0.57 0.08 0.52 -0.67 0.00 0.00 178.83 179.36 1svm h MET 360 N 0.41 0.26 -0.79 1.46 2.86 -0.79 -1.58 114.93 116.76 1svm h MET 360 Ca 0.08 -0.04 -0.04 0.00 -2.06 0.00 0.00 59.70 57.63 1svm h MET 360 Cb 0.48 -0.04 -0.04 0.00 0.06 0.00 0.00 31.60 32.07 1svm h MET 360 CO 0.03 0.32 0.33 1.25 1.06 0.00 0.00 176.91 179.89 1svm h LEU 361 N 0.14 1.08 -0.60 1.22 6.46 -1.04 -2.03 115.31 120.53 1svm h LEU 361 Ca 0.06 -0.16 0.01 0.00 -0.12 0.00 0.00 57.88 57.67 1svm h LEU 361 Cb 0.15 -0.28 -0.03 0.00 -0.73 0.00 0.00 40.66 39.77 1svm h LEU 361 CO -0.01 0.95 0.40 0.74 -0.62 0.00 0.00 178.44 179.89 1svm h THR 362 N 1.14 1.14 -0.78 1.05 2.02 -0.96 0.15 112.91 116.68 1svm h THR 362 Ca 0.26 -0.28 -0.03 0.00 0.77 0.00 0.00 66.41 67.14 1svm h THR 362 Cb 0.20 0.27 -0.04 0.00 -1.74 0.00 0.00 68.15 66.84 1svm h THR 362 CO -0.02 0.15 0.39 0.78 0.37 0.00 0.00 175.52 177.18 1svm h ASN 363 N 0.80 1.02 -0.07 4.18 2.35 -0.91 -0.82 115.58 122.13 1svm h ASN 363 Ca 0.22 -0.13 -0.00 0.00 -0.55 0.00 0.00 56.30 55.84 1svm h ASN 363 Cb -0.08 -0.26 -0.00 0.00 0.05 0.00 0.00 38.32 38.03 1svm h ASN 363 CO -0.06 0.86 0.04 -0.09 -1.65 0.00 0.00 177.43 176.53 1svm h ARG 364 N 1.10 0.10 -0.88 0.81 9.65 -0.66 -1.98 114.38 122.53 1svm h ARG 364 Ca 0.27 -0.01 0.07 0.00 -1.10 0.00 0.00 59.98 59.21 1svm h ARG 364 Cb 0.10 -0.02 -0.07 0.00 -1.39 0.00 0.00 29.97 28.60 1svm h ARG 364 CO -0.04 0.16 0.54 0.74 2.80 0.00 0.00 179.97 184.18 1svm h PHE 365 N 0.02 1.00 -0.40 2.20 -1.00 -0.37 -0.75 116.94 117.64 1svm h PHE 365 Ca 0.03 0.03 -0.06 0.00 2.81 0.00 0.00 57.97 60.78 1svm h PHE 365 Cb 0.09 -0.32 -0.02 0.00 3.61 0.00 0.00 35.95 39.31 1svm h PHE 365 CO -0.04 0.49 0.01 -0.91 -1.61 0.00 0.00 178.31 176.24 1svm h ASN 366 N 0.97 0.59 -0.44 2.17 2.35 -0.89 0.70 115.58 121.03 1svm h ASN 366 Ca 0.39 -0.12 -0.14 0.00 -0.55 0.00 0.00 56.30 55.89 1svm h ASN 366 Cb 0.22 -0.16 -0.01 0.00 0.05 0.00 0.00 38.32 38.43 1svm h ASN 366 CO -0.19 0.66 -0.26 0.44 -1.65 0.00 0.00 177.43 176.42 1svm h ASP 367 N 0.60 0.98 -0.51 5.81 3.32 -0.50 -1.40 116.42 124.72 1svm h ASP 367 Ca 0.13 -0.42 -0.10 0.00 0.02 0.00 0.00 57.03 56.66 1svm h ASP 367 Cb 0.36 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 39.62 1svm h ASP 367 CO 0.01 1.19 -0.04 -0.07 -1.72 0.00 0.00 179.24 178.61 1svm h LEU 368 N 0.78 0.95 -1.21 1.55 3.38 -0.70 -2.29 115.31 117.77 1svm h LEU 368 Ca 0.09 -0.28 -0.07 0.00 0.09 0.00 0.00 57.88 57.71 1svm h LEU 368 Cb 0.84 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 41.32 1svm h LEU 368 CO 0.07 1.03 -0.23 -0.07 0.09 0.00 0.00 178.44 179.33 1svm h LEU 369 N 0.88 0.25 -0.63 1.67 3.38 -0.69 -0.33 115.31 119.83 1svm h LEU 369 Ca 0.15 -0.07 -0.05 0.00 0.09 0.00 0.00 57.88 58.00 1svm h LEU 369 Cb 0.57 -0.07 -0.03 0.00 0.09 0.00 0.00 40.66 41.23 1svm h LEU 369 CO 0.03 0.49 0.19 0.44 0.09 0.00 0.00 178.44 179.69 1svm h ASP 370 N 0.23 0.93 -0.24 -0.43 3.32 -0.81 0.15 116.42 119.57 1svm h ASP 370 Ca 0.04 -0.21 -0.10 0.00 0.02 0.00 0.00 57.03 56.78 1svm h ASP 370 Cb 0.54 -0.24 -0.02 0.00 0.22 0.00 0.00 39.33 39.83 1svm h ASP 370 CO 0.04 0.89 -0.19 0.03 -1.72 0.00 0.00 179.24 178.29 1svm h ARG 371 N 0.92 0.69 -0.36 3.56 3.08 -0.86 -2.84 114.38 118.56 1svm h ARG 371 Ca 0.20 -0.25 -0.08 0.00 0.07 0.00 0.00 59.98 59.92 1svm h ARG 371 Cb 0.30 -0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.30 1svm h ARG 371 CO -0.01 0.83 -0.08 0.52 -1.07 0.00 0.00 179.97 180.17 1svm h MET 372 N 0.61 0.68 -0.85 0.04 2.86 -0.51 0.12 114.93 117.88 1svm h MET 372 Ca 0.09 -0.26 0.09 0.00 -2.06 0.00 0.00 59.70 57.57 1svm h MET 372 Cb 0.66 -0.04 -0.07 0.00 0.06 0.00 0.00 31.60 32.21 1svm h MET 372 CO 0.05 0.84 0.50 -0.44 1.06 0.00 0.00 176.91 178.92 1svm h ASP 373 N 0.48 0.73 0.11 1.22 3.32 -0.61 -0.11 116.42 121.56 1svm h ASP 373 Ca 0.09 0.04 -0.01 0.00 0.02 0.00 0.00 57.03 57.18 1svm h ASP 373 Cb 0.58 -0.10 0.00 0.00 0.22 0.00 0.00 39.33 40.03 1svm h ASP 373 CO 0.03 0.42 -0.05 0.40 -1.72 0.00 0.00 179.24 178.32 1svm h ILE 374 N 0.84 1.04 0.00 0.35 2.04 -1.31 -1.88 117.51 118.59 1svm h ILE 374 Ca 0.41 -1.30 -0.02 0.00 1.00 0.00 0.00 64.86 64.95 1svm h ILE 374 Cb 0.35 1.77 -0.00 0.00 -0.74 0.00 0.00 36.82 38.20 1svm h ILE 374 CO -0.24 0.28 -0.07 0.00 0.00 0.00 0.00 178.15 178.12 1svm h MET 375 N -0.83 0.00 -0.44 2.37 -0.00 -0.61 -1.38 114.93 114.04 1svm h MET 375 Ca -0.01 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.69 1svm h MET 375 Cb 0.57 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 32.17 1svm h MET 375 CO 0.02 0.07 0.00 1.19 -0.00 0.00 0.00 176.91 178.20 1svm n PHE 376 N -3.90 0.75 -2.97 -0.10 3.72 -0.07 -1.93 117.46 112.96 1svm n PHE 376 Ca -0.02 -0.57 -0.08 0.00 -0.05 0.00 0.00 57.45 56.73 1svm n PHE 376 Cb 0.16 -0.09 0.03 0.00 -0.94 0.00 0.00 39.48 38.64 1svm n PHE 376 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1svm n GLY 377 N 0.65 1.85 0.26 1.37 0.00 -0.54 -4.94 105.19 103.83 1svm n GLY 377 Ca 0.17 -2.16 0.08 0.00 0.00 0.00 0.00 46.02 44.11 1svm n GLY 377 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1svm h SER 378 N 0.02 0.00 -0.60 1.61 4.64 -1.85 -1.57 113.55 115.81 1svm h SER 378 Ca -0.11 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.21 1svm h SER 378 Cb 0.50 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.59 1svm h SER 378 CO 0.16 0.02 0.00 0.35 -0.87 0.00 0.00 176.83 176.48 1svm n THR 379 N -4.51 1.68 -3.92 2.95 -2.24 -1.26 -4.95 114.28 102.03 1svm n THR 379 Ca -0.03 -1.07 -0.21 0.00 -2.27 0.00 0.00 64.05 60.47 1svm n THR 379 Cb 0.11 0.08 -0.03 0.00 -2.10 0.00 0.00 70.33 68.38 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 -0.85 1.57 -0.03 3.38 0.00 -0.59 -4.89 107.32 105.90 1svm s GLY 380 Ca 0.47 -1.51 0.07 0.00 0.00 0.00 0.00 44.72 43.75 1svm s GLY 380 CO 0.22 -1.49 1.10 -1.14 0.00 0.00 0.00 173.10 171.80 1svm n SER 381 N -1.32 2.36 -4.86 1.64 3.41 -1.23 -4.82 113.62 108.80 1svm n SER 381 Ca -0.05 -2.26 -0.35 0.00 -0.26 0.00 0.00 58.87 55.96 1svm n SER 381 Cb 0.59 -0.16 -0.05 0.00 -0.26 0.00 0.00 64.21 64.32 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 -1.45 3.68 -0.41 7.33 0.00 -0.81 -5.06 121.76 125.03 1svm s ALA 382 Ca 0.13 -0.31 -0.11 0.00 0.00 0.00 0.00 51.96 51.67 1svm s ALA 382 Cb 0.09 -2.34 0.06 0.00 0.00 0.00 0.00 23.12 20.94 1svm s ALA 382 CO 0.04 0.54 0.27 0.34 0.00 0.00 0.00 175.76 176.94 1svm s ASP 383 N -1.79 5.74 0.54 0.00 -1.08 -1.26 -4.67 116.67 114.16 1svm s ASP 383 Ca 0.35 -1.34 0.31 0.00 -0.52 0.00 0.00 52.55 51.36 1svm s ASP 383 Cb -0.14 -2.03 1.48 0.00 -1.46 0.00 0.00 42.92 40.77 1svm s ASP 383 CO 0.19 -0.51 1.89 -0.29 0.52 0.00 0.00 175.17 176.96 1svm h ILE 384 N 5.97 0.54 -0.50 4.11 6.09 -1.95 0.11 117.51 131.88 1svm h ILE 384 Ca -0.24 0.00 -0.11 0.00 -1.37 0.00 0.00 64.86 63.14 1svm h ILE 384 Cb 1.09 0.56 -0.02 0.00 0.47 0.00 0.00 36.82 38.92 1svm h ILE 384 CO 0.75 0.00 -0.12 -0.08 -3.07 0.00 0.00 178.15 175.63 1svm h GLU 385 N 0.00 0.95 -0.01 2.19 4.81 -1.97 -1.24 114.58 119.31 1svm h GLU 385 Ca 0.40 -0.35 -0.10 0.00 -0.13 0.00 0.00 59.36 59.18 1svm h GLU 385 Cb 1.66 -0.06 -0.01 0.00 0.63 0.00 0.00 28.75 30.96 1svm h GLU 385 CO -0.00 1.01 -0.49 0.93 -0.73 0.00 0.00 179.01 179.72 1svm h GLU 386 N 0.84 0.02 0.01 1.92 5.08 -1.22 -2.13 114.58 119.10 1svm h GLU 386 Ca 0.13 -0.01 -0.22 0.00 -1.00 0.00 0.00 59.36 58.26 1svm h GLU 386 Cb 0.67 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.92 1svm h GLU 386 CO 0.05 0.51 -0.95 -1.49 -1.00 0.00 0.00 179.01 176.12 1svm h TRP 387 N 0.01 0.56 0.00 4.33 4.06 -1.21 -2.60 115.95 121.10 1svm h TRP 387 Ca -0.00 -0.31 -0.08 0.00 2.06 0.00 0.00 58.89 60.55 1svm h TRP 387 Cb 0.87 -0.06 -0.01 0.00 -1.00 0.00 0.00 29.16 28.96 1svm h TRP 387 CO 0.00 1.13 -0.39 0.52 -3.56 0.00 0.00 178.44 176.14 1svm h MET 388 N 0.20 0.00 -0.35 0.49 2.86 -1.06 -1.26 114.93 115.82 1svm h MET 388 Ca -0.08 0.00 -0.07 0.00 -2.06 0.00 0.00 59.70 57.49 1svm h MET 388 Cb 1.59 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 33.23 1svm h MET 388 CO 0.16 0.39 -0.08 0.00 1.06 0.00 0.00 176.91 178.44 1svm h ALA 389 N 1.61 1.21 -0.47 6.32 0.00 -1.21 -0.56 119.26 126.15 1svm h ALA 389 Ca -0.00 -0.26 -0.12 0.00 0.00 0.00 0.00 54.91 54.52 1svm h ALA 389 Cb 0.71 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.34 1svm h ALA 389 CO 0.05 0.51 -0.19 0.78 0.00 0.00 0.00 179.25 180.41 1svm h GLY 390 N 0.93 1.01 1.01 0.00 0.00 -0.88 -1.35 103.07 103.80 1svm h GLY 390 Ca 0.10 -0.86 0.00 0.00 0.00 0.00 0.00 47.33 46.57 1svm h GLY 390 CO 0.03 0.79 0.53 -2.08 0.00 0.00 0.00 176.54 175.80 1svm h VAL 391 N 0.82 1.22 -0.07 4.60 2.07 -0.59 0.40 116.25 124.70 1svm h VAL 391 Ca 0.11 -0.44 -0.00 0.00 0.82 0.00 0.00 66.70 67.19 1svm h VAL 391 Cb 0.74 0.03 -0.00 0.00 -1.52 0.00 0.00 31.29 30.53 1svm h VAL 391 CO 0.06 0.22 0.03 0.00 0.02 0.00 0.00 177.57 177.90 1svm h ALA 392 N 1.29 0.08 -0.03 1.67 0.00 -0.77 -0.69 119.26 120.81 1svm h ALA 392 Ca 0.30 -0.07 0.01 0.00 0.00 0.00 0.00 54.91 55.15 1svm h ALA 392 Cb -0.09 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 1svm h ALA 392 CO -0.06 -0.35 -0.01 2.35 0.00 0.00 0.00 179.25 181.17 1svm h TRP 393 N -0.02 -0.03 -0.73 0.00 7.01 -0.91 -2.39 115.95 118.88 1svm h TRP 393 Ca 0.02 0.00 0.05 0.00 2.11 0.00 0.00 58.89 61.07 1svm h TRP 393 Cb 0.12 0.02 -0.04 0.00 -2.10 0.00 0.00 29.16 27.16 1svm h TRP 393 CO -0.03 -0.02 0.48 -0.07 -2.79 0.00 0.00 178.44 176.00 1svm h LEU 394 N -0.01 0.72 0.00 0.65 3.38 -0.82 0.03 115.31 119.26 1svm h LEU 394 Ca 0.02 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.99 1svm h LEU 394 Cb 0.04 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 40.63 1svm h LEU 394 CO -0.04 0.48 0.00 1.57 0.09 0.00 0.00 178.44 180.54 1svm n HIS 395 N -4.47 0.00 0.64 1.13 -0.00 -0.28 -1.89 115.22 110.36 1svm n HIS 395 Ca 0.10 0.00 0.07 0.00 0.46 0.00 0.00 57.72 58.35 1svm n HIS 395 Cb 0.17 -0.23 -0.04 0.00 -0.12 0.00 0.00 29.99 29.77 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 0.75 0.46 -7.95 0.00 5.85 -1.15 -3.46 115.31 109.81 1svm h LEU 397 Ca 0.00 -0.26 -0.11 0.00 0.84 0.00 0.00 57.88 58.35 1svm h LEU 397 Cb 0.40 -0.13 -0.16 0.00 0.37 0.00 0.00 40.66 41.14 1svm h LEU 397 CO 0.00 0.95 -0.52 -0.76 -0.34 0.00 0.00 178.44 177.77 1svm s LEU 398 N -8.12 1.87 0.45 2.25 1.02 -1.26 -4.83 118.68 110.05 1svm s LEU 398 Ca -0.06 -0.67 -0.23 0.00 0.02 0.00 0.00 54.13 53.19 1svm s LEU 398 Cb 0.11 0.62 -0.08 0.00 0.02 0.00 0.00 46.19 46.87 1svm s LEU 398 CO 0.82 -0.59 1.17 -2.84 0.02 0.00 0.00 176.35 174.94 1svm s PRO 399 N -3.24 3.82 -1.49 1.29 0.02 -1.26 -3.48 135.00 130.66 1svm s PRO 399 Ca 0.00 1.80 -0.03 0.00 0.02 0.00 0.00 61.00 62.79 1svm s PRO 399 Cb 0.03 -2.47 0.00 0.00 0.02 0.00 0.00 34.50 32.08 1svm s PRO 399 CO -0.08 -0.50 0.13 1.63 -0.33 0.00 0.00 177.00 177.85 1svm n LYS 400 N -0.35 -1.25 -0.34 5.54 5.02 -1.26 -4.76 118.16 120.75 1svm n LYS 400 Ca 0.07 0.14 0.06 0.00 -2.02 0.00 0.00 58.31 56.55 1svm n LYS 400 Cb 0.48 -3.64 0.21 0.00 -0.02 0.00 0.00 35.03 32.06 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 -1.87 0.90 0.00 1.97 4.05 -1.82 -0.93 114.93 117.22 1svm h MET 401 Ca -0.66 -0.05 -0.04 0.00 -0.28 0.00 0.00 59.70 58.66 1svm h MET 401 Cb 1.40 -0.20 -0.01 0.00 -0.80 0.00 0.00 31.60 31.99 1svm h MET 401 CO 0.68 0.60 -0.21 0.38 0.23 0.00 0.00 176.91 178.58 1svm h ASP 402 N 0.93 0.00 0.60 1.39 3.04 -1.92 -0.93 116.42 119.52 1svm h ASP 402 Ca 0.46 0.00 -0.24 0.00 -3.24 0.00 0.00 57.03 54.02 1svm h ASP 402 Cb 0.45 0.00 -0.00 0.00 -1.04 0.00 0.00 39.33 38.73 1svm h ASP 402 CO -0.26 0.21 -1.06 0.28 -2.04 0.00 0.00 179.24 176.37 1svm h SER 403 N 0.00 0.36 -0.33 4.15 0.02 -1.57 -1.49 113.55 114.69 1svm h SER 403 Ca -0.00 -0.34 -0.01 0.00 -0.84 0.00 0.00 61.79 60.60 1svm h SER 403 Cb 0.40 -0.11 -0.01 0.00 0.14 0.00 0.00 62.40 62.81 1svm h SER 403 CO 0.03 1.20 0.15 0.58 -1.14 0.00 0.00 176.83 177.65 1svm h VAL 404 N 0.11 1.17 -0.40 2.27 2.07 -0.57 0.14 116.25 121.03 1svm h VAL 404 Ca -0.09 -0.49 -0.03 0.00 0.82 0.00 0.00 66.70 66.91 1svm h VAL 404 Cb 1.75 0.88 -0.02 0.00 -1.52 0.00 0.00 31.29 32.39 1svm h VAL 404 CO 0.17 0.18 0.12 0.58 0.02 0.00 0.00 177.57 178.63 1svm h VAL 405 N 0.39 1.22 -0.24 2.57 2.07 -1.20 -1.37 116.25 119.70 1svm h VAL 405 Ca 0.11 -0.73 -0.00 0.00 0.82 0.00 0.00 66.70 66.90 1svm h VAL 405 Cb 0.14 0.94 -0.01 0.00 -1.52 0.00 0.00 31.29 30.84 1svm h VAL 405 CO -0.01 0.26 0.14 0.22 0.02 0.00 0.00 177.57 178.19 1svm h TYR 406 N 0.51 0.31 -0.17 1.57 3.20 -1.06 -1.57 116.97 119.76 1svm h TYR 406 Ca 0.13 -0.00 -0.04 0.00 3.14 0.00 0.00 58.73 61.95 1svm h TYR 406 Cb 0.28 -0.10 -0.01 0.00 1.54 0.00 0.00 36.73 38.43 1svm h TYR 406 CO 0.01 0.25 -0.08 -0.44 -1.64 0.00 0.00 178.16 176.26 1svm h ASP 407 N 0.29 0.23 -0.15 -2.11 3.32 -0.63 -1.91 116.42 115.47 1svm h ASP 407 Ca 0.08 -0.04 -0.02 0.00 0.02 0.00 0.00 57.03 57.07 1svm h ASP 407 Cb 0.03 -0.06 -0.01 0.00 0.22 0.00 0.00 39.33 39.51 1svm h ASP 407 CO -0.02 0.36 0.00 0.15 -1.72 0.00 0.00 179.24 178.01 1svm h PHE 408 N 0.24 0.28 -0.47 4.55 3.57 -0.78 -1.06 116.94 123.27 1svm h PHE 408 Ca 0.05 -0.05 0.05 0.00 3.53 0.00 0.00 57.97 61.56 1svm h PHE 408 Cb 0.31 -0.07 -0.05 0.00 2.79 0.00 0.00 35.95 38.93 1svm h PHE 408 CO 0.01 0.48 0.20 -0.07 -2.23 0.00 0.00 178.31 176.69 1svm h LEU 409 N 0.01 0.25 -0.82 0.59 3.38 -0.95 0.63 115.31 118.40 1svm h LEU 409 Ca 0.04 0.04 0.01 0.00 0.09 0.00 0.00 57.88 58.07 1svm h LEU 409 Cb 0.36 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.07 1svm h LEU 409 CO 0.01 0.18 0.54 0.11 0.09 0.00 0.00 178.44 179.37 1svm h LYS 410 N 0.40 1.08 -0.52 1.13 1.79 -1.23 0.20 116.57 119.42 1svm h LYS 410 Ca 0.22 -0.06 -0.03 0.00 -2.18 0.00 0.00 60.65 58.60 1svm h LYS 410 Cb 0.18 -0.24 -0.02 0.00 -1.58 0.00 0.00 32.23 30.56 1svm h LYS 410 CO -0.19 0.71 0.23 0.00 -1.08 0.00 0.00 179.45 179.12 1svm h MET 412 N 0.70 0.73 -0.06 0.00 2.86 -0.32 -1.89 114.93 116.95 1svm h MET 412 Ca 0.18 -0.28 -0.04 0.00 -2.06 0.00 0.00 59.70 57.50 1svm h MET 412 Cb 0.16 -0.04 0.00 0.00 0.06 0.00 0.00 31.60 31.78 1svm h MET 412 CO -0.02 0.88 -0.11 0.28 1.06 0.00 0.00 176.91 179.00 1svm h VAL 413 N 0.64 1.42 -0.19 -2.22 2.07 -0.33 -3.24 116.25 114.41 1svm h VAL 413 Ca 0.09 -1.42 -0.06 0.00 0.82 0.00 0.00 66.70 66.14 1svm h VAL 413 Cb 0.69 2.22 -0.01 0.00 -1.52 0.00 0.00 31.29 32.67 1svm h VAL 413 CO 0.05 0.39 -0.13 1.88 0.02 0.00 0.00 177.57 179.78 1svm h TYR 414 N -0.32 0.32 -6.55 1.57 -1.99 -1.00 -3.44 116.97 105.56 1svm h TYR 414 Ca 0.00 -0.04 -0.51 0.00 2.00 0.00 0.00 58.73 60.18 1svm h TYR 414 Cb 0.69 -0.09 -0.06 0.00 2.00 0.00 0.00 36.73 39.27 1svm h TYR 414 CO 0.11 0.44 -0.90 -1.71 -0.00 0.00 0.00 178.16 176.10 1svm n ASN 415 N -4.25 -0.53 -4.72 3.88 4.05 -0.71 -4.88 115.26 108.11 1svm n ASN 415 Ca -0.00 -1.04 -0.42 0.00 0.45 0.00 0.00 54.58 53.57 1svm n ASN 415 Cb 0.29 -2.89 -0.03 0.00 1.23 0.00 0.00 39.78 38.37 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 -3.97 4.04 0.09 -1.44 1.01 -1.26 -4.95 121.20 114.72 1svm s ILE 416 Ca 0.04 1.50 -0.36 0.00 0.00 0.00 0.00 60.65 61.82 1svm s ILE 416 Cb -0.02 -3.96 -0.16 0.00 0.01 0.00 0.00 42.46 38.33 1svm s ILE 416 CO 0.90 0.13 1.38 -2.65 0.00 0.00 0.00 174.94 174.70 1svm n PRO 417 N 3.72 1.27 -1.24 2.79 -0.02 -1.26 -0.97 135.00 139.29 1svm n PRO 417 Ca 0.08 0.46 -0.08 0.00 -2.02 0.00 0.00 63.50 61.94 1svm n PRO 417 Cb 0.47 -2.12 -0.04 0.00 -0.02 0.00 0.00 33.50 31.79 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 2.70 -1.49 -2.84 -0.52 4.81 0.43 -4.78 118.16 116.48 1svm n LYS 418 Ca 0.18 0.75 -0.00 0.00 -0.87 0.00 0.00 58.31 58.38 1svm n LYS 418 Cb 0.20 -5.02 0.05 0.00 0.02 0.00 0.00 35.03 30.28 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 -0.93 1.72 -0.00 1.64 5.02 -0.14 -4.69 118.16 120.77 1svm n LYS 419 Ca -0.08 -3.49 0.08 0.00 -2.02 0.00 0.00 58.31 52.79 1svm n LYS 419 Cb 0.50 -1.59 -0.11 0.00 -0.02 0.00 0.00 35.03 33.81 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 -0.60 1.11 -5.16 1.97 1.74 -1.20 -4.47 116.66 110.03 1svm n ARG 420 Ca 0.07 -0.07 -0.31 0.00 -0.77 0.00 0.00 57.85 56.77 1svm n ARG 420 Cb 0.80 -1.33 -0.15 0.00 -1.02 0.00 0.00 32.46 30.76 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 -2.83 2.37 -0.00 -1.55 1.51 -1.24 -2.01 117.35 113.59 1svm s TYR 421 Ca 0.01 -0.40 0.03 0.00 -1.01 0.00 0.00 57.07 55.69 1svm s TYR 421 Cb 0.12 -1.49 -0.03 0.00 -0.11 0.00 0.00 41.96 40.45 1svm s TYR 421 CO 0.69 0.03 -0.06 -1.58 -1.11 0.00 0.00 175.55 173.52 1svm s TRP 422 N -0.68 2.92 -0.17 2.71 0.52 -0.83 -0.93 118.94 122.48 1svm s TRP 422 Ca 0.11 -0.02 -0.03 0.00 0.02 0.00 0.00 56.10 56.18 1svm s TRP 422 Cb -0.10 -1.62 -0.02 0.00 -1.15 0.00 0.00 33.47 30.58 1svm s TRP 422 CO 0.00 0.39 -0.05 -1.17 0.02 0.00 0.00 176.95 176.13 1svm s LEU 423 N -1.40 3.04 -0.35 2.99 2.96 0.24 -1.62 118.68 124.53 1svm s LEU 423 Ca 0.17 -0.26 -0.10 0.00 -0.22 0.00 0.00 54.13 53.73 1svm s LEU 423 Cb -0.11 -1.74 0.02 0.00 0.50 0.00 0.00 46.19 44.86 1svm s LEU 423 CO 0.08 0.10 0.17 -0.36 -1.32 0.00 0.00 176.35 175.02 1svm s PHE 424 N 0.77 3.23 -0.01 5.38 0.40 0.83 -0.27 117.98 128.30 1svm s PHE 424 Ca -0.02 -0.99 0.06 0.00 -0.60 0.00 0.00 56.93 55.39 1svm s PHE 424 Cb -0.15 -2.39 -0.02 0.00 0.51 0.00 0.00 43.02 40.98 1svm s PHE 424 CO 0.02 -0.63 -0.21 0.21 0.70 0.00 0.00 175.22 175.31 1svm s LYS 425 N 1.53 1.66 0.00 0.44 2.20 -0.40 -1.28 119.74 123.90 1svm s LYS 425 Ca 0.02 -0.76 0.00 0.00 -0.36 0.00 0.00 55.97 54.87 1svm s LYS 425 Cb -0.19 -1.62 0.00 0.00 -1.51 0.00 0.00 37.83 34.51 1svm s LYS 425 CO 0.06 0.44 0.00 0.41 -0.36 0.00 0.00 175.35 175.90 1svm n GLY 426 N 2.52 0.86 3.58 5.54 0.00 -0.97 -0.47 105.19 116.25 1svm n GLY 426 Ca -0.15 -1.03 -0.29 0.00 0.00 0.00 0.00 46.02 44.54 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 -0.54 0.43 1.61 0.02 -1.26 -4.11 135.00 129.14 1svm s PRO 427 Ca 0.00 0.45 -0.26 0.00 0.02 0.00 0.00 61.00 61.21 1svm s PRO 427 Cb 0.00 -1.63 -0.09 0.00 0.02 0.00 0.00 34.50 32.80 1svm s PRO 427 CO 0.00 -3.37 1.43 -0.89 -0.33 0.00 0.00 177.00 173.84 1svm n ILE 428 N -4.61 2.56 -3.74 2.83 5.41 -1.26 -3.11 119.36 117.44 1svm n ILE 428 Ca 0.06 -0.50 -0.22 0.00 1.00 0.00 0.00 62.75 63.09 1svm n ILE 428 Cb 0.57 -1.85 0.03 0.00 -0.71 0.00 0.00 39.64 37.68 1svm n ILE 428 CO 0.00 0.00 0.00 0.47 0.00 0.00 0.00 176.55 177.02 1svm n ASP 429 N 0.03 -1.18 -0.40 4.38 8.00 -1.26 -4.90 116.55 121.21 1svm n ASP 429 Ca 0.04 -0.84 0.06 0.00 0.71 0.00 0.00 54.79 54.76 1svm n ASP 429 Cb 0.40 -3.92 0.03 0.00 -0.02 0.00 0.00 41.12 37.62 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 -3.04 1.76 0.00 -2.24 3.41 -1.18 -4.64 113.62 107.69 1svm n SER 430 Ca -0.29 -1.38 0.00 0.00 -0.26 0.00 0.00 58.87 56.94 1svm n SER 430 Cb 0.67 0.15 0.00 0.00 -0.26 0.00 0.00 64.21 64.78 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 0.76 0.93 0.14 5.00 0.00 -1.26 -4.17 105.19 106.58 1svm n GLY 431 Ca 0.06 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.94 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 3.47 -0.27 -0.36 1.61 1.57 -1.94 -2.36 116.57 118.28 1svm h LYS 432 Ca 0.00 0.02 -0.14 0.00 -1.87 0.00 0.00 60.65 58.66 1svm h LYS 432 Cb 0.00 0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.36 1svm h LYS 432 CO 0.00 -0.10 -0.32 1.15 -0.57 0.00 0.00 179.45 179.61 1svm h THR 433 N -0.38 1.28 -0.14 -0.16 2.02 -1.98 -0.88 112.91 112.68 1svm h THR 433 Ca -0.03 -1.48 0.03 0.00 0.77 0.00 0.00 66.41 65.71 1svm h THR 433 Cb 0.29 1.34 -0.04 0.00 -1.74 0.00 0.00 68.15 68.01 1svm h THR 433 CO 0.05 0.49 -0.08 0.74 0.37 0.00 0.00 175.52 177.08 1svm h THR 434 N 0.67 0.74 -0.15 3.16 2.02 -1.92 0.13 112.91 117.56 1svm h THR 434 Ca 0.07 0.00 -0.20 0.00 0.77 0.00 0.00 66.41 67.05 1svm h THR 434 Cb 0.86 0.74 0.00 0.00 -1.74 0.00 0.00 68.15 68.02 1svm h THR 434 CO 0.08 0.00 -0.72 0.25 0.37 0.00 0.00 175.52 175.50 1svm h LEU 435 N -0.08 0.79 -0.65 2.58 5.85 -1.39 -2.57 115.31 119.85 1svm h LEU 435 Ca 0.08 -0.50 -0.04 0.00 0.84 0.00 0.00 57.88 58.26 1svm h LEU 435 Cb 0.20 -0.23 -0.03 0.00 0.37 0.00 0.00 40.66 40.97 1svm h LEU 435 CO -0.19 1.27 0.24 0.00 -0.34 0.00 0.00 178.44 179.43 1svm h ALA 436 N 0.72 0.84 -0.65 1.25 0.00 -0.94 -0.50 119.26 119.97 1svm h ALA 436 Ca -0.03 -0.18 -0.06 0.00 0.00 0.00 0.00 54.91 54.64 1svm h ALA 436 Cb 1.32 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 18.83 1svm h ALA 436 CO 0.14 0.47 0.18 0.00 0.00 0.00 0.00 179.25 180.05 1svm h ALA 437 N 1.10 0.85 -0.28 0.00 0.00 -0.76 -0.04 119.26 120.13 1svm h ALA 437 Ca 0.21 -0.22 -0.03 0.00 0.00 0.00 0.00 54.91 54.87 1svm h ALA 437 Cb 0.23 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 1svm h ALA 437 CO -0.01 0.54 0.05 0.00 0.00 0.00 0.00 179.25 179.83 1svm h ALA 438 N 1.07 0.37 -0.54 0.00 0.00 -1.09 -1.60 119.26 117.47 1svm h ALA 438 Ca 0.21 -0.18 -0.07 0.00 0.00 0.00 0.00 54.91 54.87 1svm h ALA 438 Cb 0.32 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.98 1svm h ALA 438 CO -0.00 0.05 0.07 -0.07 0.00 0.00 0.00 179.25 179.29 1svm h LEU 439 N 0.28 0.82 -0.50 0.00 3.38 -0.94 0.35 115.31 118.70 1svm h LEU 439 Ca 0.09 -0.18 -0.03 0.00 0.09 0.00 0.00 57.88 57.85 1svm h LEU 439 Cb 0.32 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.83 1svm h LEU 439 CO 0.00 0.84 0.19 0.25 0.09 0.00 0.00 178.44 179.82 1svm h LEU 440 N 0.82 0.70 -0.79 1.67 5.85 -0.82 -1.61 115.31 121.13 1svm h LEU 440 Ca 0.17 -0.18 -0.13 0.00 0.84 0.00 0.00 57.88 58.58 1svm h LEU 440 Cb 0.39 -0.18 -0.02 0.00 0.37 0.00 0.00 40.66 41.22 1svm h LEU 440 CO 0.01 0.69 -0.59 -0.08 -0.34 0.00 0.00 178.44 178.13 1svm h GLU 441 N 0.67 0.06 -0.31 1.25 4.81 -1.03 0.41 114.58 120.43 1svm h GLU 441 Ca 0.17 -0.04 -0.10 0.00 -0.13 0.00 0.00 59.36 59.25 1svm h GLU 441 Cb 0.21 0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.58 1svm h GLU 441 CO -0.01 0.63 -0.24 1.25 -0.73 0.00 0.00 179.01 179.91 1svm h LEU 442 N 0.04 0.61 0.00 1.64 5.85 -0.48 -3.32 115.31 119.66 1svm h LEU 442 Ca -0.01 -0.21 -0.14 0.00 0.84 0.00 0.00 57.88 58.36 1svm h LEU 442 Cb 1.05 -0.17 -0.03 0.00 0.37 0.00 0.00 40.66 41.89 1svm h LEU 442 CO 0.08 0.84 -1.93 0.00 -0.34 0.00 0.00 178.44 177.09 1svm n GLY 444 N 1.77 -0.53 0.00 0.00 0.00 0.14 -4.87 105.19 101.70 1svm n GLY 444 Ca -0.14 -1.41 0.00 0.00 0.00 0.00 0.00 46.02 44.47 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 0.32 -0.03 3.07 -0.02 0.00 -1.25 -3.51 105.19 103.78 1svm n GLY 445 Ca 0.00 -1.32 -0.10 0.00 0.00 0.00 0.00 46.02 44.59 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 0.56 -0.18 1.61 -0.14 -1.01 -4.99 119.74 113.59 1svm s LYS 446 Ca 0.00 -0.93 -0.08 0.00 -1.36 0.00 0.00 55.97 53.60 1svm s LYS 446 Cb 0.00 -0.09 -0.04 0.00 -1.68 0.00 0.00 37.83 36.02 1svm s LYS 446 CO 0.00 -0.02 0.07 0.00 -0.76 0.00 0.00 175.35 174.64 1svm s ALA 447 N -2.34 3.43 0.05 5.17 0.00 -1.26 -1.45 121.76 125.35 1svm s ALA 447 Ca -0.04 -0.74 0.07 0.00 0.00 0.00 0.00 51.96 51.26 1svm s ALA 447 Cb -0.03 -1.94 -0.03 0.00 0.00 0.00 0.00 23.12 21.12 1svm s ALA 447 CO -0.03 0.18 -0.18 -0.51 0.00 0.00 0.00 175.76 175.22 1svm s LEU 448 N 0.36 2.62 -0.35 0.00 1.43 0.22 -4.93 118.68 118.02 1svm s LEU 448 Ca 0.03 -0.43 -0.07 0.00 -1.03 0.00 0.00 54.13 52.63 1svm s LEU 448 Cb -0.12 -1.52 0.04 0.00 0.03 0.00 0.00 46.19 44.62 1svm s LEU 448 CO -0.00 0.25 0.12 0.21 0.23 0.00 0.00 176.35 177.16 1svm s ASN 449 N -1.49 5.37 -0.28 2.29 3.84 -1.26 -2.92 114.94 120.49 1svm s ASN 449 Ca 0.15 -1.17 0.12 0.00 0.21 0.00 0.00 52.86 52.16 1svm s ASN 449 Cb -0.10 -1.89 0.63 0.00 -0.55 0.00 0.00 41.25 39.34 1svm s ASN 449 CO 0.06 -0.35 1.62 1.33 -2.79 0.00 0.00 177.10 176.97 1svm n VAL 450 N 4.83 2.66 1.01 -5.21 0.24 -1.26 -4.31 118.33 116.30 1svm n VAL 450 Ca -0.12 -1.97 0.11 0.00 -2.04 0.00 0.00 64.34 60.32 1svm n VAL 450 Cb 0.45 -0.32 0.08 0.00 -1.47 0.00 0.00 33.84 32.58 1svm n VAL 450 CO 0.00 0.00 0.00 0.59 -2.14 0.00 0.00 176.83 175.28 1svm n ASN 451 N -0.51 0.83 -4.90 -1.34 3.02 -1.26 -4.05 115.26 107.05 1svm n ASN 451 Ca 0.34 -0.68 -0.28 0.00 -0.03 0.00 0.00 54.58 53.92 1svm n ASN 451 Cb 1.17 0.58 0.06 0.00 -0.61 0.00 0.00 39.78 40.97 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 -2.94 2.88 0.39 3.41 1.43 -1.26 -4.76 118.68 117.83 1svm s LEU 452 Ca 0.11 0.84 -0.25 0.00 -1.03 0.00 0.00 54.13 53.80 1svm s LEU 452 Cb 0.17 -3.56 -0.12 0.00 0.03 0.00 0.00 46.19 42.72 1svm s LEU 452 CO 0.76 -1.44 0.97 -2.65 0.23 0.00 0.00 176.35 174.21 1svm n PRO 453 N -2.96 1.28 0.00 1.29 -0.02 -1.26 -4.82 135.00 128.51 1svm n PRO 453 Ca 0.07 0.46 0.04 0.00 -2.02 0.00 0.00 63.50 62.04 1svm n PRO 453 Cb 0.59 -1.94 0.18 0.00 -0.02 0.00 0.00 33.50 32.30 1svm n PRO 453 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 1svm n LEU 454 N 0.76 0.00 0.40 2.45 4.32 -1.26 -2.99 117.00 120.68 1svm n LEU 454 Ca 0.10 0.37 -0.17 0.00 -0.02 0.00 0.00 56.01 56.28 1svm n LEU 454 Cb 0.37 -0.37 -0.09 0.00 -1.62 0.00 0.00 43.42 41.72 1svm n LEU 454 CO 0.57 -0.28 0.52 0.44 -1.22 0.00 0.00 177.39 177.42 1svm h ASP 455 N 0.00 -0.87 -0.27 -1.43 3.32 -2.04 -2.86 116.42 112.27 1svm h ASP 455 Ca 0.00 0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.06 1svm h ASP 455 Cb 0.09 0.22 0.00 0.00 0.22 0.00 0.00 39.33 39.87 1svm h ASP 455 CO 0.00 -0.55 0.00 -2.11 -1.72 0.00 0.00 179.24 174.86 1svm n ARG 456 N -5.49 1.93 -0.05 3.56 1.85 -1.16 -4.19 116.66 113.11 1svm n ARG 456 Ca -0.14 -1.10 -0.10 0.00 -1.00 0.00 0.00 57.85 55.51 1svm n ARG 456 Cb 0.42 -1.40 -0.04 0.00 -1.05 0.00 0.00 32.46 30.38 1svm n ARG 456 CO 0.00 0.00 0.00 1.25 -0.01 0.00 0.00 177.63 178.87 1svm h LEU 457 N 1.65 0.25 -0.66 2.89 5.85 -1.45 -2.52 115.31 121.32 1svm h LEU 457 Ca 0.00 -0.11 0.12 0.00 0.84 0.00 0.00 57.88 58.73 1svm h LEU 457 Cb 0.60 -0.07 -0.08 0.00 0.37 0.00 0.00 40.66 41.48 1svm h LEU 457 CO 0.06 0.29 0.22 0.78 -0.34 0.00 0.00 178.44 179.45 1svm h ASN 458 N 0.20 0.17 0.04 1.25 4.21 -1.74 0.36 115.58 120.06 1svm h ASN 458 Ca 0.07 0.10 -0.09 0.00 1.21 0.00 0.00 56.30 57.59 1svm h ASN 458 Cb 0.10 0.10 -0.01 0.00 -1.12 0.00 0.00 38.32 37.39 1svm h ASN 458 CO -0.01 0.08 -0.26 0.15 -1.29 0.00 0.00 177.43 176.10 1svm h PHE 459 N 0.37 0.40 -0.37 1.19 3.57 -1.76 0.08 116.94 120.42 1svm h PHE 459 Ca 0.35 -0.08 -0.10 0.00 3.53 0.00 0.00 57.97 61.67 1svm h PHE 459 Cb 0.49 -0.10 -0.01 0.00 2.79 0.00 0.00 35.95 39.12 1svm h PHE 459 CO -0.20 0.60 -0.14 1.49 -2.23 0.00 0.00 178.31 177.84 1svm h GLU 460 N 0.32 0.75 0.00 1.11 4.57 -0.77 -2.52 114.58 118.04 1svm h GLU 460 Ca 0.05 -0.31 -0.05 0.00 -1.18 0.00 0.00 59.36 57.87 1svm h GLU 460 Cb 0.64 -0.03 -0.01 0.00 -0.16 0.00 0.00 28.75 29.19 1svm h GLU 460 CO 0.05 0.92 -0.25 -0.07 -1.18 0.00 0.00 179.01 178.48 1svm h LEU 461 N 0.55 0.00 -2.48 1.64 3.38 -0.55 -2.33 115.31 115.51 1svm h LEU 461 Ca 0.09 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.05 1svm h LEU 461 Cb 0.67 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.42 1svm h LEU 461 CO 0.05 0.25 -0.02 1.23 0.09 0.00 0.00 178.44 180.03 1svm h GLY 462 N 0.99 0.00 2.00 0.83 0.00 -0.53 -2.02 103.07 104.34 1svm h GLY 462 Ca -0.00 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.31 1svm h GLY 462 CO 0.03 0.00 -0.07 -2.08 0.00 0.00 0.00 176.54 174.43 1svm h VAL 463 N 0.00 0.34 0.00 4.60 2.07 -1.41 -2.66 116.25 119.19 1svm h VAL 463 Ca -0.00 -0.39 0.00 0.00 0.82 0.00 0.00 66.70 67.13 1svm h VAL 463 Cb 0.14 1.28 0.00 0.00 -1.52 0.00 0.00 31.29 31.19 1svm h VAL 463 CO 0.00 0.06 0.00 0.00 0.02 0.00 0.00 177.57 177.66 1svm n ALA 464 N -2.21 1.97 -1.64 1.67 0.00 -0.76 -4.80 120.51 114.75 1svm n ALA 464 Ca -0.02 -0.08 -0.49 0.00 0.00 0.00 0.00 53.44 52.86 1svm n ALA 464 Cb 0.21 -1.33 -0.05 0.00 0.00 0.00 0.00 19.45 18.27 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 -1.47 0.05 -1.33 0.00 5.41 -1.00 -1.28 119.36 119.75 1svm n ILE 465 Ca 0.06 -0.01 -0.11 0.00 1.00 0.00 0.00 62.75 63.69 1svm n ILE 465 Cb 0.23 -1.26 -0.05 0.00 -0.71 0.00 0.00 39.64 37.85 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 3.36 -5.59 -4.85 4.38 8.00 -1.26 -4.98 116.55 115.61 1svm n ASP 466 Ca 0.18 0.28 -0.35 0.00 0.71 0.00 0.00 54.79 55.62 1svm n ASP 466 Cb 0.24 -4.08 -0.06 0.00 -0.02 0.00 0.00 41.12 37.20 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 -2.91 3.99 0.14 -1.24 -1.52 -0.40 -4.95 119.66 112.77 1svm s GLN 467 Ca 0.00 0.52 -0.12 0.00 -1.95 0.00 0.00 55.36 53.81 1svm s GLN 467 Cb 0.00 -2.84 -0.01 0.00 -0.22 0.00 0.00 33.01 29.94 1svm s GLN 467 CO 0.00 0.42 1.54 0.35 -0.25 0.00 0.00 175.29 177.34 1svm h PHE 468 N 3.27 1.00 -3.48 0.91 3.57 -1.89 -3.43 116.94 116.89 1svm h PHE 468 Ca -0.48 -0.23 -0.03 0.00 3.53 0.00 0.00 57.97 60.75 1svm h PHE 468 Cb 1.19 -0.24 -0.09 0.00 2.79 0.00 0.00 35.95 39.60 1svm h PHE 468 CO 0.64 1.00 -0.05 -0.48 -2.23 0.00 0.00 178.31 177.19 1svm s LEU 469 N -9.17 0.24 0.03 0.59 0.05 -1.23 -4.28 118.68 104.91 1svm s LEU 469 Ca -0.12 -0.73 0.03 0.00 0.05 0.00 0.00 54.13 53.36 1svm s LEU 469 Cb 0.11 1.94 -0.02 0.00 -2.05 0.00 0.00 46.19 46.18 1svm s LEU 469 CO 0.84 -1.11 -0.09 -0.69 -0.55 0.00 0.00 176.35 174.76 1svm s VAL 470 N -3.95 0.66 -0.19 1.48 1.01 -0.21 -2.41 120.40 116.80 1svm s VAL 470 Ca 0.16 -0.84 0.01 0.00 0.00 0.00 0.00 61.98 61.31 1svm s VAL 470 Cb -0.01 -0.65 0.03 0.00 0.00 0.00 0.00 36.38 35.75 1svm s VAL 470 CO 0.04 -0.15 -0.18 -0.69 0.00 0.00 0.00 175.10 174.11 1svm s VAL 471 N -0.91 2.01 -0.63 2.92 1.01 -0.53 -1.12 120.40 123.14 1svm s VAL 471 Ca -0.04 -0.99 -0.21 0.00 0.00 0.00 0.00 61.98 60.74 1svm s VAL 471 Cb -0.07 -1.86 0.09 0.00 0.00 0.00 0.00 36.38 34.53 1svm s VAL 471 CO 0.00 0.45 0.85 -0.36 0.00 0.00 0.00 175.10 176.04 1svm s PHE 472 N 1.29 2.84 0.17 5.22 0.08 0.79 -0.61 117.98 127.75 1svm s PHE 472 Ca 0.03 -0.77 -0.30 0.00 0.12 0.00 0.00 56.93 56.02 1svm s PHE 472 Cb -0.14 -4.16 -0.07 0.00 -0.57 0.00 0.00 43.02 38.07 1svm s PHE 472 CO -0.12 -1.48 0.93 -1.21 -0.10 0.00 0.00 175.22 173.25 1svm s GLU 473 N 3.38 4.75 -1.05 0.44 0.41 -1.15 -1.74 118.70 123.75 1svm s GLU 473 Ca 0.17 1.44 -0.20 0.00 -0.41 0.00 0.00 54.97 55.96 1svm s GLU 473 Cb -0.20 -3.33 0.03 0.00 -1.78 0.00 0.00 34.13 28.85 1svm s GLU 473 CO 0.08 0.37 0.64 -3.47 -0.49 0.00 0.00 175.26 172.39 1svm n ASP 474 N 2.17 -4.36 -4.70 -0.19 4.64 -1.03 -4.77 116.55 108.30 1svm n ASP 474 Ca -0.00 -1.17 -0.42 0.00 -1.38 0.00 0.00 54.79 51.82 1svm n ASP 474 Cb 0.48 -1.58 -0.03 0.00 -1.04 0.00 0.00 41.12 38.96 1svm n ASP 474 CO 0.00 0.00 0.00 -0.69 -0.82 0.00 0.00 177.20 175.69 1svm s VAL 475 N -3.30 4.86 0.03 5.18 1.01 -0.39 -4.93 120.40 122.85 1svm s VAL 475 Ca 0.28 1.97 -0.05 0.00 0.00 0.00 0.00 61.98 64.18 1svm s VAL 475 Cb -0.16 -4.28 -0.05 0.00 0.00 0.00 0.00 36.38 31.90 1svm s VAL 475 CO 0.94 0.11 0.27 -0.54 0.00 0.00 0.00 175.10 175.88 1svm s LYS 476 N 1.40 3.56 0.00 2.72 1.02 -1.26 -4.44 119.74 122.74 1svm s LYS 476 Ca 0.48 -0.13 0.00 0.00 0.02 0.00 0.00 55.97 56.35 1svm s LYS 476 Cb -0.19 -3.05 0.00 0.00 -0.52 0.00 0.00 37.83 34.06 1svm s LYS 476 CO 0.23 0.63 0.00 0.41 -0.92 0.00 0.00 175.35 175.69 1svm n GLY 477 N 0.92 4.33 0.15 -3.33 0.00 -1.26 -0.76 105.19 105.24 1svm n GLY 477 Ca -0.10 -2.10 -0.00 0.00 0.00 0.00 0.00 46.02 43.82 1svm n GLY 477 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1svm n THR 478 N -0.20 0.08 -1.75 2.61 -1.04 -1.26 -0.98 114.28 111.75 1svm n THR 478 Ca 0.00 0.41 -0.31 0.00 -2.04 0.00 0.00 64.05 62.11 1svm n THR 478 Cb 0.00 -1.47 -0.04 0.00 -1.82 0.00 0.00 70.33 67.00 1svm n THR 478 CO 0.00 0.00 0.00 -0.83 -0.64 0.00 0.00 175.07 173.60 1svm s GLY 479 N -3.10 -0.27 0.00 3.41 0.00 -1.26 -4.19 107.32 101.91 1svm s GLY 479 Ca -0.01 -0.49 0.00 0.00 0.00 0.00 0.00 44.72 44.21 1svm s GLY 479 CO 0.02 3.89 0.00 0.61 0.00 0.00 0.00 173.10 177.62 1svm n GLY 480 N 6.17 0.40 0.13 0.20 0.00 -1.26 -3.74 105.19 107.10 1svm n GLY 480 Ca 0.35 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.48 1svm n GLY 480 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1svm n GLU 481 N 0.00 0.16 0.10 1.61 0.00 -1.24 -1.69 120.64 119.58 1svm n GLU 481 Ca 0.00 0.51 -0.04 0.00 0.00 0.00 0.00 57.16 57.63 1svm n GLU 481 Cb 0.18 -1.88 0.13 0.00 0.00 0.00 0.00 31.44 29.86 1svm n GLU 481 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.13 177.90 1svm h SER 482 N 0.00 0.19 -0.76 -1.84 0.02 -1.92 -3.09 113.55 106.14 1svm h SER 482 Ca 0.00 -0.11 -0.27 0.00 -0.84 0.00 0.00 61.79 60.57 1svm h SER 482 Cb 0.20 -0.05 -0.16 0.00 0.14 0.00 0.00 62.40 62.52 1svm h SER 482 CO 0.00 0.76 0.33 0.54 -1.14 0.00 0.00 176.83 177.32 1svm n ARG 483 N -3.84 3.30 -3.07 3.45 1.74 -0.68 -4.91 116.66 112.65 1svm n ARG 483 Ca -0.02 -3.08 -0.23 0.00 -0.77 0.00 0.00 57.85 53.76 1svm n ARG 483 Cb 0.63 -2.18 0.03 0.00 -1.02 0.00 0.00 32.46 29.92 1svm n ARG 483 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 1svm n ASP 484 N -0.43 -5.79 -4.44 0.55 10.43 -1.17 -4.97 116.55 110.72 1svm n ASP 484 Ca 0.44 -0.30 -0.36 0.00 2.57 0.00 0.00 54.79 57.14 1svm n ASP 484 Cb 1.42 -4.69 -0.13 0.00 1.84 0.00 0.00 41.12 39.56 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 -6.67 3.31 0.84 0.64 1.43 -0.86 -5.03 118.68 112.35 1svm s LEU 485 Ca 0.32 -0.22 -0.12 0.00 -1.03 0.00 0.00 54.13 53.08 1svm s LEU 485 Cb -0.15 -1.86 0.10 0.00 0.03 0.00 0.00 46.19 44.31 1svm s LEU 485 CO 0.39 0.02 1.19 -2.84 0.23 0.00 0.00 176.35 175.34 1svm s PRO 486 N 1.30 1.46 0.14 1.29 0.02 -1.26 -3.69 135.00 134.26 1svm s PRO 486 Ca 0.04 1.68 -0.03 0.00 0.02 0.00 0.00 61.00 62.71 1svm s PRO 486 Cb -0.15 -1.76 -0.05 0.00 0.02 0.00 0.00 34.50 32.56 1svm s PRO 486 CO 0.02 -2.33 0.36 -1.12 -0.33 0.00 0.00 177.00 173.60 1svm s SER 487 N -2.34 6.45 0.34 2.53 0.01 -1.26 -4.66 113.70 114.77 1svm s SER 487 Ca 0.71 0.50 -0.11 0.00 1.31 0.00 0.00 55.95 58.36 1svm s SER 487 Cb -0.27 -2.06 0.03 0.00 0.21 0.00 0.00 66.02 63.94 1svm s SER 487 CO 0.53 0.05 0.63 -0.83 0.41 0.00 0.00 173.24 174.03 1svm s GLY 488 N -2.60 0.75 0.00 3.44 0.00 -0.15 -4.96 107.32 103.80 1svm s GLY 488 Ca 0.40 -1.01 0.22 0.00 0.00 0.00 0.00 44.72 44.33 1svm s GLY 488 CO 0.26 -0.58 1.18 -1.06 0.00 0.00 0.00 173.10 172.90 1svm n GLN 489 N -0.52 1.97 -0.21 2.90 1.13 -1.26 -4.17 117.38 117.23 1svm n GLN 489 Ca -0.04 -1.76 -0.05 0.00 -1.94 0.00 0.00 57.00 53.21 1svm n GLN 489 Cb 0.61 -1.41 0.00 0.00 0.11 0.00 0.00 30.24 29.55 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 4.23 -0.14 0.97 1.08 0.00 -1.56 0.29 103.07 107.95 1svm h GLY 490 Ca 0.00 0.45 -0.02 0.00 0.00 0.00 0.00 47.33 47.75 1svm h GLY 490 CO 0.00 -0.20 0.20 -2.22 0.00 0.00 0.00 176.54 174.32 1svm h ILE 491 N -0.16 1.20 -0.93 2.60 1.08 -1.21 -0.98 117.51 119.11 1svm h ILE 491 Ca 0.23 -0.61 0.01 0.00 -0.39 0.00 0.00 64.86 64.10 1svm h ILE 491 Cb 0.55 0.71 -0.05 0.00 -3.07 0.00 0.00 36.82 34.97 1svm h ILE 491 CO -0.69 0.23 0.61 0.78 -0.69 0.00 0.00 178.15 178.40 1svm h ASN 492 N 0.63 1.06 -0.24 1.72 2.35 -1.58 -1.15 115.58 118.38 1svm h ASN 492 Ca 0.16 -0.03 -0.01 0.00 -0.55 0.00 0.00 56.30 55.87 1svm h ASN 492 Cb 0.17 -0.27 -0.01 0.00 0.05 0.00 0.00 38.32 38.26 1svm h ASN 492 CO -0.02 0.77 0.11 0.78 -1.65 0.00 0.00 177.43 177.42 1svm h ASN 493 N 1.26 0.32 -0.58 5.81 2.35 0.16 -2.35 115.58 122.55 1svm h ASN 493 Ca 0.34 -0.14 -0.02 0.00 -0.55 0.00 0.00 56.30 55.92 1svm h ASN 493 Cb -0.15 -0.08 -0.03 0.00 0.05 0.00 0.00 38.32 38.11 1svm h ASN 493 CO -0.07 0.38 0.29 -0.07 -1.65 0.00 0.00 177.43 176.30 1svm h LEU 494 N 0.25 0.78 -1.00 1.61 3.38 -0.78 -0.88 115.31 118.67 1svm h LEU 494 Ca 0.08 -0.08 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1svm h LEU 494 Cb 0.15 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 40.70 1svm h LEU 494 CO -0.01 0.66 0.00 -0.78 0.09 0.00 0.00 178.44 178.40 1svm h ASP 495 N 0.86 0.00 -0.01 -0.43 1.82 -0.90 -0.09 116.42 117.67 1svm h ASP 495 Ca 0.21 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.85 1svm h ASP 495 Cb 0.09 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.10 1svm h ASP 495 CO -0.03 0.00 -0.01 0.59 -1.61 0.00 0.00 179.24 178.18 1svm n ASN 496 N -2.45 1.94 -1.86 2.28 3.02 -0.35 -4.09 115.26 113.74 1svm n ASN 496 Ca 0.01 -1.63 -0.21 0.00 -0.03 0.00 0.00 54.58 52.72 1svm n ASN 496 Cb 0.23 0.01 0.05 0.00 -0.61 0.00 0.00 39.78 39.46 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 0.50 4.92 -0.33 3.41 4.77 -0.05 -4.82 117.00 125.40 1svm n LEU 497 Ca 0.17 -4.58 0.01 0.00 -0.03 0.00 0.00 56.01 51.58 1svm n LEU 497 Cb 0.43 -0.43 0.18 0.00 -2.33 0.00 0.00 43.42 41.26 1svm n LEU 497 CO 0.16 1.94 1.27 0.03 -1.33 0.00 0.00 177.39 179.47 1svm h ARG 498 N 1.99 1.16 0.00 3.23 3.08 -1.71 -0.65 114.38 121.48 1svm h ARG 498 Ca 0.35 -0.07 0.00 0.00 0.07 0.00 0.00 59.98 60.33 1svm h ARG 498 Cb 1.42 -0.26 0.00 0.00 0.08 0.00 0.00 29.97 31.21 1svm h ARG 498 CO 0.74 0.77 0.00 0.38 -1.07 0.00 0.00 179.97 180.79 1svm h ASP 499 N 1.19 0.00 0.00 7.04 -0.00 -1.93 0.06 116.42 122.79 1svm h ASP 499 Ca 0.37 0.00 -0.01 0.00 -0.00 0.00 0.00 57.03 57.39 1svm h ASP 499 Cb -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 39.33 39.33 1svm h ASP 499 CO -0.11 0.00 -0.04 1.88 -0.00 0.00 0.00 179.24 180.97 1svm h TYR 500 N 0.00 0.04 -0.31 4.15 -1.99 -1.49 -3.19 116.97 114.18 1svm h TYR 500 Ca 0.00 -0.02 -0.11 0.00 2.00 0.00 0.00 58.73 60.60 1svm h TYR 500 Cb 0.43 -0.00 -0.01 0.00 2.00 0.00 0.00 36.73 39.15 1svm h TYR 500 CO 0.00 0.91 -0.25 -0.07 -0.00 0.00 0.00 178.16 178.75 1svm h LEU 501 N -0.85 0.61 -0.13 3.88 3.38 -1.26 -3.23 115.31 117.71 1svm h LEU 501 Ca -0.01 -0.22 0.03 0.00 0.09 0.00 0.00 57.88 57.78 1svm h LEU 501 Cb 0.92 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 41.48 1svm h LEU 501 CO 0.01 0.85 -0.06 0.44 0.09 0.00 0.00 178.44 179.76 1svm h ASP 502 N 0.53 -0.21 -0.58 -0.43 3.45 -1.10 -3.42 116.42 114.66 1svm h ASP 502 Ca 0.07 0.05 -0.15 0.00 0.43 0.00 0.00 57.03 57.43 1svm h ASP 502 Cb 0.71 0.12 -0.05 0.00 -0.56 0.00 0.00 39.33 39.56 1svm h ASP 502 CO 0.05 -0.09 -0.16 0.61 -1.57 0.00 0.00 179.24 178.09 1svm n GLY 503 N -1.20 0.69 0.09 2.75 0.00 -1.20 -0.42 105.19 105.90 1svm n GLY 503 Ca -0.04 -0.66 -0.14 0.00 0.00 0.00 0.00 46.02 45.18 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 0.70 1.86 -4.95 1.61 7.64 -1.26 -4.69 113.62 114.52 1svm n SER 504 Ca -0.08 0.49 -0.24 0.00 1.01 0.00 0.00 58.87 60.06 1svm n SER 504 Cb 0.35 -0.88 -0.02 0.00 -1.01 0.00 0.00 64.21 62.64 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 -2.40 5.26 0.28 0.44 -7.23 -1.26 -5.05 120.40 110.44 1svm s VAL 505 Ca -0.24 -0.77 -0.28 0.00 -1.81 0.00 0.00 61.98 58.87 1svm s VAL 505 Cb 0.05 -3.81 -0.09 0.00 0.56 0.00 0.00 36.38 33.09 1svm s VAL 505 CO 0.40 -0.25 0.97 -0.54 -0.31 0.00 0.00 175.10 175.37 1svm s LYS 506 N -3.69 4.69 0.38 4.82 1.02 -1.26 -4.63 119.74 121.07 1svm s LYS 506 Ca 0.35 1.49 0.08 0.00 0.02 0.00 0.00 55.97 57.91 1svm s LYS 506 Cb -0.10 -3.07 -0.02 0.00 -0.52 0.00 0.00 37.83 34.13 1svm s LYS 506 CO 0.29 0.35 0.37 0.08 -0.92 0.00 0.00 175.35 175.53 1svm s VAL 507 N -1.34 3.16 -0.42 3.17 1.01 0.14 -4.79 120.40 121.32 1svm s VAL 507 Ca 0.46 -1.29 -0.06 0.00 0.00 0.00 0.00 61.98 61.09 1svm s VAL 507 Cb -0.24 -3.11 0.10 0.00 0.00 0.00 0.00 36.38 33.13 1svm s VAL 507 CO 0.31 -0.08 0.25 0.20 0.00 0.00 0.00 175.10 175.77 1svm s ASN 508 N -4.10 5.45 -0.00 3.32 -0.87 -1.26 -1.06 114.94 116.41 1svm s ASN 508 Ca 0.46 -1.86 -0.12 0.00 -1.57 0.00 0.00 52.86 49.77 1svm s ASN 508 Cb -0.05 -1.91 -0.05 0.00 -0.02 0.00 0.00 41.25 39.21 1svm s ASN 508 CO 0.28 -0.58 0.36 -0.76 -2.57 0.00 0.00 177.10 173.83 1svm s LEU 509 N 1.27 4.43 -0.13 0.60 1.02 1.00 -4.98 118.68 121.90 1svm s LEU 509 Ca 0.06 0.83 0.01 0.00 0.02 0.00 0.00 54.13 55.05 1svm s LEU 509 Cb -0.24 -2.59 0.02 0.00 0.02 0.00 0.00 46.19 43.41 1svm s LEU 509 CO -0.02 0.31 -0.14 -1.83 0.02 0.00 0.00 176.35 174.69 1svm s GLU 510 N -1.27 2.18 -0.41 1.70 -1.05 -1.26 -0.91 118.70 117.69 1svm s GLU 510 Ca 0.24 -0.53 0.06 0.00 -0.15 0.00 0.00 54.97 54.59 1svm s GLU 510 Cb -0.15 -1.95 0.20 0.00 -0.44 0.00 0.00 34.13 31.78 1svm s GLU 510 CO 0.13 -0.16 0.42 1.17 0.95 0.00 0.00 175.26 177.77 1svm n LYS 511 N 4.53 0.38 0.00 -4.83 4.81 -1.15 -4.08 118.16 117.82 1svm n LYS 511 Ca -0.17 -3.15 0.00 0.00 -0.87 0.00 0.00 58.31 54.11 1svm n LYS 511 Cb 0.51 -1.50 0.00 0.00 0.02 0.00 0.00 35.03 34.06 1svm n LYS 511 CO 0.00 0.00 0.00 1.17 1.17 0.00 0.00 177.40 179.74 1svm n LYS 512 N 2.32 0.00 -1.86 1.64 0.00 -1.26 -4.87 118.16 114.13 1svm n LYS 512 Ca 0.26 0.00 -0.17 0.00 0.00 0.00 0.00 58.31 58.40 1svm n LYS 512 Cb 0.50 0.00 -0.05 0.00 0.00 0.00 0.00 35.03 35.49 1svm n LYS 512 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.40 178.98 1svm n HIS 513 N 0.00 -0.36 -3.52 5.64 -0.00 -1.26 -4.94 115.22 110.79 1svm n HIS 513 Ca 0.00 0.00 -0.12 0.00 -0.00 0.00 0.00 57.72 57.60 1svm n HIS 513 Cb 0.00 -3.17 -0.04 0.00 -0.00 0.00 0.00 29.99 26.78 1svm n HIS 513 CO 0.00 0.00 0.00 -0.48 -0.00 0.00 0.00 176.34 175.86 1svm s LEU 514 N -4.36 -0.46 -0.07 0.27 0.05 -1.26 -5.12 118.68 107.74 1svm s LEU 514 Ca 0.00 0.28 -0.29 0.00 0.05 0.00 0.00 54.13 54.17 1svm s LEU 514 Cb 0.00 2.16 -0.07 0.00 -2.05 0.00 0.00 46.19 46.23 1svm s LEU 514 CO 0.00 -0.58 2.07 0.20 -0.55 0.00 0.00 176.35 177.49 1svm s ASN 515 N -1.82 6.04 -0.06 1.48 -0.87 -1.26 -2.93 114.94 115.52 1svm s ASN 515 Ca -0.01 2.35 0.11 0.00 -1.57 0.00 0.00 52.86 53.74 1svm s ASN 515 Cb -0.01 -2.52 -0.16 0.00 -0.02 0.00 0.00 41.25 38.54 1svm s ASN 515 CO -0.02 -1.43 0.16 1.17 -2.57 0.00 0.00 177.10 174.41 1svm n LYS 516 N 8.04 1.20 -3.64 -0.60 4.81 -0.72 -4.92 118.16 122.33 1svm n LYS 516 Ca 0.24 -0.06 -0.07 0.00 -0.87 0.00 0.00 58.31 57.55 1svm n LYS 516 Cb 0.43 -1.29 -0.07 0.00 0.02 0.00 0.00 35.03 34.12 1svm n LYS 516 CO 0.00 0.00 0.00 0.50 1.17 0.00 0.00 177.40 179.07 1svm s ARG 517 N -2.57 0.62 -0.34 1.64 3.52 -0.09 -5.00 118.95 116.73 1svm s ARG 517 Ca -0.05 0.95 -0.12 0.00 -0.13 0.00 0.00 55.73 56.38 1svm s ARG 517 Cb 0.06 0.18 -0.01 0.00 -1.56 0.00 0.00 34.95 33.62 1svm s ARG 517 CO 0.48 -0.11 0.23 0.99 -0.81 0.00 0.00 175.30 176.08 1svm s THR 518 N 1.16 5.11 0.23 4.11 2.01 -1.26 -0.00 115.64 126.99 1svm s THR 518 Ca -0.06 -0.32 -0.15 0.00 0.31 0.00 0.00 61.69 61.46 1svm s THR 518 Cb -0.05 -3.65 0.01 0.00 0.01 0.00 0.00 72.50 68.82 1svm s THR 518 CO -0.13 -0.03 0.51 0.00 -0.69 0.00 0.00 174.62 174.28 1svm s GLN 519 N 1.69 1.50 0.04 4.92 -2.07 -0.22 -4.88 119.66 120.64 1svm s GLN 519 Ca 0.05 -1.09 -0.31 0.00 -1.82 0.00 0.00 55.36 52.20 1svm s GLN 519 Cb -0.18 0.50 -0.06 0.00 -1.09 0.00 0.00 33.01 32.18 1svm s GLN 519 CO 0.09 -0.63 1.28 0.42 -1.32 0.00 0.00 175.29 175.14 1svm s ILE 520 N -3.96 3.84 0.48 3.63 -1.09 -1.26 0.25 121.20 123.09 1svm s ILE 520 Ca 0.16 1.28 -0.23 0.00 -2.23 0.00 0.00 60.65 59.63 1svm s ILE 520 Cb -0.01 -3.82 -0.07 0.00 -1.58 0.00 0.00 42.46 36.98 1svm s ILE 520 CO 0.04 0.06 1.30 0.12 -1.23 0.00 0.00 174.94 175.24 1svm s PHE 521 N 1.53 2.57 0.64 3.97 5.36 -1.26 -4.92 117.98 125.87 1svm s PHE 521 Ca 0.61 1.41 -0.17 0.00 -0.96 0.00 0.00 56.93 57.82 1svm s PHE 521 Cb -0.31 -3.67 -0.01 0.00 -0.34 0.00 0.00 43.02 38.69 1svm s PHE 521 CO 0.28 -2.37 1.17 -2.14 -1.46 0.00 0.00 175.22 170.70 1svm s PRO 522 N -2.66 2.77 1.06 10.12 0.02 -1.26 -4.76 135.00 140.29 1svm s PRO 522 Ca 0.65 1.67 -0.18 0.00 0.02 0.00 0.00 61.00 63.16 1svm s PRO 522 Cb -0.37 -1.92 0.25 0.00 0.02 0.00 0.00 34.50 32.48 1svm s PRO 522 CO 0.45 -1.33 1.28 -0.35 -0.33 0.00 0.00 177.00 176.73 1svm n PRO 523 N -2.04 -1.82 0.00 5.54 -0.04 -1.26 -4.61 135.00 130.76 1svm n PRO 523 Ca 0.12 -1.99 0.00 0.00 -0.04 0.00 0.00 63.50 61.60 1svm n PRO 523 Cb 0.51 -1.46 0.00 0.00 -0.04 0.00 0.00 33.50 32.51 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 -4.06 -0.59 3.19 0.55 0.00 -0.85 -1.04 105.19 102.38 1svm n GLY 524 Ca 0.16 -0.57 -0.17 0.00 0.00 0.00 0.00 46.02 45.44 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 1.10 -0.06 -0.61 1.01 -0.28 -1.96 121.20 116.41 1svm s ILE 525 Ca 0.00 -1.51 0.01 0.00 0.00 0.00 0.00 60.65 59.16 1svm s ILE 525 Cb 0.00 -1.26 0.02 0.00 0.01 0.00 0.00 42.46 41.22 1svm s ILE 525 CO 0.00 -0.38 -0.08 -0.69 0.00 0.00 0.00 174.94 173.79 1svm s VAL 526 N -1.85 0.86 0.03 2.92 1.01 -0.64 -0.15 120.40 122.59 1svm s VAL 526 Ca 0.03 -0.31 0.07 0.00 0.00 0.00 0.00 61.98 61.78 1svm s VAL 526 Cb -0.07 -0.83 -0.03 0.00 0.00 0.00 0.00 36.38 35.45 1svm s VAL 526 CO 0.02 0.30 -0.20 0.42 0.00 0.00 0.00 175.10 175.63 1svm s THR 527 N 0.86 2.61 0.19 3.92 -4.23 -0.71 -0.12 115.64 118.16 1svm s THR 527 Ca -0.11 -1.21 -0.23 0.00 -1.18 0.00 0.00 61.69 58.95 1svm s THR 527 Cb -0.15 -2.07 0.05 0.00 1.34 0.00 0.00 72.50 71.67 1svm s THR 527 CO 0.01 0.37 0.79 0.00 -0.54 0.00 0.00 174.62 175.25 1svm s MET 528 N -1.31 1.43 -0.67 3.99 0.23 -0.41 -1.27 119.30 121.30 1svm s MET 528 Ca 0.13 -0.74 -0.03 0.00 -1.03 0.00 0.00 55.69 54.03 1svm s MET 528 Cb -0.10 0.52 0.18 0.00 -1.53 0.00 0.00 34.83 33.90 1svm s MET 528 CO 0.04 -0.65 2.45 0.09 -2.03 0.00 0.00 175.02 174.91 1svm n ASN 529 N -0.43 6.98 -3.52 -1.18 5.03 -1.26 -2.29 115.26 118.59 1svm n ASN 529 Ca -0.07 -3.45 -0.19 0.00 0.87 0.00 0.00 54.58 51.73 1svm n ASN 529 Cb 0.61 -1.18 0.07 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 0.36 -6.37 -2.71 3.52 1.02 -1.26 -4.86 120.64 110.34 1svm n GLU 530 Ca 0.51 0.79 -0.21 0.00 -0.02 0.00 0.00 57.16 58.24 1svm n GLU 530 Cb 0.41 -5.71 0.04 0.00 -0.02 0.00 0.00 31.44 26.16 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 -3.42 2.64 0.41 -0.32 1.51 -1.26 -4.99 117.35 111.92 1svm s TYR 531 Ca 0.09 -0.14 -0.24 0.00 -1.01 0.00 0.00 57.07 55.77 1svm s TYR 531 Cb -0.04 -2.70 -0.09 0.00 -0.11 0.00 0.00 41.96 39.03 1svm s TYR 531 CO 0.75 -0.91 1.07 -1.12 -1.11 0.00 0.00 175.55 174.23 1svm s SER 532 N -4.46 6.66 -0.15 2.29 0.01 -1.25 -5.03 113.70 111.77 1svm s SER 532 Ca 0.58 2.10 0.00 0.00 1.31 0.00 0.00 55.95 59.94 1svm s SER 532 Cb -0.10 -2.59 0.02 0.00 0.21 0.00 0.00 66.02 63.57 1svm s SER 532 CO 0.38 -0.56 -0.15 -0.69 0.41 0.00 0.00 173.24 172.63 1svm s VAL 533 N -1.63 1.60 0.42 3.43 1.01 -1.26 -4.84 120.40 119.13 1svm s VAL 533 Ca 0.58 -0.66 -0.25 0.00 0.00 0.00 0.00 61.98 61.66 1svm s VAL 533 Cb -0.23 -1.50 -0.10 0.00 0.00 0.00 0.00 36.38 34.55 1svm s VAL 533 CO 0.29 0.46 1.24 -2.65 0.00 0.00 0.00 175.10 174.45 1svm n PRO 534 N 4.73 1.87 -0.16 2.72 -0.02 -1.26 -4.75 135.00 138.12 1svm n PRO 534 Ca -0.17 0.66 0.06 0.00 -2.02 0.00 0.00 63.50 62.03 1svm n PRO 534 Cb 0.50 -2.34 0.36 0.00 -0.02 0.00 0.00 33.50 32.01 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 2.04 0.71 -0.83 -0.52 2.10 -1.99 -0.19 116.57 117.89 1svm h LYS 535 Ca -0.47 -0.04 0.01 0.00 -2.00 0.00 0.00 60.65 58.14 1svm h LYS 535 Cb 1.30 -0.16 -0.04 0.00 -0.90 0.00 0.00 32.23 32.43 1svm h LYS 535 CO 0.60 0.47 0.54 1.79 -2.00 0.00 0.00 179.45 180.85 1svm h THR 536 N 0.73 1.21 0.13 0.07 1.35 -2.00 -1.55 112.91 112.85 1svm h THR 536 Ca 0.29 -0.39 -0.28 0.00 -0.55 0.00 0.00 66.41 65.48 1svm h THR 536 Cb 0.23 0.00 0.03 0.00 -1.73 0.00 0.00 68.15 66.68 1svm h THR 536 CO -0.09 0.21 -1.19 0.25 -0.25 0.00 0.00 175.52 174.44 1svm h LEU 537 N 1.12 0.82 -1.59 3.87 5.85 -1.60 -3.27 115.31 120.51 1svm h LEU 537 Ca 0.30 -0.84 0.05 0.00 0.84 0.00 0.00 57.88 58.23 1svm h LEU 537 Cb -0.12 -0.26 -0.03 0.00 0.37 0.00 0.00 40.66 40.62 1svm h LEU 537 CO -0.06 1.58 0.36 -0.61 -0.34 0.00 0.00 178.44 179.36 1svm h GLN 538 N 0.18 0.49 0.00 1.25 5.75 -0.75 -0.14 115.11 121.89 1svm h GLN 538 Ca -0.19 -0.03 0.00 0.00 -0.15 0.00 0.00 58.65 58.28 1svm h GLN 538 Cb 1.88 -0.11 0.00 0.00 1.07 0.00 0.00 27.48 30.32 1svm h GLN 538 CO 0.23 0.33 0.00 0.00 -2.65 0.00 0.00 178.83 176.73 1svm n ALA 539 N -2.49 1.26 0.70 3.38 0.00 -0.61 -1.13 120.51 121.61 1svm n ALA 539 Ca 0.07 0.13 0.12 0.00 0.00 0.00 0.00 53.44 53.76 1svm n ALA 539 Cb 0.22 -1.30 0.14 0.00 0.00 0.00 0.00 19.45 18.52 1svm n ALA 539 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1svm n ARG 540 N -2.12 0.20 -3.36 0.00 3.00 -0.06 -4.77 116.66 109.55 1svm n ARG 540 Ca 0.00 0.03 -0.43 0.00 -0.01 0.00 0.00 57.85 57.44 1svm n ARG 540 Cb 0.10 -1.60 -0.09 0.00 0.00 0.00 0.00 32.46 30.86 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 -3.13 3.19 -0.29 -1.55 2.99 -0.28 -3.71 117.98 115.19 1svm s PHE 541 Ca 0.07 -0.44 0.27 0.00 0.00 0.00 0.00 56.93 56.83 1svm s PHE 541 Cb 0.15 -2.82 0.79 0.00 0.00 0.00 0.00 43.02 41.14 1svm s PHE 541 CO 0.74 -0.68 1.76 -0.24 -0.00 0.00 0.00 175.22 176.81 1svm h VAL 542 N 5.70 0.00 -2.76 -0.44 3.04 -1.31 -3.45 116.25 117.03 1svm h VAL 542 Ca -0.27 -0.72 -0.12 0.00 -1.01 0.00 0.00 66.70 64.59 1svm h VAL 542 Cb 1.11 1.70 -0.23 0.00 -2.01 0.00 0.00 31.29 31.87 1svm h VAL 542 CO 0.78 0.00 -0.22 -0.75 -1.01 0.00 0.00 177.57 176.37 1svm s LYS 543 N -3.36 0.56 -0.06 4.17 2.20 -1.24 -5.07 119.74 116.94 1svm s LYS 543 Ca 0.05 0.38 0.03 0.00 -0.36 0.00 0.00 55.97 56.08 1svm s LYS 543 Cb 0.07 0.26 0.00 0.00 -1.51 0.00 0.00 37.83 36.66 1svm s LYS 543 CO 0.60 -0.10 -0.16 -1.14 -0.36 0.00 0.00 175.35 174.18 1svm s GLN 544 N -0.22 1.99 -0.15 4.03 0.74 -1.26 -0.59 119.66 124.21 1svm s GLN 544 Ca -0.04 -0.58 0.02 0.00 0.05 0.00 0.00 55.36 54.81 1svm s GLN 544 Cb -0.03 -1.63 0.01 0.00 1.10 0.00 0.00 33.01 32.45 1svm s GLN 544 CO 0.02 0.15 -0.21 0.42 -0.55 0.00 0.00 175.29 175.12 1svm s ILE 545 N 0.34 2.16 -0.36 -2.34 1.01 0.63 -4.95 121.20 117.69 1svm s ILE 545 Ca -0.11 -0.94 -0.16 0.00 0.00 0.00 0.00 60.65 59.44 1svm s ILE 545 Cb -0.14 -1.87 -0.01 0.00 0.01 0.00 0.00 42.46 40.45 1svm s ILE 545 CO 0.04 0.54 0.37 -1.81 0.00 0.00 0.00 174.94 174.09 1svm s ASP 546 N 0.86 6.18 0.23 3.58 1.01 -1.26 -1.27 116.67 126.00 1svm s ASP 546 Ca -0.06 -0.32 -0.20 0.00 0.71 0.00 0.00 52.55 52.68 1svm s ASP 546 Cb -0.15 -2.20 -0.08 0.00 1.01 0.00 0.00 42.92 41.49 1svm s ASP 546 CO -0.03 -0.38 0.74 -0.36 0.21 0.00 0.00 175.17 175.35 1svm s PHE 547 N 2.03 3.65 -0.07 4.23 0.40 0.38 -4.98 117.98 123.61 1svm s PHE 547 Ca 0.12 1.41 0.01 0.00 -0.60 0.00 0.00 56.93 57.87 1svm s PHE 547 Cb -0.17 -2.64 0.02 0.00 0.51 0.00 0.00 43.02 40.74 1svm s PHE 547 CO 0.12 0.32 -0.09 1.03 0.70 0.00 0.00 175.22 177.30 1svm s ARG 548 N -2.00 1.39 0.45 0.44 0.52 -1.26 -4.29 118.95 114.21 1svm s ARG 548 Ca 0.44 -0.28 -0.25 0.00 -0.52 0.00 0.00 55.73 55.12 1svm s ARG 548 Cb -0.17 -1.26 -0.08 0.00 0.52 0.00 0.00 34.95 33.97 1svm s ARG 548 CO 0.21 -0.06 1.35 -2.14 0.02 0.00 0.00 175.30 174.68 1svm s PRO 549 N 0.94 3.71 -0.08 3.54 0.02 -1.26 -4.91 135.00 136.96 1svm s PRO 549 Ca -0.10 2.25 -0.00 0.00 0.02 0.00 0.00 61.00 63.17 1svm s PRO 549 Cb -0.15 -2.61 0.02 0.00 0.02 0.00 0.00 34.50 31.79 1svm s PRO 549 CO 0.00 -0.74 -0.04 0.15 -0.33 0.00 0.00 177.00 176.05 1svm s LYS 550 N -2.46 1.00 0.20 5.54 1.02 -1.26 -5.05 119.74 118.72 1svm s LYS 550 Ca 0.61 -0.08 -0.14 0.00 0.02 0.00 0.00 55.97 56.39 1svm s LYS 550 Cb -0.40 -1.15 0.20 0.00 -0.52 0.00 0.00 37.83 35.97 1svm s LYS 550 CO 0.51 -0.22 1.65 -0.44 -0.92 0.00 0.00 175.35 175.93 1svm h ASP 551 N 7.93 -0.42 -0.33 2.83 3.32 -2.00 -1.90 116.42 125.85 1svm h ASP 551 Ca -0.27 0.15 -0.03 0.00 0.02 0.00 0.00 57.03 56.90 1svm h ASP 551 Cb 1.14 0.31 -0.02 0.00 0.22 0.00 0.00 39.33 40.97 1svm h ASP 551 CO 0.36 -0.15 0.11 0.10 -1.72 0.00 0.00 179.24 177.94 1svm h TYR 552 N 0.04 0.59 -0.55 4.55 -0.00 -1.87 0.15 116.97 119.88 1svm h TYR 552 Ca 0.27 -0.03 -0.05 0.00 0.00 0.00 0.00 58.73 58.92 1svm h TYR 552 Cb 0.42 -0.18 -0.02 0.00 0.00 0.00 0.00 36.73 36.95 1svm h TYR 552 CO -0.42 0.50 0.17 -0.07 -0.00 0.00 0.00 178.16 178.35 1svm h LEU 553 N 0.58 0.81 -0.06 0.10 3.38 -1.57 0.32 115.31 118.87 1svm h LEU 553 Ca 0.14 -0.21 -0.01 0.00 0.09 0.00 0.00 57.88 57.89 1svm h LEU 553 Cb 0.20 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 40.73 1svm h LEU 553 CO -0.01 0.81 0.01 0.50 0.09 0.00 0.00 178.44 179.84 1svm h LYS 554 N 0.77 0.09 -0.50 1.13 3.64 -0.89 -1.86 116.57 118.96 1svm h LYS 554 Ca 0.18 -0.03 -0.04 0.00 -1.27 0.00 0.00 60.65 59.50 1svm h LYS 554 Cb 0.29 -0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 32.07 1svm h LYS 554 CO -0.00 0.33 0.16 0.45 -2.27 0.00 0.00 179.45 178.11 1svm h HIS 555 N -0.16 0.74 -0.45 1.91 3.86 -0.54 -1.73 115.15 118.79 1svm h HIS 555 Ca 0.02 -0.05 -0.03 0.00 -1.16 0.00 0.00 60.37 59.15 1svm h HIS 555 Cb 0.28 -0.23 -0.02 0.00 1.06 0.00 0.00 27.41 28.51 1svm h HIS 555 CO 0.02 0.61 0.17 0.00 0.86 0.00 0.00 177.93 179.59 1svm h LEU 557 N 0.59 0.67 -1.57 0.00 4.07 -0.81 -0.45 115.31 117.81 1svm h LEU 557 Ca 0.15 -0.08 0.04 0.00 0.08 0.00 0.00 57.88 58.07 1svm h LEU 557 Cb 0.21 -0.17 -0.03 0.00 1.08 0.00 0.00 40.66 41.75 1svm h LEU 557 CO -0.01 0.60 0.34 -0.33 -1.08 0.00 0.00 178.44 177.96 1svm h GLU 558 N 0.74 0.54 -0.42 1.13 5.08 -1.00 -1.43 114.58 119.22 1svm h GLU 558 Ca 0.18 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.51 1svm h GLU 558 Cb 0.14 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.27 1svm h GLU 558 CO -0.02 0.36 0.00 0.54 -1.00 0.00 0.00 179.01 178.89 1svm n ARG 559 N -4.47 2.43 -2.62 2.33 1.74 -0.78 -4.37 116.66 110.91 1svm n ARG 559 Ca 0.06 -2.22 -0.12 0.00 -0.77 0.00 0.00 57.85 54.80 1svm n ARG 559 Cb 0.17 -1.45 0.03 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 1.27 2.30 -0.38 0.55 7.64 -0.25 -4.45 113.62 120.30 1svm n SER 560 Ca 0.18 -2.85 0.31 0.00 1.01 0.00 0.00 58.87 57.52 1svm n SER 560 Cb 0.55 -0.50 0.61 0.00 -1.01 0.00 0.00 64.21 63.86 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 2.80 0.21 -0.27 1.43 5.08 -1.65 -1.23 114.58 120.94 1svm h GLU 561 Ca -0.00 -0.01 0.08 0.00 -1.00 0.00 0.00 59.36 58.42 1svm h GLU 561 Cb 1.17 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 30.36 1svm h GLU 561 CO 0.53 0.14 0.27 0.27 -1.00 0.00 0.00 179.01 179.21 1svm h PHE 562 N 0.21 0.00 0.00 4.33 -5.15 -1.92 -0.91 116.94 113.50 1svm h PHE 562 Ca 0.68 0.00 -0.04 0.00 -0.20 0.00 0.00 57.97 58.41 1svm h PHE 562 Cb 2.07 0.00 -0.01 0.00 0.22 0.00 0.00 35.95 38.23 1svm h PHE 562 CO -0.00 0.00 -0.17 -0.07 -2.00 0.00 0.00 178.31 176.06 1svm h LEU 563 N 0.00 0.00 0.00 2.10 3.38 -1.58 -1.26 115.31 117.95 1svm h LEU 563 Ca 0.13 0.00 -0.42 0.00 0.09 0.00 0.00 57.88 57.67 1svm h LEU 563 Cb 0.66 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 41.34 1svm h LEU 563 CO -0.00 0.17 -2.47 0.18 0.09 0.00 0.00 178.44 176.41 1svm n LEU 564 N -3.94 2.43 -0.26 1.67 4.77 -0.45 -1.31 117.00 119.92 1svm n LEU 564 Ca -0.02 0.12 0.04 0.00 -0.03 0.00 0.00 56.01 56.12 1svm n LEU 564 Cb 0.26 -0.87 0.27 0.00 -2.33 0.00 0.00 43.42 40.74 1svm n LEU 564 CO 0.33 0.74 1.24 -0.33 -1.33 0.00 0.00 177.39 178.04 1svm h GLU 565 N -0.52 0.94 -0.55 3.23 5.08 -1.31 -0.40 114.58 121.04 1svm h GLU 565 Ca -0.63 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 57.67 1svm h GLU 565 Cb 1.75 -0.21 0.00 0.00 0.50 0.00 0.00 28.75 30.79 1svm h GLU 565 CO -0.26 0.62 0.00 1.63 -1.00 0.00 0.00 179.01 180.00 1svm n LYS 566 N -4.47 2.41 -3.83 2.33 5.02 -0.48 -4.96 118.16 114.17 1svm n LYS 566 Ca 0.12 -2.17 -0.29 0.00 -2.02 0.00 0.00 58.31 53.95 1svm n LYS 566 Cb 0.18 -1.48 0.01 0.00 -0.02 0.00 0.00 35.03 33.72 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 1.29 -2.35 -0.08 1.97 1.74 -0.16 -4.94 116.66 114.12 1svm n ARG 567 Ca 0.20 0.42 -0.22 0.00 -0.77 0.00 0.00 57.85 57.49 1svm n ARG 567 Cb 0.53 -4.29 -0.12 0.00 -1.02 0.00 0.00 32.46 27.56 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 -1.91 0.90 0.00 0.55 2.04 -1.44 -3.34 117.51 114.31 1svm h ILE 568 Ca -0.65 -2.22 0.00 0.00 1.00 0.00 0.00 64.86 63.00 1svm h ILE 568 Cb 1.37 2.31 0.00 0.00 -0.74 0.00 0.00 36.82 39.76 1svm h ILE 568 CO 0.56 0.42 0.00 2.30 0.00 0.00 0.00 178.15 181.43 1svm n ILE 569 N -4.28 0.92 -0.46 -0.67 -5.35 -1.16 -1.65 119.36 106.71 1svm n ILE 569 Ca -0.31 0.39 0.08 0.00 -0.27 0.00 0.00 62.75 62.64 1svm n ILE 569 Cb 0.74 -1.34 0.25 0.00 -1.74 0.00 0.00 39.64 37.55 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 -2.21 3.08 -3.33 6.28 10.64 -1.26 -4.73 117.38 125.86 1svm n GLN 570 Ca 0.01 -2.49 -0.38 0.00 -1.83 0.00 0.00 57.00 52.30 1svm n GLN 570 Cb 0.16 -1.57 -0.06 0.00 -0.86 0.00 0.00 30.24 27.91 1svm n GLN 570 CO 0.00 0.00 0.00 0.45 -1.83 0.00 0.00 177.06 175.68 1svm s SER 571 N -1.14 6.99 0.46 2.61 0.15 -0.66 -2.41 113.70 119.72 1svm s SER 571 Ca 0.38 1.18 0.24 0.00 0.70 0.00 0.00 55.95 58.44 1svm s SER 571 Cb 0.23 -2.33 1.13 0.00 -1.71 0.00 0.00 66.02 63.34 1svm s SER 571 CO 0.20 0.28 1.93 1.23 1.20 0.00 0.00 173.24 178.08 1svm h GLY 572 N 4.65 0.00 1.59 9.45 0.00 -1.82 -2.21 103.07 114.73 1svm h GLY 572 Ca -0.50 0.00 -0.08 0.00 0.00 0.00 0.00 47.33 46.76 1svm h GLY 572 CO 0.63 0.00 -0.15 -2.22 0.00 0.00 0.00 176.54 174.80 1svm h ILE 573 N 0.00 1.24 -0.38 2.60 1.08 -1.91 0.35 117.51 120.49 1svm h ILE 573 Ca -0.00 -1.07 -0.11 0.00 -0.39 0.00 0.00 64.86 63.29 1svm h ILE 573 Cb 0.55 1.19 -0.01 0.00 -3.07 0.00 0.00 36.82 35.48 1svm h ILE 573 CO 0.03 0.35 -0.21 0.00 -0.69 0.00 0.00 178.15 177.62 1svm h ALA 574 N 1.40 0.92 -0.19 1.87 0.00 -1.64 -1.03 119.26 120.58 1svm h ALA 574 Ca 0.08 -0.36 -0.16 0.00 0.00 0.00 0.00 54.91 54.46 1svm h ALA 574 Cb 0.53 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 1svm h ALA 574 CO 0.03 0.62 -0.56 -0.07 0.00 0.00 0.00 179.25 179.27 1svm h LEU 575 N 0.65 0.64 -0.54 0.00 3.38 -1.30 -1.81 115.31 116.33 1svm h LEU 575 Ca 0.09 -0.35 -0.11 0.00 0.09 0.00 0.00 57.88 57.61 1svm h LEU 575 Cb 0.71 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 41.26 1svm h LEU 575 CO 0.05 1.07 -0.10 0.25 0.09 0.00 0.00 178.44 179.80 1svm h LEU 576 N 0.44 1.03 -0.75 1.67 5.85 -0.70 -1.27 115.31 121.57 1svm h LEU 576 Ca 0.01 -0.35 -0.03 0.00 0.84 0.00 0.00 57.88 58.34 1svm h LEU 576 Cb 1.11 -0.28 -0.03 0.00 0.37 0.00 0.00 40.66 41.83 1svm h LEU 576 CO 0.11 1.14 0.34 -0.07 -0.34 0.00 0.00 178.44 179.61 1svm h LEU 577 N 0.90 1.00 -0.38 2.25 3.38 -1.10 -1.44 115.31 119.93 1svm h LEU 577 Ca 0.14 -0.15 0.03 0.00 0.09 0.00 0.00 57.88 57.99 1svm h LEU 577 Cb 0.67 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 41.13 1svm h LEU 577 CO 0.05 0.87 0.17 -0.03 0.09 0.00 0.00 178.44 179.59 1svm h MET 578 N 1.06 0.35 -0.89 1.13 4.05 -0.89 -0.35 114.93 119.39 1svm h MET 578 Ca 0.25 -0.02 -0.01 0.00 -0.28 0.00 0.00 59.70 59.64 1svm h MET 578 Cb 0.16 -0.08 -0.04 0.00 -0.80 0.00 0.00 31.60 30.84 1svm h MET 578 CO -0.03 0.23 0.52 -0.07 0.23 0.00 0.00 176.91 177.79 1svm h LEU 579 N 0.36 1.08 -1.04 3.39 3.38 -0.81 0.54 115.31 122.21 1svm h LEU 579 Ca 0.16 -0.08 -0.08 0.00 0.09 0.00 0.00 57.88 57.97 1svm h LEU 579 Cb 0.09 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.56 1svm h LEU 579 CO -0.13 0.84 -0.22 0.40 0.09 0.00 0.00 178.44 179.42 1svm h ILE 580 N 1.23 1.25 0.15 1.22 2.04 -0.71 0.19 117.51 122.88 1svm h ILE 580 Ca 0.32 -1.18 -0.30 0.00 1.00 0.00 0.00 64.86 64.70 1svm h ILE 580 Cb -0.03 1.32 0.02 0.00 -0.74 0.00 0.00 36.82 37.40 1svm h ILE 580 CO -0.06 0.37 -1.28 -0.25 0.00 0.00 0.00 178.15 176.93 1svm h TRP 581 N 0.38 0.82 0.00 1.37 2.91 -0.57 -3.40 115.95 117.46 1svm h TRP 581 Ca 0.06 -0.56 -0.36 0.00 1.13 0.00 0.00 58.89 59.16 1svm h TRP 581 Cb 0.61 -0.05 -0.07 0.00 -0.51 0.00 0.00 29.16 29.14 1svm h TRP 581 CO 0.02 1.41 -2.31 0.66 -1.03 0.00 0.00 178.44 177.19 1svm n TYR 582 N -3.69 0.13 -3.35 2.65 4.02 0.14 -5.01 117.16 112.05 1svm n TYR 582 Ca -0.12 0.05 -0.38 0.00 -0.01 0.00 0.00 57.90 57.43 1svm n TYR 582 Cb 1.02 -1.02 -0.06 0.00 -0.02 0.00 0.00 39.34 39.25 1svm n TYR 582 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 176.86 176.88 1svm s ARG 583 N -2.51 4.14 0.44 -0.72 1.81 0.67 -5.06 118.95 117.72 1svm s ARG 583 Ca -0.12 0.58 -0.24 0.00 -1.72 0.00 0.00 55.73 54.22 1svm s ARG 583 Cb 0.07 -3.28 -0.08 0.00 -0.45 0.00 0.00 34.95 31.21 1svm s ARG 583 CO 0.81 0.54 1.26 -1.25 -0.68 0.00 0.00 175.30 175.97 1svm s PRO 584 N -0.67 3.79 0.30 3.54 0.04 -1.26 -4.79 135.00 135.95 1svm s PRO 584 Ca 0.27 2.02 0.05 0.00 0.04 0.00 0.00 61.00 63.39 1svm s PRO 584 Cb -0.18 -2.58 0.73 0.00 0.04 0.00 0.00 34.50 32.52 1svm s PRO 584 CO 0.15 -0.59 1.76 0.28 0.04 0.00 0.00 177.00 178.64 1svm h VAL 585 N 2.13 0.66 -0.02 -0.36 2.07 -1.96 -1.86 116.25 116.91 1svm h VAL 585 Ca -0.50 -0.23 0.01 0.00 0.82 0.00 0.00 66.70 66.80 1svm h VAL 585 Cb 1.25 -0.08 -0.00 0.00 -1.52 0.00 0.00 31.29 30.94 1svm h VAL 585 CO 0.61 0.12 0.24 0.00 0.02 0.00 0.00 177.57 178.56 1svm h ALA 586 N 1.65 1.29 0.00 1.67 0.00 -1.99 -1.17 119.26 120.72 1svm h ALA 586 Ca 0.57 -0.00 -0.12 0.00 0.00 0.00 0.00 54.91 55.36 1svm h ALA 586 Cb 0.94 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.71 1svm h ALA 586 CO -0.41 -0.25 -0.57 0.93 0.00 0.00 0.00 179.25 178.95 1svm h GLU 587 N 0.00 0.00 -7.25 0.00 5.08 -1.71 -3.46 114.58 107.25 1svm h GLU 587 Ca 0.01 0.00 -0.48 0.00 -1.00 0.00 0.00 59.36 57.89 1svm h GLU 587 Cb 0.49 0.00 0.03 0.00 0.50 0.00 0.00 28.75 29.77 1svm h GLU 587 CO -0.00 0.57 0.39 -0.06 -1.00 0.00 0.00 179.01 178.91 1svm s PHE 588 N -3.01 3.50 0.27 4.33 0.40 -0.44 -4.98 117.98 118.05 1svm s PHE 588 Ca 0.03 1.41 -0.30 0.00 -0.60 0.00 0.00 56.93 57.47 1svm s PHE 588 Cb 0.08 -2.77 -0.13 0.00 0.51 0.00 0.00 43.02 40.71 1svm s PHE 588 CO 0.75 -0.50 1.32 0.00 0.70 0.00 0.00 175.22 177.49 1svm n ALA 589 N -1.99 0.91 -0.29 5.36 0.00 -1.26 -4.75 120.51 118.49 1svm n ALA 589 Ca 0.06 0.40 0.09 0.00 0.00 0.00 0.00 53.44 53.99 1svm n ALA 589 Cb 0.54 -2.23 0.24 0.00 0.00 0.00 0.00 19.45 18.00 1svm n ALA 589 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 1svm h GLN 590 N 3.48 0.45 0.00 0.00 4.20 -1.93 -0.73 115.11 120.59 1svm h GLN 590 Ca -0.45 -0.03 -0.01 0.00 0.06 0.00 0.00 58.65 58.23 1svm h GLN 590 Cb 1.29 -0.10 -0.00 0.00 0.30 0.00 0.00 27.48 28.97 1svm h GLN 590 CO 0.70 0.30 -0.05 0.66 -0.67 0.00 0.00 178.83 179.77 1svm h SER 591 N 0.46 0.00 -0.00 1.46 4.64 -2.02 -2.89 113.55 115.20 1svm h SER 591 Ca 0.48 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.80 1svm h SER 591 Cb 0.80 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.89 1svm h SER 591 CO -0.45 0.05 -0.73 0.00 -0.87 0.00 0.00 176.83 174.83 1svm n ILE 592 N -3.55 0.00 -0.27 0.95 3.06 -0.35 -4.62 119.36 114.58 1svm n ILE 592 Ca -0.02 -0.14 0.07 0.00 -2.50 0.00 0.00 62.75 60.17 1svm n ILE 592 Cb 0.16 1.01 0.22 0.00 0.54 0.00 0.00 39.64 41.57 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 0.08 0.40 -0.63 9.51 4.20 -1.14 -0.70 115.11 126.83 1svm h GLN 593 Ca 0.00 -0.02 0.08 0.00 0.06 0.00 0.00 58.65 58.77 1svm h GLN 593 Cb 0.38 -0.09 -0.06 0.00 0.30 0.00 0.00 27.48 28.01 1svm h GLN 593 CO 0.00 0.27 0.29 1.03 -0.67 0.00 0.00 178.83 179.75 1svm h SER 594 N 0.41 0.37 -0.26 1.46 0.87 -1.82 0.15 113.55 114.73 1svm h SER 594 Ca 0.46 0.06 -0.12 0.00 -1.23 0.00 0.00 61.79 60.96 1svm h SER 594 Cb 0.76 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.70 1svm h SER 594 CO -0.46 0.22 -0.25 -0.09 -0.53 0.00 0.00 176.83 175.73 1svm h ARG 595 N 0.52 0.75 -0.44 2.24 2.43 -1.49 -2.49 114.38 115.90 1svm h ARG 595 Ca 0.31 -0.31 -0.04 0.00 -0.81 0.00 0.00 59.98 59.12 1svm h ARG 595 Cb 0.31 -0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 29.81 1svm h ARG 595 CO -0.25 0.92 0.11 0.82 -1.51 0.00 0.00 179.97 180.06 1svm h ILE 596 N 0.65 1.23 -0.76 1.20 1.08 -0.07 -2.31 117.51 118.53 1svm h ILE 596 Ca 0.09 -0.79 0.06 0.00 -0.39 0.00 0.00 64.86 63.83 1svm h ILE 596 Cb 0.76 0.92 -0.06 0.00 -3.07 0.00 0.00 36.82 35.36 1svm h ILE 596 CO 0.06 0.28 0.45 0.58 -0.69 0.00 0.00 178.15 178.83 1svm h VAL 597 N 0.57 0.99 -0.87 1.67 2.07 -0.63 -0.15 116.25 119.91 1svm h VAL 597 Ca 0.14 -0.28 0.05 0.00 0.82 0.00 0.00 66.70 67.43 1svm h VAL 597 Cb 0.31 0.11 -0.06 0.00 -1.52 0.00 0.00 31.29 30.13 1svm h VAL 597 CO 0.00 0.15 0.55 -0.08 0.02 0.00 0.00 177.57 178.21 1svm h GLU 598 N 0.81 1.00 -0.00 1.57 4.81 -1.03 -1.63 114.58 120.11 1svm h GLU 598 Ca 0.34 -0.06 -0.17 0.00 -0.13 0.00 0.00 59.36 59.34 1svm h GLU 598 Cb 0.20 -0.23 -0.02 0.00 0.63 0.00 0.00 28.75 29.34 1svm h GLU 598 CO -0.19 0.66 -0.79 -1.49 -0.73 0.00 0.00 179.01 176.48 1svm h TRP 599 N 1.03 0.12 -0.63 0.92 4.06 -0.76 -2.38 115.95 118.30 1svm h TRP 599 Ca 0.37 -0.06 -0.05 0.00 2.06 0.00 0.00 58.89 61.21 1svm h TRP 599 Cb 0.11 -0.01 -0.03 0.00 -1.00 0.00 0.00 29.16 28.23 1svm h TRP 599 CO -0.02 0.83 0.21 0.87 -3.56 0.00 0.00 178.44 176.77 1svm h LYS 600 N 0.05 0.95 -0.21 0.49 1.57 -0.40 -0.36 116.57 118.67 1svm h LYS 600 Ca -0.02 -0.18 -0.16 0.00 -1.87 0.00 0.00 60.65 58.42 1svm h LYS 600 Cb 1.38 -0.15 -0.01 0.00 0.08 0.00 0.00 32.23 33.54 1svm h LYS 600 CO 0.11 0.81 -0.53 0.93 -0.57 0.00 0.00 179.45 180.20 1svm h GLU 601 N 0.93 0.61 -0.70 3.15 5.08 -1.24 -1.44 114.58 120.97 1svm h GLU 601 Ca 0.21 -0.38 -0.07 0.00 -1.00 0.00 0.00 59.36 58.12 1svm h GLU 601 Cb 0.24 0.04 -0.03 0.00 0.50 0.00 0.00 28.75 29.50 1svm h GLU 601 CO -0.01 0.99 0.15 -0.09 -1.00 0.00 0.00 179.01 179.05 1svm h ARG 602 N 0.47 1.14 -0.17 2.33 1.12 -0.93 -2.21 114.38 116.13 1svm h ARG 602 Ca 0.01 -0.29 -0.09 0.00 -1.11 0.00 0.00 59.98 58.51 1svm h ARG 602 Cb 1.08 -0.14 -0.00 0.00 -0.01 0.00 0.00 29.97 30.89 1svm h ARG 602 CO 0.10 1.01 -0.23 -0.07 -3.11 0.00 0.00 179.97 177.67 1svm h LEU 603 N 1.07 0.50 -1.65 3.80 4.07 -0.95 -3.07 115.31 119.09 1svm h LEU 603 Ca 0.22 -0.51 -0.01 0.00 0.08 0.00 0.00 57.88 57.65 1svm h LEU 603 Cb 0.40 -0.14 -0.01 0.00 1.08 0.00 0.00 40.66 41.99 1svm h LEU 603 CO 0.01 0.92 0.07 0.44 -1.08 0.00 0.00 178.44 178.79 1svm h ASP 604 N 0.11 0.26 1.03 -0.43 3.32 -1.20 0.13 116.42 119.64 1svm h ASP 604 Ca 0.02 -0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1svm h ASP 604 Cb 0.80 -0.07 0.00 0.00 0.22 0.00 0.00 39.33 40.28 1svm h ASP 604 CO 0.05 0.26 0.00 1.17 -1.72 0.00 0.00 179.24 179.01 1svm n LYS 605 N -4.43 0.18 -0.00 3.56 4.81 -0.84 -3.77 118.16 117.67 1svm n LYS 605 Ca 0.00 0.28 0.02 0.00 -0.87 0.00 0.00 58.31 57.74 1svm n LYS 605 Cb 0.13 -1.77 -0.03 0.00 0.02 0.00 0.00 35.03 33.38 1svm n LYS 605 CO 0.00 0.00 0.00 0.39 1.17 0.00 0.00 177.40 178.96 1svm n GLU 606 N -2.10 0.41 -3.65 1.64 1.02 -0.48 -4.99 120.64 112.49 1svm n GLU 606 Ca 0.04 -0.03 -0.24 0.00 -0.02 0.00 0.00 57.16 56.90 1svm n GLU 606 Cb 0.31 -1.07 -0.17 0.00 -0.02 0.00 0.00 31.44 30.49 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 -2.23 0.29 0.76 -0.32 0.40 0.32 -5.07 117.98 112.14 1svm s PHE 607 Ca -0.01 -0.21 -0.11 0.00 -0.60 0.00 0.00 56.93 56.00 1svm s PHE 607 Cb 0.03 -0.68 0.05 0.00 0.51 0.00 0.00 43.02 42.92 1svm s PHE 607 CO 0.16 -0.42 1.08 -1.54 0.70 0.00 0.00 175.22 175.20 1svm s SER 608 N 2.10 4.78 0.19 1.36 1.04 -1.26 -4.53 113.70 117.38 1svm s SER 608 Ca 0.03 1.47 -0.12 0.00 0.48 0.00 0.00 55.95 57.81 1svm s SER 608 Cb -0.15 -2.26 0.13 0.00 0.10 0.00 0.00 66.02 63.85 1svm s SER 608 CO -0.07 -1.81 1.83 -0.07 0.98 0.00 0.00 173.24 174.11 1svm h LEU 609 N -0.97 0.61 -0.45 2.42 3.38 -1.98 -2.27 115.31 116.05 1svm h LEU 609 Ca -0.46 -0.00 0.02 0.00 0.09 0.00 0.00 57.88 57.54 1svm h LEU 609 Cb 1.24 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 41.83 1svm h LEU 609 CO 0.57 0.43 0.26 0.77 0.09 0.00 0.00 178.44 180.56 1svm h SER 610 N 0.74 0.41 -0.41 -0.43 4.64 -1.98 0.44 113.55 116.95 1svm h SER 610 Ca 0.24 0.01 0.02 0.00 -0.47 0.00 0.00 61.79 61.59 1svm h SER 610 Cb 0.00 -0.08 -0.03 0.00 -0.31 0.00 0.00 62.40 61.98 1svm h SER 610 CO -0.09 0.29 0.23 0.58 -0.87 0.00 0.00 176.83 176.97 1svm h VAL 611 N 0.52 1.01 -0.46 0.95 2.07 -1.83 0.11 116.25 118.62 1svm h VAL 611 Ca 0.18 -0.16 -0.02 0.00 0.82 0.00 0.00 66.70 67.53 1svm h VAL 611 Cb 0.04 0.51 -0.02 0.00 -1.52 0.00 0.00 31.29 30.30 1svm h VAL 611 CO -0.10 0.08 0.23 0.22 0.02 0.00 0.00 177.57 178.03 1svm h TYR 612 N 0.46 0.66 -0.69 1.57 3.20 -1.04 -2.03 116.97 119.10 1svm h TYR 612 Ca 0.17 -0.03 0.06 0.00 3.14 0.00 0.00 58.73 62.07 1svm h TYR 612 Cb 0.04 -0.21 -0.04 0.00 1.54 0.00 0.00 36.73 38.06 1svm h TYR 612 CO -0.08 0.53 0.45 1.96 -1.64 0.00 0.00 178.16 179.38 1svm h GLN 613 N 0.61 0.70 -0.66 1.82 4.20 -0.29 -1.19 115.11 120.30 1svm h GLN 613 Ca 0.16 -0.04 -0.05 0.00 0.06 0.00 0.00 58.65 58.78 1svm h GLN 613 Cb 0.11 -0.16 -0.03 0.00 0.30 0.00 0.00 27.48 27.70 1svm h GLN 613 CO -0.02 0.46 0.23 -0.22 -0.67 0.00 0.00 178.83 178.61 1svm h LYS 614 N 0.72 1.00 -0.10 1.46 1.63 -0.11 -0.61 116.57 120.56 1svm h LYS 614 Ca 0.29 -0.20 -0.00 0.00 -0.85 0.00 0.00 60.65 59.89 1svm h LYS 614 Cb 0.24 -0.15 -0.00 0.00 -0.60 0.00 0.00 32.23 31.72 1svm h LYS 614 CO -0.09 0.87 0.06 0.52 -3.45 0.00 0.00 179.45 177.35 1svm h MET 615 N 0.94 0.14 -0.57 1.90 2.86 -0.67 -0.09 114.93 119.44 1svm h MET 615 Ca 0.21 -0.01 -0.01 0.00 -2.06 0.00 0.00 59.70 57.83 1svm h MET 615 Cb 0.26 -0.03 -0.03 0.00 0.06 0.00 0.00 31.60 31.87 1svm h MET 615 CO -0.01 0.15 0.31 0.87 1.06 0.00 0.00 176.91 179.29 1svm h LYS 616 N 0.09 0.79 0.06 1.72 1.57 -1.23 -1.35 116.57 118.23 1svm h LYS 616 Ca 0.04 -0.08 -0.00 0.00 -1.87 0.00 0.00 60.65 58.73 1svm h LYS 616 Cb 0.05 -0.16 0.00 0.00 0.08 0.00 0.00 32.23 32.20 1svm h LYS 616 CO -0.01 0.59 -0.03 0.35 -0.57 0.00 0.00 179.45 179.78 1svm h PHE 617 N 0.80 -0.08 -0.53 -1.35 3.57 -0.59 -1.46 116.94 117.30 1svm h PHE 617 Ca 0.20 -0.00 0.05 0.00 3.53 0.00 0.00 57.97 61.76 1svm h PHE 617 Cb 0.03 0.03 -0.03 0.00 2.79 0.00 0.00 35.95 38.77 1svm h PHE 617 CO 0.00 -0.00 0.36 -0.91 -2.23 0.00 0.00 178.31 175.53 1svm h ASN 618 N -0.14 0.45 0.19 0.41 2.35 -0.36 -0.82 115.58 117.66 1svm h ASN 618 Ca -0.01 -0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.73 1svm h ASN 618 Cb 0.11 -0.10 0.00 0.00 0.05 0.00 0.00 38.32 38.39 1svm h ASN 618 CO 0.01 0.30 -0.09 0.58 -1.65 0.00 0.00 177.43 176.58 1svm h VAL 619 N 0.51 0.91 -0.83 2.81 2.07 -0.73 0.25 116.25 121.23 1svm h VAL 619 Ca 0.23 -0.51 0.12 0.00 0.82 0.00 0.00 66.70 67.35 1svm h VAL 619 Cb 0.25 1.21 -0.06 0.00 -1.52 0.00 0.00 31.29 31.18 1svm h VAL 619 CO -0.06 0.12 0.54 0.00 0.02 0.00 0.00 177.57 178.19 1svm h ALA 620 N 0.24 1.82 0.00 1.67 0.00 -0.67 0.28 119.26 122.60 1svm h ALA 620 Ca -0.03 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1svm h ALA 620 Cb 0.39 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.04 1svm h ALA 620 CO 0.04 -0.02 -0.12 -1.33 0.00 0.00 0.00 179.25 177.82 1svm n MET 621 N -4.53 0.13 -3.34 0.00 2.00 -0.37 -4.80 117.12 106.22 1svm n MET 621 Ca 0.15 0.09 -0.16 0.00 0.00 0.00 0.00 57.70 57.78 1svm n MET 621 Cb 0.40 -1.64 0.08 0.00 0.00 0.00 0.00 33.22 32.07 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 1.41 -0.35 2.20 3.03 0.00 0.97 -4.96 105.19 107.50 1svm n GLY 622 Ca 0.06 0.09 -0.22 0.00 0.00 0.00 0.00 46.02 45.95 1svm n GLY 622 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1svm n ILE 623 N -3.91 -0.50 -2.33 -0.61 -5.35 -0.35 -3.91 119.36 102.41 1svm n ILE 623 Ca -0.26 -4.16 0.00 0.00 -0.27 0.00 0.00 62.75 58.06 1svm n ILE 623 Cb 0.66 -1.28 0.00 0.00 -1.74 0.00 0.00 39.64 37.28 1svm n ILE 623 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1svm n GLY 624 N 1.00 -5.76 0.32 3.28 0.00 -1.26 -4.52 105.19 98.25 1svm n GLY 624 Ca 0.22 0.05 0.08 0.00 0.00 0.00 0.00 46.02 46.37 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 4.35 1.00 -0.47 1.61 -1.51 -1.82 -2.25 116.25 117.17 1svm h VAL 625 Ca 0.00 -0.13 0.00 0.00 -1.23 0.00 0.00 66.70 65.34 1svm h VAL 625 Cb 0.00 0.60 0.00 0.00 -2.13 0.00 0.00 31.29 29.76 1svm h VAL 625 CO 0.00 0.07 0.00 0.18 -1.23 0.00 0.00 177.57 176.59 1svm n LEU 626 N -4.48 2.63 0.00 4.19 4.77 -1.26 -4.38 117.00 118.47 1svm n LEU 626 Ca 0.04 -1.29 0.15 0.00 -0.03 0.00 0.00 56.01 54.88 1svm n LEU 626 Cb 0.19 -0.31 0.88 0.00 -2.33 0.00 0.00 43.42 41.85 1svm n LEU 626 CO 0.35 0.65 1.05 0.47 -1.33 0.00 0.00 177.39 178.57