#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1uom n LEU 308 N 0.00 0.00 -0.00 0.00 4.32 -1.26 -2.33 117.00 117.73 1uom n LEU 308 Ca 0.00 0.00 0.06 0.00 -0.02 0.00 0.00 56.01 56.05 1uom n LEU 308 Cb 0.00 0.00 -0.07 0.00 -1.62 0.00 0.00 43.42 41.73 1uom n LEU 308 CO 0.00 0.00 -0.09 -1.20 -1.22 0.00 0.00 177.39 174.88 1uom n SER 309 N -0.81 0.72 -4.59 -1.43 7.64 -1.26 -5.02 113.62 108.87 1uom n SER 309 Ca 0.14 -0.72 -0.42 0.00 1.01 0.00 0.00 58.87 58.88 1uom n SER 309 Cb 0.06 1.05 0.01 0.00 -1.01 0.00 0.00 64.21 64.32 1uom n SER 309 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 1uom n LEU 310 N -1.35 2.10 -4.89 -3.43 4.77 -0.99 -4.98 117.00 108.24 1uom n LEU 310 Ca 0.02 1.05 -0.28 0.00 -0.03 0.00 0.00 56.01 56.76 1uom n LEU 310 Cb 0.20 -1.31 -0.01 0.00 -2.33 0.00 0.00 43.42 39.98 1uom n LEU 310 CO 0.25 -1.64 0.46 -0.89 -1.33 0.00 0.00 177.39 174.24 1uom s THR 311 N -1.25 4.86 0.10 -5.08 2.01 -1.26 -4.88 115.64 110.13 1uom s THR 311 Ca 0.62 0.37 -0.33 0.00 0.31 0.00 0.00 61.69 62.66 1uom s THR 311 Cb -0.59 -3.83 -0.14 0.00 0.01 0.00 0.00 72.50 67.95 1uom s THR 311 CO 0.58 -0.78 1.53 0.00 -0.69 0.00 0.00 174.62 175.25 1uom h ALA 312 N 0.47 -0.98 -0.11 7.40 0.00 -1.94 0.10 119.26 124.20 1uom h ALA 312 Ca -0.47 -0.11 0.03 0.00 0.00 0.00 0.00 54.91 54.37 1uom h ALA 312 Cb 1.20 0.89 -0.00 0.00 0.00 0.00 0.00 17.79 19.87 1uom h ALA 312 CO 0.62 -1.11 0.14 -0.44 0.00 0.00 0.00 179.25 178.46 1uom h ASP 313 N -0.72 0.00 0.93 0.00 3.45 -1.95 -0.51 116.42 117.62 1uom h ASP 313 Ca -0.01 0.00 -0.21 0.00 0.43 0.00 0.00 57.03 57.24 1uom h ASP 313 Cb 0.73 0.00 -0.03 0.00 -0.56 0.00 0.00 39.33 39.47 1uom h ASP 313 CO -0.28 0.00 -1.00 1.56 -1.57 0.00 0.00 179.24 177.95 1uom h GLN 314 N 0.00 0.03 -0.44 3.56 4.20 -1.55 -2.36 115.11 118.56 1uom h GLN 314 Ca 0.05 -0.05 -0.14 0.00 0.06 0.00 0.00 58.65 58.57 1uom h GLN 314 Cb 0.33 0.02 -0.01 0.00 0.30 0.00 0.00 27.48 28.11 1uom h GLN 314 CO -0.00 1.00 -0.26 1.98 -0.67 0.00 0.00 178.83 180.87 1uom h MET 315 N 0.01 0.95 -0.23 1.46 4.05 0.79 0.48 114.93 122.44 1uom h MET 315 Ca -0.02 -0.44 -0.16 0.00 -0.28 0.00 0.00 59.70 58.80 1uom h MET 315 Cb 1.75 -0.02 -0.01 0.00 -0.80 0.00 0.00 31.60 32.53 1uom h MET 315 CO 0.13 1.10 -0.51 0.28 0.23 0.00 0.00 176.91 178.15 1uom h VAL 316 N 0.79 1.30 -0.20 -5.77 2.07 -1.46 0.14 116.25 113.13 1uom h VAL 316 Ca 0.09 -1.72 -0.16 0.00 0.82 0.00 0.00 66.70 65.72 1uom h VAL 316 Cb 0.85 1.67 -0.01 0.00 -1.52 0.00 0.00 31.29 32.28 1uom h VAL 316 CO 0.07 0.55 -0.54 0.28 0.02 0.00 0.00 177.57 177.95 1uom h SER 317 N 0.51 0.65 -0.37 0.57 0.02 -1.36 -0.43 113.55 113.14 1uom h SER 317 Ca 0.02 -0.35 -0.06 0.00 -0.84 0.00 0.00 61.79 60.56 1uom h SER 317 Cb 1.06 -0.19 -0.01 0.00 0.14 0.00 0.00 62.40 63.40 1uom h SER 317 CO 0.10 1.07 -0.01 0.00 -1.14 0.00 0.00 176.83 176.85 1uom h ALA 318 N 0.95 0.50 -0.09 3.77 0.00 -0.69 -2.25 119.26 121.45 1uom h ALA 318 Ca 0.01 -0.26 -0.16 0.00 0.00 0.00 0.00 54.91 54.50 1uom h ALA 318 Cb 1.09 -0.13 0.01 0.00 0.00 0.00 0.00 17.79 18.76 1uom h ALA 318 CO 0.10 0.28 -0.56 -0.07 0.00 0.00 0.00 179.25 179.00 1uom h LEU 319 N 0.47 0.64 -1.31 0.00 3.38 -0.93 -2.73 115.31 114.83 1uom h LEU 319 Ca 0.10 -0.66 0.02 0.00 0.09 0.00 0.00 57.88 57.43 1uom h LEU 319 Cb 0.48 -0.19 -0.04 0.00 0.09 0.00 0.00 40.66 41.00 1uom h LEU 319 CO 0.02 1.21 0.47 0.25 0.09 0.00 0.00 178.44 180.48 1uom h LEU 320 N 0.13 0.79 -0.84 1.67 5.85 -1.12 -1.04 115.31 120.75 1uom h LEU 320 Ca -0.05 -0.02 -0.11 0.00 0.84 0.00 0.00 57.88 58.55 1uom h LEU 320 Cb 1.22 -0.19 -0.02 0.00 0.37 0.00 0.00 40.66 42.04 1uom h LEU 320 CO 0.11 0.56 -0.52 0.44 -0.34 0.00 0.00 178.44 178.70 1uom h ASP 321 N 0.93 0.00 1.10 1.25 5.19 -1.42 -3.04 116.42 120.43 1uom h ASP 321 Ca 0.27 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.68 1uom h ASP 321 Cb -0.05 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.46 1uom h ASP 321 CO -0.07 0.52 0.00 0.00 -3.12 0.00 0.00 179.24 176.57 1uom n ALA 322 N -2.38 2.17 -1.56 3.45 0.00 -0.43 -4.92 120.51 116.85 1uom n ALA 322 Ca -0.01 -0.05 -0.54 0.00 0.00 0.00 0.00 53.44 52.85 1uom n ALA 322 Cb 0.57 -1.44 -0.06 0.00 0.00 0.00 0.00 19.45 18.52 1uom n ALA 322 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1uom n GLU 323 N -1.86 0.79 -1.29 0.00 -0.58 -1.01 -4.56 120.64 112.13 1uom n GLU 323 Ca 0.06 0.28 -0.29 0.00 -0.42 0.00 0.00 57.16 56.79 1uom n GLU 323 Cb 0.34 -1.85 0.17 0.00 -0.57 0.00 0.00 31.44 29.53 1uom n GLU 323 CO 0.00 0.00 0.00 -2.14 -0.48 0.00 0.00 177.13 174.51 1uom s PRO 324 N 0.20 0.56 0.56 3.49 0.02 -1.26 -5.04 135.00 133.53 1uom s PRO 324 Ca 0.84 0.41 -0.06 0.00 0.02 0.00 0.00 61.00 62.21 1uom s PRO 324 Cb -1.03 -1.76 -0.00 0.00 0.02 0.00 0.00 34.50 31.72 1uom s PRO 324 CO 0.51 -2.62 0.87 -2.14 -0.33 0.00 0.00 177.00 173.29 1uom s PRO 325 N -5.08 3.10 -0.59 5.54 0.02 -1.26 -5.02 135.00 131.72 1uom s PRO 325 Ca 0.65 0.05 -0.18 0.00 0.02 0.00 0.00 61.00 61.55 1uom s PRO 325 Cb -0.17 -2.30 0.12 0.00 0.02 0.00 0.00 34.50 32.17 1uom s PRO 325 CO 0.56 -0.56 0.64 0.42 -0.33 0.00 0.00 177.00 177.74 1uom s ILE 326 N -2.92 5.00 0.84 2.83 1.01 -1.26 -5.05 121.20 121.66 1uom s ILE 326 Ca 0.52 -1.28 -0.11 0.00 0.00 0.00 0.00 60.65 59.78 1uom s ILE 326 Cb -0.10 -4.44 0.10 0.00 0.01 0.00 0.00 42.46 38.02 1uom s ILE 326 CO 0.45 -1.04 1.09 -0.76 0.00 0.00 0.00 174.94 174.69 1uom s LEU 327 N 2.15 2.63 0.17 2.97 1.43 -1.26 -4.91 118.68 121.87 1uom s LEU 327 Ca 0.09 1.66 0.06 0.00 -1.03 0.00 0.00 54.13 54.92 1uom s LEU 327 Cb -0.25 -4.21 -0.04 0.00 0.03 0.00 0.00 46.19 41.72 1uom s LEU 327 CO 0.04 -2.37 0.07 -0.31 0.23 0.00 0.00 176.35 174.01 1uom s TYR 328 N -2.91 2.99 0.12 0.29 1.51 -1.26 -4.34 117.35 113.74 1uom s TYR 328 Ca 0.62 -0.08 -0.30 0.00 -1.01 0.00 0.00 57.07 56.30 1uom s TYR 328 Cb -0.18 -1.44 -0.06 0.00 -0.11 0.00 0.00 41.96 40.18 1uom s TYR 328 CO 0.57 0.52 0.97 0.45 -1.11 0.00 0.00 175.55 176.95 1uom s SER 329 N -3.07 7.49 -1.37 2.29 0.15 -1.26 -4.94 113.70 112.99 1uom s SER 329 Ca 0.29 1.81 -0.12 0.00 0.70 0.00 0.00 55.95 58.64 1uom s SER 329 Cb -0.09 -2.59 0.10 0.00 -1.71 0.00 0.00 66.02 61.73 1uom s SER 329 CO 0.21 -0.07 2.05 -0.62 1.20 0.00 0.00 173.24 176.01 1uom n GLU 330 N 2.75 3.25 -5.13 5.44 1.02 -1.26 -4.91 120.64 121.81 1uom n GLU 330 Ca 0.02 -3.07 -0.32 0.00 -0.02 0.00 0.00 57.16 53.77 1uom n GLU 330 Cb 0.49 -3.10 -0.15 0.00 -0.02 0.00 0.00 31.44 28.66 1uom n GLU 330 CO 0.00 0.00 0.00 -0.47 1.18 0.00 0.00 177.13 177.84 1uom s TYR 331 N 1.74 2.53 -0.51 -0.32 5.04 -1.26 -5.06 117.35 119.50 1uom s TYR 331 Ca 0.43 -0.55 -0.28 0.00 -2.44 0.00 0.00 57.07 54.23 1uom s TYR 331 Cb 0.12 -1.62 0.00 0.00 0.35 0.00 0.00 41.96 40.81 1uom s TYR 331 CO -0.04 -0.10 1.54 0.34 -1.34 0.00 0.00 175.55 175.94 1uom s ASP 332 N -0.28 5.99 0.65 4.32 3.68 -1.26 -4.89 116.67 124.88 1uom s ASP 332 Ca 0.01 0.52 0.37 0.00 2.13 0.00 0.00 52.55 55.58 1uom s ASP 332 Cb -0.13 -2.54 2.06 0.00 -1.45 0.00 0.00 42.92 40.86 1uom s ASP 332 CO 0.03 -1.77 2.21 1.55 0.13 0.00 0.00 175.17 177.32 1uom h PRO 333 N 11.86 0.00 -0.15 4.34 0.13 -1.98 -2.02 132.00 144.18 1uom h PRO 333 Ca -0.28 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.85 1uom h PRO 333 Cb 1.12 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.25 1uom h PRO 333 CO 1.15 0.00 0.00 0.25 -0.23 0.00 0.00 178.00 179.17 1uom n THR 334 N -3.25 0.18 -4.19 1.56 -2.24 -1.26 -4.91 114.28 100.17 1uom n THR 334 Ca -0.02 -0.46 -0.35 0.00 -2.27 0.00 0.00 64.05 60.96 1uom n THR 334 Cb 0.19 0.82 -0.08 0.00 -2.10 0.00 0.00 70.33 69.16 1uom n THR 334 CO 0.00 0.00 0.00 -0.60 -0.57 0.00 0.00 175.07 173.90 1uom s ARG 335 N -1.82 3.10 0.04 -0.78 3.52 -0.76 -5.05 118.95 117.19 1uom s ARG 335 Ca 0.34 -0.37 -0.36 0.00 -0.13 0.00 0.00 55.73 55.22 1uom s ARG 335 Cb 0.20 -2.90 -0.15 0.00 -1.56 0.00 0.00 34.95 30.55 1uom s ARG 335 CO 0.30 0.71 1.56 -2.30 -0.81 0.00 0.00 175.30 174.75 1uom n PRO 336 N 1.85 1.65 0.15 5.12 -0.02 -1.26 -4.89 135.00 137.59 1uom n PRO 336 Ca -0.17 0.60 -0.00 0.00 -2.02 0.00 0.00 63.50 61.90 1uom n PRO 336 Cb 0.54 -2.32 0.23 0.00 -0.02 0.00 0.00 33.50 31.93 1uom n PRO 336 CO 0.00 0.00 0.00 0.35 1.98 0.00 0.00 175.50 177.83 1uom h PHE 337 N 6.06 0.02 0.00 6.00 3.57 -1.96 -3.22 116.94 127.41 1uom h PHE 337 Ca -0.47 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.03 1uom h PHE 337 Cb 1.30 -0.00 0.00 0.00 2.79 0.00 0.00 35.95 40.03 1uom h PHE 337 CO 0.67 0.55 0.00 -1.13 -2.23 0.00 0.00 178.31 176.17 1uom n SER 338 N -3.91 0.00 -0.82 0.41 3.41 -1.26 -1.46 113.62 109.99 1uom n SER 338 Ca -0.01 -0.10 -0.01 0.00 -0.26 0.00 0.00 58.87 58.49 1uom n SER 338 Cb 0.54 0.00 -0.01 0.00 -0.26 0.00 0.00 64.21 64.48 1uom n SER 338 CO 0.00 0.00 0.00 -1.84 -0.16 0.00 0.00 175.04 173.04 1uom n GLU 339 N -0.55 0.00 0.00 4.33 0.28 -1.22 -4.90 120.64 118.58 1uom n GLU 339 Ca 0.00 -0.90 0.13 0.00 -0.16 0.00 0.00 57.16 56.23 1uom n GLU 339 Cb 0.00 -0.02 0.47 0.00 1.43 0.00 0.00 31.44 33.33 1uom n GLU 339 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1uom n ALA 340 N 0.10 2.93 -2.25 -1.84 0.00 -0.53 -4.99 120.51 113.92 1uom n ALA 340 Ca -0.05 -0.25 -0.02 0.00 0.00 0.00 0.00 53.44 53.12 1uom n ALA 340 Cb 0.73 -1.29 0.00 0.00 0.00 0.00 0.00 19.45 18.89 1uom n ALA 340 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1uom n SER 341 N -1.30 -5.60 -0.17 0.00 2.88 -1.26 -4.54 113.62 103.64 1uom n SER 341 Ca 0.09 0.69 -0.02 0.00 -1.33 0.00 0.00 58.87 58.30 1uom n SER 341 Cb 0.32 -3.61 0.06 0.00 -0.75 0.00 0.00 64.21 60.23 1uom n SER 341 CO 0.00 0.00 0.00 -0.03 -1.23 0.00 0.00 175.04 173.78 1uom h MET 342 N 1.62 0.10 -0.36 -1.46 4.05 -1.94 -1.44 114.93 115.51 1uom h MET 342 Ca 0.00 -0.01 -0.01 0.00 -0.28 0.00 0.00 59.70 59.40 1uom h MET 342 Cb 0.19 -0.02 -0.02 0.00 -0.80 0.00 0.00 31.60 30.95 1uom h MET 342 CO 0.08 0.07 0.18 1.98 0.23 0.00 0.00 176.91 179.44 1uom h MET 343 N 0.10 0.51 -0.69 0.39 1.85 -1.99 -2.04 114.93 113.05 1uom h MET 343 Ca 0.26 -0.07 0.10 0.00 -0.61 0.00 0.00 59.70 59.38 1uom h MET 343 Cb 0.40 -0.09 -0.07 0.00 0.43 0.00 0.00 31.60 32.27 1uom h MET 343 CO -0.45 0.45 0.32 0.78 -0.40 0.00 0.00 176.91 177.62 1uom h GLY 344 N 0.44 1.03 0.90 1.39 0.00 -1.69 0.35 103.07 105.49 1uom h GLY 344 Ca 0.12 -0.19 -0.02 0.00 0.00 0.00 0.00 47.33 47.24 1uom h GLY 344 CO -0.02 0.03 -0.17 1.41 0.00 0.00 0.00 176.54 177.79 1uom h LEU 345 N 0.54 -0.41 -0.61 3.11 3.38 -0.96 -1.85 115.31 118.52 1uom h LEU 345 Ca 0.35 -0.05 0.04 0.00 0.09 0.00 0.00 57.88 58.31 1uom h LEU 345 Cb 0.40 0.11 -0.05 0.00 0.09 0.00 0.00 40.66 41.21 1uom h LEU 345 CO -0.29 -0.21 0.35 -0.07 0.09 0.00 0.00 178.44 178.30 1uom h LEU 346 N -0.59 0.53 0.13 1.67 4.07 -0.91 -1.73 115.31 118.49 1uom h LEU 346 Ca -0.05 0.02 0.01 0.00 0.08 0.00 0.00 57.88 57.94 1uom h LEU 346 Cb 0.44 -0.09 -0.02 0.00 1.08 0.00 0.00 40.66 42.07 1uom h LEU 346 CO 0.08 0.36 -0.17 0.74 -1.08 0.00 0.00 178.44 178.37 1uom h THR 347 N 0.66 0.61 -0.57 0.22 2.02 -0.22 -0.31 112.91 115.32 1uom h THR 347 Ca 0.26 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.42 1uom h THR 347 Cb 0.11 0.61 -0.03 0.00 -1.74 0.00 0.00 68.15 67.10 1uom h THR 347 CO -0.14 0.00 0.30 0.78 0.37 0.00 0.00 175.52 176.82 1uom h ASN 348 N -0.35 0.71 0.09 4.18 2.35 -1.18 -1.43 115.58 119.94 1uom h ASN 348 Ca 0.02 -0.06 -0.00 0.00 -0.55 0.00 0.00 56.30 55.70 1uom h ASN 348 Cb 0.36 -0.18 0.00 0.00 0.05 0.00 0.00 38.32 38.55 1uom h ASN 348 CO -0.08 0.59 -0.04 0.25 -1.65 0.00 0.00 177.43 176.50 1uom h LEU 349 N 0.80 -0.10 -0.71 1.61 5.85 -0.87 -2.90 115.31 118.99 1uom h LEU 349 Ca 0.20 -0.17 -0.01 0.00 0.84 0.00 0.00 57.88 58.74 1uom h LEU 349 Cb 0.05 0.03 -0.03 0.00 0.37 0.00 0.00 40.66 41.07 1uom h LEU 349 CO -0.03 0.11 0.40 0.00 -0.34 0.00 0.00 178.44 178.58 1uom h ALA 350 N 0.57 0.90 -0.17 1.25 0.00 -0.79 -1.96 119.26 119.06 1uom h ALA 350 Ca -0.01 -0.10 0.04 0.00 0.00 0.00 0.00 54.91 54.83 1uom h ALA 350 Cb 0.27 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 1uom h ALA 350 CO 0.02 0.41 0.12 -0.44 0.00 0.00 0.00 179.25 179.36 1uom h ASP 351 N 0.97 0.06 0.70 0.00 5.19 -1.24 0.19 116.42 122.28 1uom h ASP 351 Ca 0.25 -0.00 -0.26 0.00 -0.62 0.00 0.00 57.03 56.40 1uom h ASP 351 Cb 0.02 -0.01 -0.01 0.00 0.18 0.00 0.00 39.33 39.50 1uom h ASP 351 CO -0.04 0.04 -1.25 0.03 -3.12 0.00 0.00 179.24 174.89 1uom h ARG 352 N 0.07 0.18 -0.07 3.56 3.08 -1.20 -3.25 114.38 116.74 1uom h ARG 352 Ca 0.08 -0.30 -0.13 0.00 0.07 0.00 0.00 59.98 59.70 1uom h ARG 352 Cb 0.23 0.11 -0.01 0.00 0.08 0.00 0.00 29.97 30.38 1uom h ARG 352 CO -0.01 1.10 -0.53 0.93 -1.07 0.00 0.00 179.97 180.39 1uom h GLU 353 N 0.05 0.19 -0.82 0.04 5.08 -0.61 -3.08 114.58 115.41 1uom h GLU 353 Ca -0.13 -0.11 0.10 0.00 -1.00 0.00 0.00 59.36 58.22 1uom h GLU 353 Cb 1.93 0.01 -0.08 0.00 0.50 0.00 0.00 28.75 31.11 1uom h GLU 353 CO 0.17 0.67 0.46 1.25 -1.00 0.00 0.00 179.01 180.57 1uom h LEU 354 N 0.14 0.65 -0.67 1.33 5.85 -1.03 0.17 115.31 121.76 1uom h LEU 354 Ca 0.00 0.05 0.01 0.00 0.84 0.00 0.00 57.88 58.79 1uom h LEU 354 Cb 0.99 -0.07 -0.03 0.00 0.37 0.00 0.00 40.66 41.92 1uom h LEU 354 CO 0.08 0.36 0.44 0.58 -0.34 0.00 0.00 178.44 179.55 1uom h VAL 355 N 0.76 1.16 0.00 1.05 2.07 -1.64 -1.23 116.25 118.42 1uom h VAL 355 Ca 0.41 -0.30 -0.06 0.00 0.82 0.00 0.00 66.70 67.56 1uom h VAL 355 Cb 0.41 0.19 -0.01 0.00 -1.52 0.00 0.00 31.29 30.36 1uom h VAL 355 CO -0.26 0.16 -0.29 0.45 0.02 0.00 0.00 177.57 177.65 1uom h HIS 356 N 0.89 0.00 -0.69 1.57 3.86 -1.28 -2.94 115.15 116.57 1uom h HIS 356 Ca 0.25 0.00 -0.08 0.00 -1.16 0.00 0.00 60.37 59.38 1uom h HIS 356 Cb -0.08 0.00 -0.03 0.00 1.06 0.00 0.00 27.41 28.36 1uom h HIS 356 CO -0.03 0.29 0.13 1.98 0.86 0.00 0.00 177.93 181.16 1uom h MET 357 N 0.00 1.12 -0.04 2.45 -1.53 0.47 -1.04 114.93 116.36 1uom h MET 357 Ca -0.00 -0.29 0.00 0.00 -3.44 0.00 0.00 59.70 55.97 1uom h MET 357 Cb 0.83 -0.14 -0.00 0.00 -0.55 0.00 0.00 31.60 31.74 1uom h MET 357 CO 0.04 1.01 0.01 0.82 0.14 0.00 0.00 176.91 178.94 1uom h ILE 358 N 1.06 0.99 -0.81 1.77 5.03 -1.23 0.32 117.51 124.64 1uom h ILE 358 Ca 0.21 -0.01 0.07 0.00 -0.12 0.00 0.00 64.86 65.01 1uom h ILE 358 Cb 0.42 0.96 -0.06 0.00 -3.03 0.00 0.00 36.82 35.11 1uom h ILE 358 CO 0.01 0.01 0.48 0.78 -0.68 0.00 0.00 178.15 178.75 1uom h ASN 359 N 0.04 0.74 0.05 1.72 2.35 -1.49 0.87 115.58 119.84 1uom h ASN 359 Ca 0.02 0.03 -0.00 0.00 -0.55 0.00 0.00 56.30 55.79 1uom h ASN 359 Cb 0.01 -0.12 0.00 0.00 0.05 0.00 0.00 38.32 38.25 1uom h ASN 359 CO -0.01 0.46 -0.02 -0.25 -1.65 0.00 0.00 177.43 175.95 1uom h TRP 360 N 0.86 -0.06 -0.71 1.19 7.01 -0.66 -2.82 115.95 120.77 1uom h TRP 360 Ca 0.37 -0.00 0.07 0.00 2.11 0.00 0.00 58.89 61.44 1uom h TRP 360 Cb 0.23 0.02 -0.06 0.00 -2.10 0.00 0.00 29.16 27.24 1uom h TRP 360 CO -0.05 0.09 0.39 0.00 -2.79 0.00 0.00 178.44 176.07 1uom h ALA 361 N 0.76 0.97 -0.03 2.65 0.00 0.47 0.57 119.26 124.65 1uom h ALA 361 Ca -0.01 0.03 0.01 0.00 0.00 0.00 0.00 54.91 54.94 1uom h ALA 361 Cb 0.17 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 17.85 1uom h ALA 361 CO 0.01 0.04 0.08 0.87 0.00 0.00 0.00 179.25 180.25 1uom h LYS 362 N 0.69 0.00 -0.02 0.00 1.79 -0.68 -0.79 116.57 117.56 1uom h LYS 362 Ca 0.33 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.80 1uom h LYS 362 Cb 0.27 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.92 1uom h LYS 362 CO -0.22 0.00 -0.18 0.54 -1.08 0.00 0.00 179.45 178.52 1uom n ARG 363 N -3.36 1.64 -2.57 3.15 1.74 0.17 -4.52 116.66 112.91 1uom n ARG 363 Ca -0.02 -1.24 -0.43 0.00 -0.77 0.00 0.00 57.85 55.39 1uom n ARG 363 Cb 0.16 -1.47 -0.02 0.00 -1.02 0.00 0.00 32.46 30.10 1uom n ARG 363 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1uom s VAL 364 N -2.22 4.52 0.05 1.55 1.01 -0.30 -4.85 120.40 120.16 1uom s VAL 364 Ca 0.27 1.84 -0.38 0.00 0.00 0.00 0.00 61.98 63.71 1uom s VAL 364 Cb 0.20 -4.19 -0.18 0.00 0.00 0.00 0.00 36.38 32.21 1uom s VAL 364 CO 0.42 -0.16 1.27 -2.65 0.00 0.00 0.00 175.10 173.98 1uom n PRO 365 N 6.40 0.77 0.00 2.72 -0.02 -1.26 -1.18 135.00 142.43 1uom n PRO 365 Ca 0.13 0.28 0.00 0.00 -2.02 0.00 0.00 63.50 61.89 1uom n PRO 365 Cb 0.46 -1.88 0.00 0.00 -0.02 0.00 0.00 33.50 32.06 1uom n PRO 365 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1uom n GLY 366 N 2.25 2.73 0.12 -1.23 0.00 -1.26 -4.91 105.19 102.89 1uom n GLY 366 Ca 0.19 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.08 1uom n GLY 366 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1uom h PHE 367 N 0.00 -0.20 0.00 1.61 3.57 -1.44 -2.79 116.94 117.68 1uom h PHE 367 Ca 0.00 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.50 1uom h PHE 367 Cb 0.00 0.07 0.00 0.00 2.79 0.00 0.00 35.95 38.81 1uom h PHE 367 CO 0.00 0.00 0.00 1.33 -2.23 0.00 0.00 178.31 177.41 1uom n VAL 368 N -5.11 1.04 0.20 1.41 0.24 -1.26 -1.91 118.33 112.93 1uom n VAL 368 Ca -0.09 0.41 0.06 0.00 -2.04 0.00 0.00 64.34 62.69 1uom n VAL 368 Cb 0.17 -1.34 0.37 0.00 -1.47 0.00 0.00 33.84 31.57 1uom n VAL 368 CO 0.00 0.00 0.00 0.44 -2.14 0.00 0.00 176.83 175.13 1uom h ASP 369 N 0.00 0.00 -2.85 -1.34 3.32 -1.87 -3.45 116.42 110.23 1uom h ASP 369 Ca 0.00 0.00 -0.32 0.00 0.02 0.00 0.00 57.03 56.73 1uom h ASP 369 Cb 0.20 0.00 0.17 0.00 0.22 0.00 0.00 39.33 39.93 1uom h ASP 369 CO 0.00 0.34 -0.02 0.18 -1.72 0.00 0.00 179.24 178.02 1uom n LEU 370 N -3.54 0.00 -4.81 1.55 4.77 -0.80 -5.00 117.00 109.17 1uom n LEU 370 Ca -0.00 -0.86 -0.37 0.00 -0.03 0.00 0.00 56.01 54.75 1uom n LEU 370 Cb 0.48 -0.84 -0.06 0.00 -2.33 0.00 0.00 43.42 40.67 1uom n LEU 370 CO 0.36 -2.30 0.44 -0.89 -1.33 0.00 0.00 177.39 173.67 1uom s THR 371 N -2.30 4.52 0.23 -5.08 2.01 -1.26 -4.89 115.64 108.87 1uom s THR 371 Ca 0.58 1.39 -0.06 0.00 0.31 0.00 0.00 61.69 63.90 1uom s THR 371 Cb -0.08 -3.92 0.21 0.00 0.01 0.00 0.00 72.50 68.72 1uom s THR 371 CO 0.46 0.28 1.70 0.25 -0.69 0.00 0.00 174.62 176.62 1uom h LEU 372 N 3.62 0.06 -1.28 4.42 5.85 -1.94 0.63 115.31 126.67 1uom h LEU 372 Ca -0.48 0.13 -0.07 0.00 0.84 0.00 0.00 57.88 58.30 1uom h LEU 372 Cb 1.20 0.16 -0.01 0.00 0.37 0.00 0.00 40.66 42.38 1uom h LEU 372 CO 0.65 0.00 -0.35 0.45 -0.34 0.00 0.00 178.44 178.86 1uom h HIS 373 N 0.30 0.00 0.02 1.25 3.86 -1.99 -0.46 115.15 118.13 1uom h HIS 373 Ca 0.39 0.00 -0.25 0.00 -1.16 0.00 0.00 60.37 59.35 1uom h HIS 373 Cb 0.63 0.00 0.01 0.00 1.06 0.00 0.00 27.41 29.11 1uom h HIS 373 CO -0.24 0.35 -1.03 -0.44 0.86 0.00 0.00 177.93 177.43 1uom h ASP 374 N 0.00 0.70 -0.69 2.45 5.19 -1.13 -2.13 116.42 120.81 1uom h ASP 374 Ca -0.00 -0.58 -0.01 0.00 -0.62 0.00 0.00 57.03 55.82 1uom h ASP 374 Cb 0.66 -0.22 -0.03 0.00 0.18 0.00 0.00 39.33 39.92 1uom h ASP 374 CO 0.05 1.38 0.39 1.56 -3.12 0.00 0.00 179.24 179.50 1uom h GLN 375 N 0.28 0.95 0.03 3.56 4.20 0.71 -1.61 115.11 123.24 1uom h GLN 375 Ca -0.11 -0.10 -0.00 0.00 0.06 0.00 0.00 58.65 58.50 1uom h GLN 375 Cb 1.68 -0.19 0.00 0.00 0.30 0.00 0.00 27.48 29.27 1uom h GLN 375 CO 0.19 0.70 -0.02 0.28 -0.67 0.00 0.00 178.83 179.31 1uom h VAL 376 N 0.94 1.13 -0.61 -0.54 2.07 -1.10 -2.46 116.25 115.67 1uom h VAL 376 Ca 0.24 -0.50 0.12 0.00 0.82 0.00 0.00 66.70 67.38 1uom h VAL 376 Cb 0.01 1.46 -0.09 0.00 -1.52 0.00 0.00 31.29 31.15 1uom h VAL 376 CO -0.04 0.13 0.10 -0.74 0.02 0.00 0.00 177.57 177.04 1uom h HIS 377 N -0.26 0.16 -0.59 1.57 -0.00 -1.17 0.33 115.15 115.19 1uom h HIS 377 Ca -0.00 0.04 -0.02 0.00 -0.00 0.00 0.00 60.37 60.38 1uom h HIS 377 Cb 0.24 0.02 -0.03 0.00 -0.00 0.00 0.00 27.41 27.65 1uom h HIS 377 CO -0.00 -0.06 0.27 -0.07 -0.00 0.00 0.00 177.93 178.07 1uom h LEU 378 N 0.23 0.78 -0.48 0.26 3.38 -1.20 -1.51 115.31 116.77 1uom h LEU 378 Ca 0.32 -0.14 -0.16 0.00 0.09 0.00 0.00 57.88 57.99 1uom h LEU 378 Cb 0.49 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.03 1uom h LEU 378 CO -0.43 0.70 -0.53 -0.07 0.09 0.00 0.00 178.44 178.21 1uom h LEU 379 N 0.80 0.71 -1.86 1.67 3.38 -0.89 -1.40 115.31 117.72 1uom h LEU 379 Ca 0.20 -0.37 -0.02 0.00 0.09 0.00 0.00 57.88 57.78 1uom h LEU 379 Cb 0.14 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 40.68 1uom h LEU 379 CO -0.02 1.10 -0.11 -0.08 0.09 0.00 0.00 178.44 179.42 1uom h GLU 380 N 0.50 0.00 0.05 1.13 4.81 -0.10 0.45 114.58 121.41 1uom h GLU 380 Ca 0.02 0.00 -0.28 0.00 -0.13 0.00 0.00 59.36 58.96 1uom h GLU 380 Cb 1.08 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 30.43 1uom h GLU 380 CO 0.10 0.11 -1.51 0.77 -0.73 0.00 0.00 179.01 177.75 1uom h SER 381 N 0.00 0.15 0.00 1.04 0.02 -1.00 -3.40 113.55 110.35 1uom h SER 381 Ca -0.00 -0.24 0.00 0.00 -0.84 0.00 0.00 61.79 60.71 1uom h SER 381 Cb 0.20 -0.05 0.00 0.00 0.14 0.00 0.00 62.40 62.69 1uom h SER 381 CO 0.01 1.20 -1.82 0.00 -1.14 0.00 0.00 176.83 175.08 1uom n ALA 382 N -2.57 2.73 -0.31 3.77 0.00 -0.55 -4.76 120.51 118.81 1uom n ALA 382 Ca -0.14 -0.44 -0.01 0.00 0.00 0.00 0.00 53.44 52.85 1uom n ALA 382 Cb 1.02 -0.63 0.03 0.00 0.00 0.00 0.00 19.45 19.87 1uom n ALA 382 CO 0.00 0.00 0.00 -2.67 0.00 0.00 0.00 177.50 174.83 1uom n TRP 383 N -2.12 0.03 0.02 0.00 4.27 0.15 -0.46 117.44 119.33 1uom n TRP 383 Ca -0.03 0.99 -0.06 0.00 -3.89 0.00 0.00 57.50 54.51 1uom n TRP 383 Cb 0.48 -0.80 0.14 0.00 -1.36 0.00 0.00 31.31 29.76 1uom n TRP 383 CO 0.00 0.00 0.00 1.25 -2.29 0.00 0.00 177.69 176.65 1uom h LEU 384 N 0.00 0.49 -1.12 5.67 5.85 -1.85 -2.00 115.31 122.35 1uom h LEU 384 Ca 0.28 -0.22 -0.06 0.00 0.84 0.00 0.00 57.88 58.73 1uom h LEU 384 Cb 0.48 -0.14 -0.02 0.00 0.37 0.00 0.00 40.66 41.36 1uom h LEU 384 CO -0.80 0.85 0.01 -0.33 -0.34 0.00 0.00 178.44 177.82 1uom h GLU 385 N 0.38 0.62 -0.19 1.25 5.08 -1.07 -1.03 114.58 119.62 1uom h GLU 385 Ca 0.03 -0.14 -0.16 0.00 -1.00 0.00 0.00 59.36 58.09 1uom h GLU 385 Cb 0.89 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 30.06 1uom h GLU 385 CO 0.08 0.64 -0.49 0.82 -1.00 0.00 0.00 179.01 179.05 1uom h ILE 386 N 0.59 1.32 -0.79 3.13 2.04 -1.13 0.17 117.51 122.84 1uom h ILE 386 Ca 0.12 -1.73 0.02 0.00 1.00 0.00 0.00 64.86 64.27 1uom h ILE 386 Cb 0.37 1.91 -0.04 0.00 -0.74 0.00 0.00 36.82 38.32 1uom h ILE 386 CO 0.01 0.54 0.52 -0.07 0.00 0.00 0.00 178.15 179.15 1uom h LEU 387 N 0.35 0.88 0.04 1.44 3.38 -1.14 -2.10 115.31 118.17 1uom h LEU 387 Ca -0.01 -0.02 -0.00 0.00 0.09 0.00 0.00 57.88 57.94 1uom h LEU 387 Cb 1.10 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 41.64 1uom h LEU 387 CO 0.11 0.63 -0.02 0.24 0.09 0.00 0.00 178.44 179.48 1uom h MET 388 N 1.04 -0.06 0.00 1.13 2.86 -1.07 -0.80 114.93 118.03 1uom h MET 388 Ca 0.30 0.00 -0.02 0.00 -2.06 0.00 0.00 59.70 57.93 1uom h MET 388 Cb -0.08 0.01 -0.00 0.00 0.06 0.00 0.00 31.60 31.59 1uom h MET 388 CO -0.08 0.26 -0.07 0.97 1.06 0.00 0.00 176.91 179.04 1uom h ILE 389 N -0.37 0.69 -0.08 -1.22 2.10 -0.89 0.14 117.51 117.88 1uom h ILE 389 Ca -0.01 -0.29 -0.17 0.00 1.08 0.00 0.00 64.86 65.47 1uom h ILE 389 Cb 0.34 1.18 0.01 0.00 -1.09 0.00 0.00 36.82 37.26 1uom h ILE 389 CO 0.01 0.07 -0.62 1.23 -1.08 0.00 0.00 178.15 177.76 1uom h GLY 390 N 0.39 0.62 1.00 8.18 0.00 -1.22 -2.24 103.07 109.79 1uom h GLY 390 Ca -0.00 -0.94 0.00 0.00 0.00 0.00 0.00 47.33 46.39 1uom h GLY 390 CO 0.01 0.83 0.14 -2.00 0.00 0.00 0.00 176.54 175.52 1uom h LEU 391 N 0.17 0.25 -1.23 3.11 5.85 0.02 -2.58 115.31 120.89 1uom h LEU 391 Ca -0.06 -0.01 0.01 0.00 0.84 0.00 0.00 57.88 58.66 1uom h LEU 391 Cb 1.28 -0.06 -0.04 0.00 0.37 0.00 0.00 40.66 42.21 1uom h LEU 391 CO 0.13 0.19 0.50 0.58 -0.34 0.00 0.00 178.44 179.50 1uom h VAL 392 N 0.28 1.20 0.79 1.05 2.07 -1.05 -2.09 116.25 118.51 1uom h VAL 392 Ca 0.08 -0.37 -0.04 0.00 0.82 0.00 0.00 66.70 67.18 1uom h VAL 392 Cb -0.02 0.07 0.01 0.00 -1.52 0.00 0.00 31.29 29.83 1uom h VAL 392 CO -0.02 0.20 -0.38 -0.25 0.02 0.00 0.00 177.57 177.14 1uom h TRP 393 N 1.04 -0.99 0.00 1.57 2.91 -1.10 -2.28 115.95 117.11 1uom h TRP 393 Ca 0.28 -0.02 0.00 0.00 1.13 0.00 0.00 58.89 60.28 1uom h TRP 393 Cb -0.11 0.33 0.00 0.00 -0.51 0.00 0.00 29.16 28.87 1uom h TRP 393 CO 0.00 -0.60 0.00 2.89 -1.03 0.00 0.00 178.44 179.70 1uom n ARG 394 N -5.52 0.06 0.00 2.65 1.85 -1.00 -1.24 116.66 113.47 1uom n ARG 394 Ca -0.14 0.39 0.11 0.00 -1.00 0.00 0.00 57.85 57.21 1uom n ARG 394 Cb 0.43 -1.64 0.12 0.00 -1.05 0.00 0.00 32.46 30.32 1uom n ARG 394 CO 0.00 0.00 0.00 0.43 -0.01 0.00 0.00 177.63 178.05 1uom n SER 395 N -1.77 1.11 -0.28 2.89 7.64 -0.79 -4.48 113.62 117.93 1uom n SER 395 Ca 0.02 -0.89 0.09 0.00 1.01 0.00 0.00 58.87 59.10 1uom n SER 395 Cb 0.13 0.48 0.24 0.00 -1.01 0.00 0.00 64.21 64.06 1uom n SER 395 CO 0.00 0.00 0.00 -0.03 -3.01 0.00 0.00 175.04 172.00 1uom h MET 396 N 0.84 0.35 -0.67 1.43 -1.53 -0.58 0.98 114.93 115.74 1uom h MET 396 Ca 0.00 -0.02 0.00 0.00 -3.44 0.00 0.00 59.70 56.24 1uom h MET 396 Cb 0.56 -0.08 0.00 0.00 -0.55 0.00 0.00 31.60 31.53 1uom h MET 396 CO 0.00 0.23 0.00 0.39 0.14 0.00 0.00 176.91 177.67 1uom n GLU 397 N -5.08 2.98 -3.43 0.39 1.02 -1.26 -4.48 120.64 110.78 1uom n GLU 397 Ca 0.18 -1.79 -0.26 0.00 -0.02 0.00 0.00 57.16 55.27 1uom n GLU 397 Cb 0.55 -1.80 -0.09 0.00 -0.02 0.00 0.00 31.44 30.08 1uom n GLU 397 CO 0.00 0.00 0.00 0.72 1.18 0.00 0.00 177.13 179.03 1uom n HIS 398 N 0.47 1.90 -1.60 -0.32 8.25 0.34 -5.10 115.22 119.16 1uom n HIS 398 Ca 0.16 -3.91 -0.54 0.00 -0.26 0.00 0.00 57.72 53.16 1uom n HIS 398 Cb 0.70 -0.42 -0.07 0.00 1.12 0.00 0.00 29.99 31.33 1uom n HIS 398 CO 0.00 0.00 0.00 -2.30 0.64 0.00 0.00 176.34 174.68 1uom n PRO 399 N 1.42 0.94 -0.90 -0.41 -0.02 -1.26 -1.35 135.00 133.42 1uom n PRO 399 Ca 0.26 0.34 0.00 0.00 -2.02 0.00 0.00 63.50 62.08 1uom n PRO 399 Cb 0.44 -1.96 0.00 0.00 -0.02 0.00 0.00 33.50 31.96 1uom n PRO 399 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1uom n GLY 400 N 2.64 0.56 3.25 -1.23 0.00 -1.26 -4.99 105.19 104.17 1uom n GLY 400 Ca 0.20 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.08 1uom n GLY 400 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1uom s LYS 401 N -0.43 1.08 -0.20 1.61 1.02 -0.45 -3.57 119.74 118.80 1uom s LYS 401 Ca 0.00 -1.47 0.01 0.00 0.02 0.00 0.00 55.97 54.53 1uom s LYS 401 Cb 0.00 -0.60 0.04 0.00 -0.52 0.00 0.00 37.83 36.75 1uom s LYS 401 CO 0.00 0.05 -0.14 -0.51 -0.92 0.00 0.00 175.35 173.82 1uom s LEU 402 N -3.18 2.41 -1.19 3.17 1.43 0.72 -4.81 118.68 117.24 1uom s LEU 402 Ca 0.18 -0.86 -0.15 0.00 -1.03 0.00 0.00 54.13 52.26 1uom s LEU 402 Cb 0.03 -1.39 0.15 0.00 0.03 0.00 0.00 46.19 45.02 1uom s LEU 402 CO 0.01 -0.09 1.44 -0.22 0.23 0.00 0.00 176.35 177.72 1uom s LEU 403 N 1.30 4.88 0.44 1.79 2.96 -1.26 -2.04 118.68 126.74 1uom s LEU 403 Ca 0.00 -2.81 0.15 0.00 -0.22 0.00 0.00 54.13 51.25 1uom s LEU 403 Cb -0.15 -2.43 0.97 0.00 0.50 0.00 0.00 46.19 45.08 1uom s LEU 403 CO -0.10 -0.84 1.97 -0.26 -1.32 0.00 0.00 176.35 175.80 1uom h PHE 404 N 7.41 0.00 -1.49 5.38 0.04 -1.74 -3.43 116.94 123.11 1uom h PHE 404 Ca 0.31 0.00 0.11 0.00 2.80 0.00 0.00 57.97 61.19 1uom h PHE 404 Cb 0.89 0.00 -0.24 0.00 2.20 0.00 0.00 35.95 38.80 1uom h PHE 404 CO 1.15 0.21 0.61 0.00 -0.60 0.00 0.00 178.31 179.68 1uom s ALA 405 N -4.55 -1.96 0.53 2.45 0.00 -1.19 -4.94 121.76 112.10 1uom s ALA 405 Ca -0.04 1.63 0.41 0.00 0.00 0.00 0.00 51.96 53.97 1uom s ALA 405 Cb 0.15 -0.83 1.61 0.00 0.00 0.00 0.00 23.12 24.05 1uom s ALA 405 CO 0.70 -0.30 1.68 -1.35 0.00 0.00 0.00 175.76 176.49 1uom h PRO 406 N 2.47 0.03 -0.44 0.00 0.11 -1.87 0.85 132.00 133.14 1uom h PRO 406 Ca -0.17 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.94 1uom h PRO 406 Cb 1.17 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.27 1uom h PRO 406 CO 0.30 0.02 0.00 0.27 -0.21 0.00 0.00 178.00 178.37 1uom n ASN 407 N -4.15 4.51 -3.17 -2.05 6.94 -1.26 -4.67 115.26 111.40 1uom n ASN 407 Ca 0.35 -2.76 -0.21 0.00 -0.02 0.00 0.00 54.58 51.95 1uom n ASN 407 Cb 1.60 -0.56 -0.06 0.00 -2.36 0.00 0.00 39.78 38.40 1uom n ASN 407 CO 0.00 0.00 0.00 -0.11 -1.03 0.00 0.00 177.26 176.12 1uom n LEU 408 N 0.28 -1.01 -4.36 -4.53 7.94 0.30 -4.88 117.00 110.73 1uom n LEU 408 Ca 0.23 -4.13 -0.41 0.00 -1.11 0.00 0.00 56.01 50.60 1uom n LEU 408 Cb 0.93 0.64 -0.11 0.00 0.53 0.00 0.00 43.42 45.41 1uom n LEU 408 CO 0.21 1.94 -0.15 -0.22 -1.11 0.00 0.00 177.39 178.07 1uom s LEU 409 N -0.22 4.81 0.04 -1.96 2.96 -1.25 -1.96 118.68 121.10 1uom s LEU 409 Ca 0.33 -1.07 0.05 0.00 -0.22 0.00 0.00 54.13 53.22 1uom s LEU 409 Cb 0.09 -2.03 -0.04 0.00 0.50 0.00 0.00 46.19 44.71 1uom s LEU 409 CO -0.16 -0.42 -0.07 -0.76 -1.32 0.00 0.00 176.35 173.62 1uom s LEU 410 N 1.54 3.14 0.00 -0.68 1.43 -0.87 -4.91 118.68 118.33 1uom s LEU 410 Ca 0.02 -0.23 0.06 0.00 -1.03 0.00 0.00 54.13 52.95 1uom s LEU 410 Cb -0.20 -1.85 0.06 0.00 0.03 0.00 0.00 46.19 44.23 1uom s LEU 410 CO 0.06 0.24 0.49 -0.90 0.23 0.00 0.00 176.35 176.48 1uom n ASP 411 N 1.22 1.92 -0.02 2.29 5.68 -1.26 -0.20 116.55 126.18 1uom n ASP 411 Ca -0.14 -2.29 -0.01 0.00 -0.50 0.00 0.00 54.79 51.84 1uom n ASP 411 Cb 0.52 -0.21 -0.01 0.00 -1.14 0.00 0.00 41.12 40.29 1uom n ASP 411 CO 0.00 0.00 0.00 0.03 -1.33 0.00 0.00 177.20 175.90 1uom h ARG 412 N 0.00 -0.03 -0.98 0.11 3.08 -1.98 -2.73 114.38 111.85 1uom h ARG 412 Ca -0.23 0.00 0.33 0.00 0.07 0.00 0.00 59.98 60.15 1uom h ARG 412 Cb 0.97 0.01 -0.16 0.00 0.08 0.00 0.00 29.97 30.86 1uom h ARG 412 CO 0.35 -0.02 0.48 -0.91 -1.07 0.00 0.00 179.97 178.80 1uom h ASN 413 N -0.03 0.33 0.13 7.04 -0.26 -1.96 0.57 115.58 121.40 1uom h ASN 413 Ca 0.01 0.22 0.00 0.00 -0.56 0.00 0.00 56.30 55.97 1uom h ASN 413 Cb 0.06 0.21 0.00 0.00 -1.06 0.00 0.00 38.32 37.53 1uom h ASN 413 CO -0.07 -0.23 0.00 0.00 -1.06 0.00 0.00 177.43 176.07 1uom n GLN 414 N -5.16 0.06 0.09 0.81 6.02 -1.03 -1.18 117.38 116.99 1uom n GLN 414 Ca 0.31 0.50 -0.12 0.00 -0.01 0.00 0.00 57.00 57.69 1uom n GLN 414 Cb 1.01 -1.67 -0.11 0.00 1.02 0.00 0.00 30.24 30.49 1uom n GLN 414 CO 0.00 0.00 0.00 0.78 -1.01 0.00 0.00 177.06 176.83 1uom h GLY 415 N 0.54 0.19 -0.13 1.08 0.00 0.09 -3.23 103.07 101.62 1uom h GLY 415 Ca 0.00 -0.46 0.00 0.00 0.00 0.00 0.00 47.33 46.87 1uom h GLY 415 CO 0.00 0.40 0.00 0.28 0.00 0.00 0.00 176.54 177.22 1uom n LYS 416 N -3.49 0.05 0.17 4.80 5.02 -0.32 -2.94 118.16 121.45 1uom n LYS 416 Ca -0.05 0.00 -0.12 0.00 -2.02 0.00 0.00 58.31 56.13 1uom n LYS 416 Cb 0.96 -1.00 -0.07 0.00 -0.02 0.00 0.00 35.03 34.90 1uom n LYS 416 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 1uom h SER 417 N 0.12 -0.40 -2.45 4.39 0.87 -1.73 -3.45 113.55 110.89 1uom h SER 417 Ca 0.00 -0.15 -0.49 0.00 -1.23 0.00 0.00 61.79 59.92 1uom h SER 417 Cb 0.00 0.10 -0.01 0.00 -0.44 0.00 0.00 62.40 62.05 1uom h SER 417 CO 0.00 0.03 -0.40 -0.69 -0.53 0.00 0.00 176.83 175.24 1uom s VAL 418 N -4.03 5.25 0.00 2.23 1.01 -1.15 -5.05 120.40 118.66 1uom s VAL 418 Ca -0.12 -0.76 -0.30 0.00 0.00 0.00 0.00 61.98 60.80 1uom s VAL 418 Cb 0.01 -3.81 -0.07 0.00 0.00 0.00 0.00 36.38 32.52 1uom s VAL 418 CO 0.44 -0.27 1.60 -1.61 0.00 0.00 0.00 175.10 175.25 1uom s GLU 419 N -3.74 4.21 -0.39 2.72 8.01 -1.26 -2.94 118.70 125.31 1uom s GLU 419 Ca 0.35 2.19 0.00 0.00 0.01 0.00 0.00 54.97 57.53 1uom s GLU 419 Cb -0.10 -3.75 0.00 0.00 -4.31 0.00 0.00 34.13 25.97 1uom s GLU 419 CO 0.30 -0.75 0.00 0.41 0.01 0.00 0.00 175.26 175.23 1uom n GLY 420 N 3.98 0.58 0.12 -1.39 0.00 -1.26 -4.88 105.19 102.33 1uom n GLY 420 Ca 0.16 -0.20 0.01 0.00 0.00 0.00 0.00 46.02 45.99 1uom n GLY 420 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 1uom h MET 421 N 0.33 0.00 0.00 1.61 -1.53 -1.75 -3.25 114.93 110.33 1uom h MET 421 Ca -0.08 0.00 0.00 0.00 -3.44 0.00 0.00 59.70 56.18 1uom h MET 421 Cb 0.56 0.00 0.00 0.00 -0.55 0.00 0.00 31.60 31.61 1uom h MET 421 CO 0.11 0.40 0.00 -0.24 0.14 0.00 0.00 176.91 177.32 1uom h VAL 422 N 0.00 0.00 -0.12 -5.77 3.04 -1.79 -1.66 116.25 109.95 1uom h VAL 422 Ca -0.08 -0.41 -0.04 0.00 -1.01 0.00 0.00 66.70 65.15 1uom h VAL 422 Cb 1.47 1.37 -0.00 0.00 -2.01 0.00 0.00 31.29 32.12 1uom h VAL 422 CO 0.06 0.00 -0.10 -0.08 -1.01 0.00 0.00 177.57 176.44 1uom h GLU 423 N 0.00 0.28 -0.51 4.17 4.81 -1.94 -2.39 114.58 119.01 1uom h GLU 423 Ca 0.00 -0.14 -0.12 0.00 -0.13 0.00 0.00 59.36 58.97 1uom h GLU 423 Cb 0.43 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.80 1uom h GLU 423 CO 0.00 0.66 -0.16 0.82 -0.73 0.00 0.00 179.01 179.60 1uom h ILE 424 N -0.10 1.27 -0.25 2.32 2.04 -1.59 -2.52 117.51 118.68 1uom h ILE 424 Ca 0.02 -1.33 -0.00 0.00 1.00 0.00 0.00 64.86 64.56 1uom h ILE 424 Cb 0.60 1.04 -0.01 0.00 -0.74 0.00 0.00 36.82 37.71 1uom h ILE 424 CO 0.03 0.46 0.16 -0.26 0.00 0.00 0.00 178.15 178.53 1uom h PHE 425 N 0.88 0.33 -0.69 1.37 0.05 -1.33 -1.13 116.94 116.42 1uom h PHE 425 Ca 0.13 0.00 0.03 0.00 3.82 0.00 0.00 57.97 61.95 1uom h PHE 425 Cb 0.74 -0.11 -0.05 0.00 2.00 0.00 0.00 35.95 38.53 1uom h PHE 425 CO 0.05 0.24 0.42 -0.44 -0.18 0.00 0.00 178.31 178.40 1uom h ASP 426 N 0.32 0.68 -0.62 2.17 3.32 -1.35 0.39 116.42 121.33 1uom h ASP 426 Ca 0.09 0.00 -0.05 0.00 0.02 0.00 0.00 57.03 57.10 1uom h ASP 426 Cb 0.00 -0.14 -0.03 0.00 0.22 0.00 0.00 39.33 39.38 1uom h ASP 426 CO -0.02 0.47 0.22 0.24 -1.72 0.00 0.00 179.24 178.43 1uom h MET 427 N 0.82 0.98 -0.20 3.56 2.86 -1.19 -0.39 114.93 121.37 1uom h MET 427 Ca 0.28 -0.19 -0.04 0.00 -2.06 0.00 0.00 59.70 57.69 1uom h MET 427 Cb 0.05 -0.16 -0.01 0.00 0.06 0.00 0.00 31.60 31.55 1uom h MET 427 CO -0.12 0.83 -0.03 -0.07 1.06 0.00 0.00 176.91 178.59 1uom h LEU 428 N 0.96 0.37 -0.69 1.22 3.38 0.02 -1.97 115.31 118.60 1uom h LEU 428 Ca 0.22 -0.35 0.04 0.00 0.09 0.00 0.00 57.88 57.87 1uom h LEU 428 Cb 0.25 -0.10 -0.05 0.00 0.09 0.00 0.00 40.66 40.85 1uom h LEU 428 CO -0.01 0.63 0.42 -0.07 0.09 0.00 0.00 178.44 179.50 1uom h LEU 429 N 0.11 0.68 -1.21 1.67 3.38 0.02 -0.45 115.31 119.51 1uom h LEU 429 Ca 0.05 0.01 0.01 0.00 0.09 0.00 0.00 57.88 58.04 1uom h LEU 429 Cb 0.46 -0.14 -0.04 0.00 0.09 0.00 0.00 40.66 41.03 1uom h LEU 429 CO 0.02 0.47 0.53 0.00 0.09 0.00 0.00 178.44 179.55 1uom h ALA 430 N 1.31 1.44 -0.31 1.53 0.00 -0.95 0.18 119.26 122.47 1uom h ALA 430 Ca 0.28 -0.05 -0.11 0.00 0.00 0.00 0.00 54.91 55.03 1uom h ALA 430 Cb 0.06 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.52 1uom h ALA 430 CO -0.12 0.51 -0.26 1.15 0.00 0.00 0.00 179.25 180.53 1uom h THR 431 N 1.07 1.30 -0.50 0.00 2.02 -0.52 -1.37 112.91 114.91 1uom h THR 431 Ca 0.30 -1.41 0.03 0.00 0.77 0.00 0.00 66.41 66.10 1uom h THR 431 Cb -0.10 1.52 -0.04 0.00 -1.74 0.00 0.00 68.15 67.79 1uom h THR 431 CO -0.07 0.45 0.27 -1.28 0.37 0.00 0.00 175.52 175.27 1uom h SER 432 N 0.48 0.42 -0.84 4.18 0.87 -0.30 -1.23 113.55 117.12 1uom h SER 432 Ca 0.06 0.02 0.04 0.00 -1.23 0.00 0.00 61.79 60.67 1uom h SER 432 Cb 0.82 -0.07 -0.05 0.00 -0.44 0.00 0.00 62.40 62.66 1uom h SER 432 CO 0.07 0.29 0.53 -1.28 -0.53 0.00 0.00 176.83 175.91 1uom h SER 433 N 0.54 0.87 -0.47 6.23 0.87 -0.45 -1.24 113.55 119.90 1uom h SER 433 Ca 0.21 0.00 -0.07 0.00 -1.23 0.00 0.00 61.79 60.70 1uom h SER 433 Cb 0.08 -0.19 -0.02 0.00 -0.44 0.00 0.00 62.40 61.83 1uom h SER 433 CO -0.12 0.59 0.06 -0.09 -0.53 0.00 0.00 176.83 176.74 1uom h ARG 434 N 1.02 0.85 -0.73 2.24 9.65 -0.47 0.13 114.38 127.08 1uom h ARG 434 Ca 0.34 -0.21 -0.03 0.00 -1.10 0.00 0.00 59.98 58.99 1uom h ARG 434 Cb 0.05 -0.11 -0.03 0.00 -1.39 0.00 0.00 29.97 28.49 1uom h ARG 434 CO -0.13 0.82 0.35 0.74 2.80 0.00 0.00 179.97 184.55 1uom h PHE 435 N 0.81 1.05 -0.43 2.20 -1.00 -0.39 0.10 116.94 119.27 1uom h PHE 435 Ca 0.16 -0.05 -0.02 0.00 2.81 0.00 0.00 57.97 60.87 1uom h PHE 435 Cb 0.40 -0.33 -0.02 0.00 3.61 0.00 0.00 35.95 39.61 1uom h PHE 435 CO 0.02 0.77 0.18 0.00 -1.61 0.00 0.00 178.31 177.68 1uom h ARG 436 N 1.02 0.63 -0.71 1.51 3.08 -0.54 0.46 114.38 119.82 1uom h ARG 436 Ca 0.25 -0.11 0.05 0.00 0.07 0.00 0.00 59.98 60.25 1uom h ARG 436 Cb 0.11 -0.11 -0.05 0.00 0.08 0.00 0.00 29.97 30.01 1uom h ARG 436 CO -0.03 0.57 0.42 1.98 -1.07 0.00 0.00 179.97 181.83 1uom h MET 437 N 0.54 0.76 -0.00 0.04 4.05 -0.43 -2.08 114.93 117.80 1uom h MET 437 Ca 0.14 -0.05 0.00 0.00 -0.28 0.00 0.00 59.70 59.52 1uom h MET 437 Cb 0.17 -0.17 0.00 0.00 -0.80 0.00 0.00 31.60 30.80 1uom h MET 437 CO -0.01 0.50 -0.19 -1.33 0.23 0.00 0.00 176.91 176.11 1uom n MET 438 N -4.73 0.25 -3.67 0.39 2.81 -0.03 -4.95 117.12 107.20 1uom n MET 438 Ca 0.09 -0.09 -0.25 0.00 -1.81 0.00 0.00 57.70 55.64 1uom n MET 438 Cb 0.16 -1.50 0.03 0.00 -0.71 0.00 0.00 33.22 31.20 1uom n MET 438 CO 0.00 0.00 0.00 -1.71 1.51 0.00 0.00 175.97 175.77 1uom n ASN 439 N -1.30 -3.40 -4.78 7.83 5.15 0.13 -4.88 115.26 114.01 1uom n ASN 439 Ca 0.09 -0.91 -0.41 0.00 -0.60 0.00 0.00 54.58 52.75 1uom n ASN 439 Cb 0.32 -3.79 -0.00 0.00 -0.53 0.00 0.00 39.78 35.77 1uom n ASN 439 CO 0.00 0.00 0.00 -0.22 1.40 0.00 0.00 177.26 178.44 1uom s LEU 440 N -6.47 4.31 0.06 1.20 2.96 -1.05 -5.01 118.68 114.68 1uom s LEU 440 Ca 0.25 2.97 0.01 0.00 -0.22 0.00 0.00 54.13 57.14 1uom s LEU 440 Cb -0.08 -3.70 -0.04 0.00 0.50 0.00 0.00 46.19 42.87 1uom s LEU 440 CO 0.83 -0.85 0.16 -1.10 -1.32 0.00 0.00 176.35 174.07 1uom s GLN 441 N -2.09 3.24 0.44 1.98 -1.52 -1.26 -4.97 119.66 115.48 1uom s GLN 441 Ca 0.53 -0.52 0.24 0.00 -1.95 0.00 0.00 55.36 53.66 1uom s GLN 441 Cb -0.45 -2.93 1.23 0.00 -0.22 0.00 0.00 33.01 30.64 1uom s GLN 441 CO 0.60 0.60 1.78 0.78 -0.25 0.00 0.00 175.29 178.80 1uom h GLY 442 N 3.23 0.90 1.42 3.09 0.00 -1.99 0.22 103.07 109.94 1uom h GLY 442 Ca -0.46 -0.15 -0.18 0.00 0.00 0.00 0.00 47.33 46.54 1uom h GLY 442 CO 0.72 -0.11 -0.64 0.83 0.00 0.00 0.00 176.54 177.33 1uom h GLU 443 N 0.28 0.59 -0.35 4.80 3.07 -1.98 -2.71 114.58 118.28 1uom h GLU 443 Ca 0.59 -0.42 -0.09 0.00 -0.50 0.00 0.00 59.36 58.94 1uom h GLU 443 Cb 1.73 0.07 -0.01 0.00 -0.84 0.00 0.00 28.75 29.70 1uom h GLU 443 CO -0.23 1.04 -0.14 0.93 -1.40 0.00 0.00 179.01 179.21 1uom h GLU 444 N 0.43 0.71 -0.15 2.33 5.08 -1.09 -3.01 114.58 118.88 1uom h GLU 444 Ca -0.01 -0.30 0.05 0.00 -1.00 0.00 0.00 59.36 58.10 1uom h GLU 444 Cb 1.22 -0.03 -0.06 0.00 0.50 0.00 0.00 28.75 30.39 1uom h GLU 444 CO 0.12 0.90 -0.21 0.35 -1.00 0.00 0.00 179.01 179.17 1uom h PHE 445 N 0.49 -0.54 -0.45 4.33 3.57 -0.73 -1.57 116.94 122.03 1uom h PHE 445 Ca 0.08 0.03 -0.03 0.00 3.53 0.00 0.00 57.97 61.58 1uom h PHE 445 Cb 0.67 0.26 -0.02 0.00 2.79 0.00 0.00 35.95 39.65 1uom h PHE 445 CO 0.06 -0.29 0.15 -0.39 -2.23 0.00 0.00 178.31 175.61 1uom h VAL 446 N -0.25 1.18 -0.66 1.41 -1.51 -1.52 -1.74 116.25 113.16 1uom h VAL 446 Ca 0.11 -0.61 -0.03 0.00 -1.23 0.00 0.00 66.70 64.94 1uom h VAL 446 Cb 0.41 0.68 -0.03 0.00 -2.13 0.00 0.00 31.29 30.22 1uom h VAL 446 CO -0.30 0.23 0.30 0.00 -1.23 0.00 0.00 177.57 176.58 1uom h LEU 448 N 0.92 0.94 -1.11 0.00 3.38 -0.76 -0.83 115.31 117.85 1uom h LEU 448 Ca 0.22 -0.26 -0.08 0.00 0.09 0.00 0.00 57.88 57.85 1uom h LEU 448 Cb 0.14 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.63 1uom h LEU 448 CO -0.03 0.97 -0.24 0.50 0.09 0.00 0.00 178.44 179.73 1uom h LYS 449 N 0.88 0.33 -0.07 1.13 3.64 -1.12 -0.77 116.57 120.60 1uom h LYS 449 Ca 0.18 -0.11 -0.20 0.00 -1.27 0.00 0.00 60.65 59.24 1uom h LYS 449 Cb 0.43 -0.03 -0.00 0.00 -0.41 0.00 0.00 32.23 32.23 1uom h LYS 449 CO 0.01 0.56 -0.79 0.77 -2.27 0.00 0.00 179.45 177.73 1uom h SER 450 N 0.30 0.57 -0.37 4.20 0.02 -1.04 -2.71 113.55 114.53 1uom h SER 450 Ca 0.05 -0.40 -0.03 0.00 -0.84 0.00 0.00 61.79 60.57 1uom h SER 450 Cb 0.59 -0.17 -0.02 0.00 0.14 0.00 0.00 62.40 62.95 1uom h SER 450 CO 0.04 1.16 0.12 0.40 -1.14 0.00 0.00 176.83 177.42 1uom h ILE 451 N 0.31 1.21 -0.36 3.27 2.04 -0.69 -2.40 117.51 120.88 1uom h ILE 451 Ca -0.05 -0.67 0.06 0.00 1.00 0.00 0.00 64.86 65.21 1uom h ILE 451 Cb 1.39 0.95 -0.05 0.00 -0.74 0.00 0.00 36.82 38.37 1uom h ILE 451 CO 0.14 0.23 0.05 0.40 0.00 0.00 0.00 178.15 178.97 1uom h ILE 452 N 0.45 0.78 -0.57 -0.67 2.04 -1.13 0.29 117.51 118.71 1uom h ILE 452 Ca 0.12 -0.05 0.06 0.00 1.00 0.00 0.00 64.86 65.99 1uom h ILE 452 Cb 0.24 0.61 -0.06 0.00 -0.74 0.00 0.00 36.82 36.87 1uom h ILE 452 CO -0.01 0.03 0.27 0.25 0.00 0.00 0.00 178.15 178.69 1uom h LEU 453 N 0.16 0.35 0.00 1.44 5.85 -1.29 -0.80 115.31 121.02 1uom h LEU 453 Ca 0.18 0.04 -0.10 0.00 0.84 0.00 0.00 57.88 58.84 1uom h LEU 453 Cb 0.22 -0.01 -0.02 0.00 0.37 0.00 0.00 40.66 41.22 1uom h LEU 453 CO -0.25 0.23 -0.76 -0.07 -0.34 0.00 0.00 178.44 177.24 1uom h LEU 454 N 0.50 0.00 0.06 2.25 3.38 -1.09 -3.40 115.31 117.01 1uom h LEU 454 Ca 0.26 0.00 -0.33 0.00 0.09 0.00 0.00 57.88 57.91 1uom h LEU 454 Cb 0.22 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.94 1uom h LEU 454 CO -0.21 0.41 -1.81 -3.20 0.09 0.00 0.00 178.44 173.72 1uom n ASN 455 N -3.05 2.00 -0.36 -0.43 5.15 0.10 -4.16 115.26 114.51 1uom n ASN 455 Ca -0.01 0.27 0.29 0.00 -0.60 0.00 0.00 54.58 54.53 1uom n ASN 455 Cb 0.72 -0.86 0.58 0.00 -0.53 0.00 0.00 39.78 39.69 1uom n ASN 455 CO 0.00 0.00 0.00 0.28 1.40 0.00 0.00 177.26 178.94 1uom h SER 456 N -0.44 0.33 -0.21 1.20 0.02 -1.34 -1.78 113.55 111.33 1uom h SER 456 Ca -0.43 0.09 0.00 0.00 -0.84 0.00 0.00 61.79 60.61 1uom h SER 456 Cb 1.71 0.05 0.00 0.00 0.14 0.00 0.00 62.40 64.29 1uom h SER 456 CO -0.09 -0.01 0.00 0.61 -1.14 0.00 0.00 176.83 176.20 1uom n GLY 457 N -1.52 2.46 0.01 -3.77 0.00 -1.26 -4.66 105.19 96.45 1uom n GLY 457 Ca 0.29 -0.24 0.10 0.00 0.00 0.00 0.00 46.02 46.16 1uom n GLY 457 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 1uom n VAL 458 N 0.20 0.67 0.59 1.61 3.14 -0.67 -2.73 118.33 121.13 1uom n VAL 458 Ca 0.07 0.16 0.09 0.00 -2.96 0.00 0.00 64.34 61.70 1uom n VAL 458 Cb 0.35 -0.84 0.10 0.00 -1.06 0.00 0.00 33.84 32.39 1uom n VAL 458 CO 0.00 0.00 0.00 -1.22 -6.46 0.00 0.00 176.83 169.15 1uom n TYR 459 N -1.55 0.12 -2.04 1.45 4.01 -1.26 -4.51 117.16 113.38 1uom n TYR 459 Ca 0.05 -0.08 -0.12 0.00 -0.16 0.00 0.00 57.90 57.58 1uom n TYR 459 Cb 0.23 -0.00 0.07 0.00 -0.31 0.00 0.00 39.34 39.33 1uom n TYR 459 CO 0.00 0.00 0.00 0.25 -0.46 0.00 0.00 176.86 176.65 1uom n THR 460 N 1.04 2.18 0.10 -0.72 -2.24 -1.11 -4.66 114.28 108.87 1uom n THR 460 Ca 0.12 -3.67 -0.02 0.00 -2.27 0.00 0.00 64.05 58.21 1uom n THR 460 Cb 0.47 -0.52 -0.05 0.00 -2.10 0.00 0.00 70.33 68.13 1uom n THR 460 CO 0.00 0.00 0.00 -0.26 -0.57 0.00 0.00 175.07 174.24 1uom h PHE 461 N 1.89 0.00 -6.10 4.78 0.04 -1.79 -3.48 116.94 112.28 1uom h PHE 461 Ca 0.19 0.00 -0.40 0.00 2.80 0.00 0.00 57.97 60.56 1uom h PHE 461 Cb 1.39 0.00 0.10 0.00 2.20 0.00 0.00 35.95 39.65 1uom h PHE 461 CO 0.75 0.73 -0.92 1.28 -0.60 0.00 0.00 178.31 179.56 1uom n LEU 462 N -3.26 -3.30 -3.56 1.54 4.32 -1.26 -5.00 117.00 106.47 1uom n LEU 462 Ca 0.00 -0.96 -0.16 0.00 -0.02 0.00 0.00 56.01 54.87 1uom n LEU 462 Cb 0.84 -2.53 -0.06 0.00 -1.62 0.00 0.00 43.42 40.04 1uom n LEU 462 CO 0.44 0.41 0.44 -0.55 -1.22 0.00 0.00 177.39 176.90 1uom s SER 463 N -3.50 -0.69 -0.09 -1.43 0.15 -1.26 -5.05 113.70 101.84 1uom s SER 463 Ca 0.45 1.00 0.13 0.00 0.70 0.00 0.00 55.95 58.23 1uom s SER 463 Cb -0.14 0.91 0.22 0.00 -1.71 0.00 0.00 66.02 65.29 1uom s SER 463 CO 0.84 -0.46 1.11 -1.20 1.20 0.00 0.00 173.24 174.73 1uom n SER 464 N 1.62 1.46 -4.73 5.45 7.64 -1.26 -4.78 113.62 119.02 1uom n SER 464 Ca -0.17 -2.75 -0.31 0.00 1.01 0.00 0.00 58.87 56.65 1uom n SER 464 Cb 0.56 -0.36 0.12 0.00 -1.01 0.00 0.00 64.21 63.53 1uom n SER 464 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 1uom s THR 465 N -1.83 2.86 0.20 0.44 -4.23 -1.26 -4.81 115.64 107.01 1uom s THR 465 Ca 0.22 0.28 -0.11 0.00 -1.18 0.00 0.00 61.69 60.91 1uom s THR 465 Cb 0.20 -2.64 0.14 0.00 1.34 0.00 0.00 72.50 71.54 1uom s THR 465 CO 0.00 -0.36 1.85 0.25 -0.54 0.00 0.00 174.62 175.82 1uom h LEU 466 N -1.44 0.74 -0.62 4.79 6.46 -1.99 -1.57 115.31 121.67 1uom h LEU 466 Ca -0.45 -0.01 -0.01 0.00 -0.12 0.00 0.00 57.88 57.29 1uom h LEU 466 Cb 1.25 -0.17 -0.03 0.00 -0.73 0.00 0.00 40.66 40.99 1uom h LEU 466 CO 0.50 0.52 0.36 0.50 -0.62 0.00 0.00 178.44 179.69 1uom h LYS 467 N 0.87 0.85 0.00 1.25 3.64 -1.99 -0.51 116.57 120.68 1uom h LYS 467 Ca 0.27 -0.09 -0.06 0.00 -1.27 0.00 0.00 60.65 59.50 1uom h LYS 467 Cb -0.02 -0.17 -0.01 0.00 -0.41 0.00 0.00 32.23 31.61 1uom h LYS 467 CO -0.09 0.63 -0.30 0.77 -2.27 0.00 0.00 179.45 178.18 1uom h SER 468 N 0.84 0.00 0.20 4.20 0.02 -1.83 -1.08 113.55 115.90 1uom h SER 468 Ca 0.22 0.00 -0.21 0.00 -0.84 0.00 0.00 61.79 60.96 1uom h SER 468 Cb 0.01 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.55 1uom h SER 468 CO -0.04 0.30 -0.82 -0.07 -1.14 0.00 0.00 176.83 175.06 1uom h LEU 469 N 0.00 0.60 -0.48 5.07 3.38 -0.54 -1.21 115.31 122.13 1uom h LEU 469 Ca -0.00 -0.43 -0.17 0.00 0.09 0.00 0.00 57.88 57.37 1uom h LEU 469 Cb 0.58 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.13 1uom h LEU 469 CO 0.04 1.20 -0.74 -0.33 0.09 0.00 0.00 178.44 178.70 1uom h GLU 470 N 0.32 0.17 0.24 1.13 5.08 -0.76 -1.85 114.58 118.90 1uom h GLU 470 Ca -0.06 -0.15 -0.01 0.00 -1.00 0.00 0.00 59.36 58.14 1uom h GLU 470 Cb 1.43 0.04 0.00 0.00 0.50 0.00 0.00 28.75 30.72 1uom h GLU 470 CO 0.15 0.84 -0.11 0.93 -1.00 0.00 0.00 179.01 179.81 1uom h GLU 471 N 0.11 -0.31 -0.69 2.33 4.39 -1.13 0.16 114.58 119.44 1uom h GLU 471 Ca -0.02 0.02 0.10 0.00 0.34 0.00 0.00 59.36 59.80 1uom h GLU 471 Cb 1.31 0.07 -0.07 0.00 -0.10 0.00 0.00 28.75 29.95 1uom h GLU 471 CO 0.11 0.06 0.33 0.87 -1.16 0.00 0.00 179.01 179.21 1uom h LYS 472 N -0.76 0.54 0.07 2.33 1.57 -1.27 0.10 116.57 119.15 1uom h LYS 472 Ca -0.03 -0.03 0.02 0.00 -1.87 0.00 0.00 60.65 58.74 1uom h LYS 472 Cb 0.50 -0.12 -0.03 0.00 0.08 0.00 0.00 32.23 32.66 1uom h LYS 472 CO 0.05 0.36 -0.23 0.22 -0.57 0.00 0.00 179.45 179.28 1uom h ASP 473 N 0.55 -0.66 -0.18 0.86 3.58 -1.25 -2.03 116.42 117.30 1uom h ASP 473 Ca 0.35 0.08 -0.00 0.00 0.42 0.00 0.00 57.03 57.88 1uom h ASP 473 Cb 0.39 0.26 -0.01 0.00 1.72 0.00 0.00 39.33 41.69 1uom h ASP 473 CO -0.29 -0.31 0.11 -0.74 -2.88 0.00 0.00 179.24 175.14 1uom h HIS 474 N -0.40 0.24 -0.19 0.28 2.76 0.27 -1.89 115.15 116.23 1uom h HIS 474 Ca 0.04 0.00 -0.19 0.00 -2.20 0.00 0.00 60.37 58.03 1uom h HIS 474 Cb 0.44 -0.08 0.01 0.00 1.55 0.00 0.00 27.41 29.33 1uom h HIS 474 CO -0.24 0.17 -0.60 0.82 -1.30 0.00 0.00 177.93 176.78 1uom h ILE 475 N 0.26 1.30 0.00 6.26 2.04 -0.40 -2.52 117.51 124.45 1uom h ILE 475 Ca 0.07 -1.82 0.00 0.00 1.00 0.00 0.00 64.86 64.11 1uom h ILE 475 Cb -0.00 1.89 0.00 0.00 -0.74 0.00 0.00 36.82 37.97 1uom h ILE 475 CO -0.01 0.58 0.00 0.45 0.00 0.00 0.00 178.15 179.16 1uom h HIS 476 N 0.47 0.00 0.14 1.37 3.86 -1.04 -0.47 115.15 119.48 1uom h HIS 476 Ca -0.02 0.00 -0.29 0.00 -1.16 0.00 0.00 60.37 58.90 1uom h HIS 476 Cb 1.23 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.70 1uom h HIS 476 CO 0.09 0.00 -1.35 0.00 0.86 0.00 0.00 177.93 177.53 1uom h ARG 477 N 0.00 0.29 -0.02 2.45 2.47 -1.23 -1.87 114.38 116.47 1uom h ARG 477 Ca 0.00 -0.50 -0.01 0.00 -1.26 0.00 0.00 59.98 58.21 1uom h ARG 477 Cb 0.57 0.18 -0.00 0.00 -1.65 0.00 0.00 29.97 29.08 1uom h ARG 477 CO 0.00 1.21 -0.03 0.28 0.56 0.00 0.00 179.97 181.99 1uom h VAL 478 N 0.08 1.43 -0.77 2.04 2.07 -1.15 -2.63 116.25 117.32 1uom h VAL 478 Ca -0.18 -1.32 0.16 0.00 0.82 0.00 0.00 66.70 66.18 1uom h VAL 478 Cb 2.00 2.27 -0.10 0.00 -1.52 0.00 0.00 31.29 33.94 1uom h VAL 478 CO 0.20 0.35 0.28 -0.07 0.02 0.00 0.00 177.57 178.34 1uom h LEU 479 N -0.47 0.21 -0.97 2.57 3.38 -1.16 0.28 115.31 119.14 1uom h LEU 479 Ca 0.00 0.13 0.02 0.00 0.09 0.00 0.00 57.88 58.12 1uom h LEU 479 Cb 0.59 0.12 -0.05 0.00 0.09 0.00 0.00 40.66 41.41 1uom h LEU 479 CO 0.01 0.05 0.64 0.44 0.09 0.00 0.00 178.44 179.67 1uom h ASP 480 N 0.39 1.09 -0.60 -0.43 3.32 -1.28 -0.47 116.42 118.44 1uom h ASP 480 Ca 0.43 -0.02 0.05 0.00 0.02 0.00 0.00 57.03 57.51 1uom h ASP 480 Cb 0.70 -0.26 -0.05 0.00 0.22 0.00 0.00 39.33 39.94 1uom h ASP 480 CO -0.45 0.77 0.33 0.11 -1.72 0.00 0.00 179.24 178.29 1uom h LYS 481 N 1.28 0.62 -0.20 3.56 1.79 -0.13 -0.42 116.57 123.07 1uom h LYS 481 Ca 0.37 -0.04 -0.06 0.00 -2.18 0.00 0.00 60.65 58.75 1uom h LYS 481 Cb -0.09 -0.14 -0.01 0.00 -1.58 0.00 0.00 32.23 30.41 1uom h LYS 481 CO -0.10 0.41 -0.13 0.82 -1.08 0.00 0.00 179.45 179.37 1uom h ILE 482 N 0.64 1.20 -0.09 1.86 2.04 -0.01 -1.11 117.51 122.03 1uom h ILE 482 Ca 0.26 -0.88 -0.01 0.00 1.00 0.00 0.00 64.86 65.23 1uom h ILE 482 Cb 0.13 1.19 -0.00 0.00 -0.74 0.00 0.00 36.82 37.40 1uom h ILE 482 CO -0.15 0.28 0.01 0.74 0.00 0.00 0.00 178.15 179.03 1uom h THR 483 N 0.31 1.22 -0.82 -0.27 2.02 0.16 -0.76 112.91 114.77 1uom h THR 483 Ca 0.06 -0.68 0.10 0.00 0.77 0.00 0.00 66.41 66.66 1uom h THR 483 Cb 0.42 1.50 -0.08 0.00 -1.74 0.00 0.00 68.15 68.25 1uom h THR 483 CO 0.02 0.19 0.45 0.44 0.37 0.00 0.00 175.52 177.00 1uom h ASP 484 N -0.08 0.62 -0.48 4.18 3.32 -0.77 -1.46 116.42 121.74 1uom h ASP 484 Ca 0.03 0.06 -0.02 0.00 0.02 0.00 0.00 57.03 57.11 1uom h ASP 484 Cb 0.29 -0.06 -0.02 0.00 0.22 0.00 0.00 39.33 39.76 1uom h ASP 484 CO 0.00 0.34 0.22 0.74 -1.72 0.00 0.00 179.24 178.82 1uom h THR 485 N 0.74 1.20 -0.57 0.35 2.02 -0.82 -0.54 112.91 115.29 1uom h THR 485 Ca 0.41 -0.59 0.02 0.00 0.77 0.00 0.00 66.41 67.02 1uom h THR 485 Cb 0.42 0.69 -0.03 0.00 -1.74 0.00 0.00 68.15 67.49 1uom h THR 485 CO -0.27 0.23 0.35 -0.07 0.37 0.00 0.00 175.52 176.13 1uom h LEU 486 N 0.64 0.58 -0.23 2.58 3.38 -0.23 -1.47 115.31 120.56 1uom h LEU 486 Ca 0.16 -0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.11 1uom h LEU 486 Cb 0.15 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.77 1uom h LEU 486 CO -0.02 0.41 0.07 0.40 0.09 0.00 0.00 178.44 179.39 1uom h ILE 487 N 0.70 1.20 -0.43 1.22 2.04 -1.09 -2.26 117.51 118.89 1uom h ILE 487 Ca 0.22 -0.63 0.09 0.00 1.00 0.00 0.00 64.86 65.54 1uom h ILE 487 Cb -0.00 1.18 -0.09 0.00 -0.74 0.00 0.00 36.82 37.16 1uom h ILE 487 CO -0.09 0.20 -0.24 -0.74 0.00 0.00 0.00 178.15 177.29 1uom h HIS 488 N 0.20 -0.62 -0.55 1.37 2.76 -0.61 0.33 115.15 118.03 1uom h HIS 488 Ca 0.07 0.05 0.10 0.00 -2.20 0.00 0.00 60.37 58.40 1uom h HIS 488 Cb 0.25 0.34 -0.08 0.00 1.55 0.00 0.00 27.41 29.47 1uom h HIS 488 CO 0.01 -0.32 0.10 -0.07 -1.30 0.00 0.00 177.93 176.35 1uom h LEU 489 N -0.16 -0.02 -1.19 0.26 3.38 -1.08 -0.52 115.31 115.98 1uom h LEU 489 Ca 0.20 0.10 -0.08 0.00 0.09 0.00 0.00 57.88 58.20 1uom h LEU 489 Cb 0.47 0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.36 1uom h LEU 489 CO -0.52 0.01 -0.32 0.24 0.09 0.00 0.00 178.44 177.94 1uom h MET 490 N 0.24 0.15 -0.34 1.13 2.86 -0.45 -0.96 114.93 117.55 1uom h MET 490 Ca 0.28 -0.06 -0.09 0.00 -2.06 0.00 0.00 59.70 57.78 1uom h MET 490 Cb 0.40 -0.01 -0.01 0.00 0.06 0.00 0.00 31.60 32.05 1uom h MET 490 CO -0.37 0.46 -0.14 0.00 1.06 0.00 0.00 176.91 177.91 1uom h ALA 491 N 1.54 0.48 -0.06 6.32 0.00 0.81 -2.52 119.26 125.83 1uom h ALA 491 Ca 0.02 -0.33 -0.09 0.00 0.00 0.00 0.00 54.91 54.50 1uom h ALA 491 Cb 0.63 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.29 1uom h ALA 491 CO 0.05 0.37 -0.40 0.87 0.00 0.00 0.00 179.25 180.14 1uom h LYS 492 N 0.47 0.13 0.00 0.00 1.57 -0.82 -2.05 116.57 115.88 1uom h LYS 492 Ca 0.08 -0.06 0.00 0.00 -1.87 0.00 0.00 60.65 58.80 1uom h LYS 492 Cb 0.67 -0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.97 1uom h LYS 492 CO 0.05 0.51 0.00 0.00 -0.57 0.00 0.00 179.45 179.44 1uom n ALA 493 N -2.47 1.51 0.00 3.86 0.00 -0.39 -4.86 120.51 118.16 1uom n ALA 493 Ca -0.02 0.07 0.00 0.00 0.00 0.00 0.00 53.44 53.49 1uom n ALA 493 Cb 0.45 -1.31 0.00 0.00 0.00 0.00 0.00 19.45 18.59 1uom n ALA 493 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1uom n GLY 494 N -0.32 1.20 3.72 0.00 0.00 -0.77 -5.08 105.19 103.94 1uom n GLY 494 Ca 0.02 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.64 1uom n GLY 494 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1uom n LEU 495 N 0.00 4.85 -4.65 0.99 4.32 -0.96 -5.00 117.00 116.54 1uom n LEU 495 Ca 0.00 1.03 -0.30 0.00 -0.02 0.00 0.00 56.01 56.72 1uom n LEU 495 Cb 0.00 -1.54 0.23 0.00 -1.62 0.00 0.00 43.42 40.49 1uom n LEU 495 CO 0.00 -0.62 0.67 0.42 -1.22 0.00 0.00 177.39 176.64 1uom s THR 496 N -1.26 1.67 0.13 -5.08 -4.23 -1.26 -4.58 115.64 101.03 1uom s THR 496 Ca 0.67 0.00 -0.17 0.00 -1.18 0.00 0.00 61.69 61.01 1uom s THR 496 Cb -0.45 -2.58 -0.02 0.00 1.34 0.00 0.00 72.50 70.79 1uom s THR 496 CO 0.53 0.00 1.71 -0.07 -0.54 0.00 0.00 174.62 176.25 1uom h LEU 497 N -2.42 0.46 -0.14 4.79 3.38 -1.98 -1.07 115.31 118.33 1uom h LEU 497 Ca -0.45 -0.12 0.02 0.00 0.09 0.00 0.00 57.88 57.42 1uom h LEU 497 Cb 1.28 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 41.89 1uom h LEU 497 CO 0.34 0.46 0.02 -0.61 0.09 0.00 0.00 178.44 178.74 1uom h GLN 498 N 0.44 0.07 -0.02 1.13 4.15 -2.00 -1.70 115.11 117.17 1uom h GLN 498 Ca 0.12 -0.00 -0.02 0.00 0.77 0.00 0.00 58.65 59.51 1uom h GLN 498 Cb 0.12 -0.02 -0.00 0.00 0.21 0.00 0.00 27.48 27.79 1uom h GLN 498 CO -0.02 0.05 -0.10 1.96 -1.93 0.00 0.00 178.83 178.79 1uom h GLN 499 N 0.07 0.03 -0.15 1.69 4.20 -1.88 -1.06 115.11 118.02 1uom h GLN 499 Ca 0.06 -0.00 -0.02 0.00 0.06 0.00 0.00 58.65 58.74 1uom h GLN 499 Cb 0.06 -0.01 -0.01 0.00 0.30 0.00 0.00 27.48 27.83 1uom h GLN 499 CO -0.09 0.14 -0.00 1.96 -0.67 0.00 0.00 178.83 180.16 1uom h GLN 500 N 0.03 0.26 0.19 1.46 4.20 -0.38 -1.13 115.11 119.74 1uom h GLN 500 Ca 0.01 -0.09 -0.01 0.00 0.06 0.00 0.00 58.65 58.62 1uom h GLN 500 Cb 0.20 -0.02 0.00 0.00 0.30 0.00 0.00 27.48 27.96 1uom h GLN 500 CO 0.01 0.50 -0.09 0.45 -0.67 0.00 0.00 178.83 179.03 1uom h HIS 501 N -0.00 -0.24 -0.77 2.96 3.86 -0.81 -1.00 115.15 119.15 1uom h HIS 501 Ca 0.04 -0.01 0.06 0.00 -1.16 0.00 0.00 60.37 59.31 1uom h HIS 501 Cb 0.38 0.08 -0.06 0.00 1.06 0.00 0.00 27.41 28.88 1uom h HIS 501 CO 0.04 -0.06 0.46 1.96 0.86 0.00 0.00 177.93 181.18 1uom h GLN 502 N -0.38 0.81 -0.19 2.45 4.20 -1.22 -1.17 115.11 119.62 1uom h GLN 502 Ca -0.03 -0.05 -0.15 0.00 0.06 0.00 0.00 58.65 58.48 1uom h GLN 502 Cb 0.29 -0.18 -0.01 0.00 0.30 0.00 0.00 27.48 27.88 1uom h GLN 502 CO 0.04 0.54 -0.51 -0.09 -0.67 0.00 0.00 178.83 178.14 1uom h ARG 503 N 0.84 0.52 -0.23 1.46 2.43 -1.13 -1.13 114.38 117.14 1uom h ARG 503 Ca 0.34 -0.31 -0.01 0.00 -0.81 0.00 0.00 59.98 59.19 1uom h ARG 503 Cb 0.17 0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 29.74 1uom h ARG 503 CO -0.17 0.91 0.12 1.25 -1.51 0.00 0.00 179.97 180.57 1uom h LEU 504 N 0.41 0.30 -0.52 3.80 5.85 -0.72 -1.42 115.31 123.01 1uom h LEU 504 Ca 0.02 -0.10 -0.01 0.00 0.84 0.00 0.00 57.88 58.63 1uom h LEU 504 Cb 1.04 -0.08 -0.02 0.00 0.37 0.00 0.00 40.66 41.97 1uom h LEU 504 CO 0.10 0.31 0.29 0.00 -0.34 0.00 0.00 178.44 178.80 1uom h ALA 505 N 1.00 0.67 -0.53 1.25 0.00 -1.07 -0.69 119.26 119.89 1uom h ALA 505 Ca 0.08 -0.09 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 1uom h ALA 505 Cb 0.09 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.64 1uom h ALA 505 CO -0.01 0.18 0.25 1.96 0.00 0.00 0.00 179.25 181.63 1uom h GLN 506 N 0.70 0.74 -0.01 0.00 4.20 -1.02 -0.52 115.11 119.18 1uom h GLN 506 Ca 0.18 -0.09 -0.01 0.00 0.06 0.00 0.00 58.65 58.80 1uom h GLN 506 Cb 0.04 -0.14 -0.00 0.00 0.30 0.00 0.00 27.48 27.68 1uom h GLN 506 CO -0.03 0.58 -0.02 -0.07 -0.67 0.00 0.00 178.83 178.62 1uom h LEU 507 N 0.74 0.04 -0.79 1.46 3.38 -0.74 -3.10 115.31 116.31 1uom h LEU 507 Ca 0.19 -0.53 -0.03 0.00 0.09 0.00 0.00 57.88 57.59 1uom h LEU 507 Cb 0.08 -0.01 -0.04 0.00 0.09 0.00 0.00 40.66 40.78 1uom h LEU 507 CO -0.02 0.57 0.36 -0.07 0.09 0.00 0.00 178.44 179.36 1uom h LEU 508 N -0.48 1.04 -2.10 1.67 3.38 -0.97 -2.68 115.31 115.17 1uom h LEU 508 Ca 0.00 -0.14 -0.02 0.00 0.09 0.00 0.00 57.88 57.81 1uom h LEU 508 Cb 0.56 -0.27 -0.00 0.00 0.09 0.00 0.00 40.66 41.04 1uom h LEU 508 CO 0.00 0.90 -0.08 -0.07 0.09 0.00 0.00 178.44 179.29 1uom h LEU 509 N 1.12 0.00 -1.42 1.67 3.38 -1.15 -0.33 115.31 118.59 1uom h LEU 509 Ca 0.27 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 58.19 1uom h LEU 509 Cb 0.14 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.89 1uom h LEU 509 CO -0.03 0.08 -0.23 0.40 0.09 0.00 0.00 178.44 178.74 1uom h ILE 510 N 0.00 0.71 -0.00 1.22 2.04 -1.39 -2.06 117.51 118.03 1uom h ILE 510 Ca -0.00 -0.98 -0.05 0.00 1.00 0.00 0.00 64.86 64.83 1uom h ILE 510 Cb 0.18 1.62 -0.01 0.00 -0.74 0.00 0.00 36.82 37.88 1uom h ILE 510 CO 0.01 0.23 -0.21 -0.07 0.00 0.00 0.00 178.15 178.10 1uom h LEU 511 N 0.00 0.00 -0.61 1.44 3.38 -1.10 -0.80 115.31 117.63 1uom h LEU 511 Ca -0.00 -0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.94 1uom h LEU 511 Cb 0.60 -0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.32 1uom h LEU 511 CO 0.03 0.22 0.27 0.28 0.09 0.00 0.00 178.44 179.32 1uom h SER 512 N 0.00 0.82 -0.17 -0.43 0.02 -1.44 0.86 113.55 113.21 1uom h SER 512 Ca -0.00 -0.15 -0.06 0.00 -0.84 0.00 0.00 61.79 60.74 1uom h SER 512 Cb 0.38 -0.21 -0.02 0.00 0.14 0.00 0.00 62.40 62.69 1uom h SER 512 CO 0.03 0.74 -0.07 -0.74 -1.14 0.00 0.00 176.83 175.65 1uom h HIS 513 N 0.83 0.52 -0.11 3.45 -0.00 -1.22 -1.31 115.15 117.32 1uom h HIS 513 Ca 0.20 -0.07 -0.13 0.00 -0.00 0.00 0.00 60.37 60.38 1uom h HIS 513 Cb 0.16 -0.15 -0.01 0.00 -0.00 0.00 0.00 27.41 27.42 1uom h HIS 513 CO 0.01 0.57 -0.49 0.82 -0.00 0.00 0.00 177.93 178.84 1uom h ILE 514 N 0.47 1.34 -0.32 6.26 2.04 -0.47 -0.47 117.51 126.35 1uom h ILE 514 Ca 0.09 -1.71 -0.03 0.00 1.00 0.00 0.00 64.86 64.22 1uom h ILE 514 Cb 0.42 1.79 -0.01 0.00 -0.74 0.00 0.00 36.82 38.28 1uom h ILE 514 CO 0.02 0.51 0.08 -0.09 0.00 0.00 0.00 178.15 178.68 1uom h ARG 515 N 0.23 0.51 -0.01 2.37 9.65 -0.12 -1.03 114.38 125.97 1uom h ARG 515 Ca 0.01 -0.12 0.00 0.00 -1.10 0.00 0.00 59.98 58.77 1uom h ARG 515 Cb 0.94 -0.07 -0.00 0.00 -1.39 0.00 0.00 29.97 29.45 1uom h ARG 515 CO 0.08 0.56 0.01 1.25 2.80 0.00 0.00 179.97 184.67 1uom h HIS 516 N 0.36 0.01 -0.77 2.20 2.76 -0.95 -0.85 115.15 117.91 1uom h HIS 516 Ca 0.10 0.00 0.06 0.00 -2.20 0.00 0.00 60.37 58.33 1uom h HIS 516 Cb 0.28 -0.00 -0.06 0.00 1.55 0.00 0.00 27.41 29.18 1uom h HIS 516 CO 0.01 0.02 0.47 0.52 -1.30 0.00 0.00 177.93 177.65 1uom h MET 517 N 0.01 0.84 -0.40 5.26 2.86 -0.97 -0.83 114.93 121.69 1uom h MET 517 Ca 0.00 -0.05 0.03 0.00 -2.06 0.00 0.00 59.70 57.63 1uom h MET 517 Cb 0.01 -0.19 -0.04 0.00 0.06 0.00 0.00 31.60 31.44 1uom h MET 517 CO -0.00 0.56 0.19 1.03 1.06 0.00 0.00 176.91 179.74 1uom h SER 518 N 0.87 0.26 -0.41 1.22 0.87 -0.78 0.21 113.55 115.79 1uom h SER 518 Ca 0.34 0.02 0.04 0.00 -1.23 0.00 0.00 61.79 60.96 1uom h SER 518 Cb 0.15 -0.02 -0.04 0.00 -0.44 0.00 0.00 62.40 62.05 1uom h SER 518 CO -0.16 0.19 0.18 0.78 -0.53 0.00 0.00 176.83 177.28 1uom h ASN 519 N 0.38 0.23 -0.84 6.23 -0.26 0.04 0.57 115.58 121.93 1uom h ASN 519 Ca 0.17 0.03 -0.03 0.00 -0.56 0.00 0.00 56.30 55.92 1uom h ASN 519 Cb 0.10 -0.00 -0.04 0.00 -1.06 0.00 0.00 38.32 37.31 1uom h ASN 519 CO -0.13 0.17 0.42 0.11 -1.06 0.00 0.00 177.43 176.94 1uom h LYS 520 N 0.36 1.21 -0.60 0.81 1.79 -0.80 -2.29 116.57 117.05 1uom h LYS 520 Ca 0.18 -0.17 -0.05 0.00 -2.18 0.00 0.00 60.65 58.43 1uom h LYS 520 Cb 0.13 -0.22 -0.03 0.00 -1.58 0.00 0.00 32.23 30.53 1uom h LYS 520 CO -0.16 0.92 0.16 0.78 -1.08 0.00 0.00 179.45 180.07 1uom h GLY 521 N 1.20 1.00 1.83 3.86 0.00 0.96 -2.27 103.07 109.65 1uom h GLY 521 Ca 0.29 -0.58 -0.07 0.00 0.00 0.00 0.00 47.33 46.98 1uom h GLY 521 CO -0.04 0.54 -0.23 -0.33 0.00 0.00 0.00 176.54 176.48 1uom h MET 522 N 0.89 0.20 0.39 4.80 2.86 0.61 -0.38 114.93 124.30 1uom h MET 522 Ca 0.20 -0.06 -0.02 0.00 -2.06 0.00 0.00 59.70 57.76 1uom h MET 522 Cb 0.30 -0.02 0.00 0.00 0.06 0.00 0.00 31.60 31.94 1uom h MET 522 CO -0.00 0.43 -0.19 0.93 1.06 0.00 0.00 176.91 179.14 1uom h GLU 523 N 0.19 -0.51 -0.49 1.72 5.08 -1.03 -3.16 114.58 116.38 1uom h GLU 523 Ca 0.03 0.03 0.07 0.00 -1.00 0.00 0.00 59.36 58.50 1uom h GLU 523 Cb 0.52 0.11 -0.06 0.00 0.50 0.00 0.00 28.75 29.83 1uom h GLU 523 CO 0.04 -0.19 0.15 1.25 -1.00 0.00 0.00 179.01 179.25 1uom h HIS 524 N -0.92 0.25 0.00 4.33 2.76 -1.39 -3.52 115.15 116.66 1uom h HIS 524 Ca -0.05 0.03 0.00 0.00 -2.20 0.00 0.00 60.37 58.14 1uom h HIS 524 Cb 0.55 -0.04 0.00 0.00 1.55 0.00 0.00 27.41 29.47 1uom h HIS 524 CO 0.02 0.06 0.00 -0.11 -1.30 0.00 0.00 177.93 176.60 1uom n LEU 525 N -5.05 0.00 -4.92 0.26 7.94 -0.16 -5.12 117.00 109.96 1uom n LEU 525 Ca 0.05 0.00 -0.28 0.00 -1.11 0.00 0.00 56.01 54.67 1uom n LEU 525 Cb 0.21 0.00 -0.03 0.00 0.53 0.00 0.00 43.42 44.13 1uom n LEU 525 CO 0.23 0.00 0.01 -2.84 -1.11 0.00 0.00 177.39 173.68 1uom s PRO 535 N 0.00 3.53 0.43 1.96 0.02 -1.26 -5.06 135.00 134.62 1uom s PRO 535 Ca 0.00 -0.32 0.10 0.00 0.02 0.00 0.00 61.00 60.81 1uom s PRO 535 Cb 0.00 -2.86 0.96 0.00 0.02 0.00 0.00 34.50 32.62 1uom s PRO 535 CO 0.00 0.43 2.04 1.25 -0.33 0.00 0.00 177.00 180.39 1uom h LEU 536 N 2.20 0.26 0.36 -5.54 5.85 -2.02 -1.75 115.31 114.66 1uom h LEU 536 Ca -0.47 -0.02 -0.01 0.00 0.84 0.00 0.00 57.88 58.21 1uom h LEU 536 Cb 1.18 -0.07 -0.00 0.00 0.37 0.00 0.00 40.66 42.15 1uom h LEU 536 CO 0.69 0.26 -0.20 0.22 -0.34 0.00 0.00 178.44 179.07 1uom h TYR 537 N 0.29 -0.52 -0.75 1.25 5.03 -1.98 0.13 116.97 120.42 1uom h TYR 537 Ca 0.07 -0.01 -0.02 0.00 2.58 0.00 0.00 58.73 61.35 1uom h TYR 537 Cb 0.09 0.18 -0.03 0.00 1.55 0.00 0.00 36.73 38.52 1uom h TYR 537 CO 0.00 -0.32 0.37 -0.44 -1.32 0.00 0.00 178.16 176.46 1uom h ASP 538 N -0.53 0.97 0.17 -2.11 3.45 -1.92 0.40 116.42 116.86 1uom h ASP 538 Ca -0.04 -0.13 -0.00 0.00 0.43 0.00 0.00 57.03 57.29 1uom h ASP 538 Cb 0.42 -0.25 -0.01 0.00 -0.56 0.00 0.00 39.33 38.94 1uom h ASP 538 CO 0.06 0.82 -0.13 0.25 -1.57 0.00 0.00 179.24 178.67 1uom h LEU 539 N 1.05 -0.33 -0.53 1.55 5.85 -1.17 -1.38 115.31 120.34 1uom h LEU 539 Ca 0.26 0.03 -0.01 0.00 0.84 0.00 0.00 57.88 59.00 1uom h LEU 539 Cb 0.10 0.10 -0.03 0.00 0.37 0.00 0.00 40.66 41.21 1uom h LEU 539 CO -0.03 -0.20 0.30 -0.07 -0.34 0.00 0.00 178.44 178.09 1uom h LEU 540 N -0.31 0.65 0.11 2.25 4.07 -0.41 -2.78 115.31 118.90 1uom h LEU 540 Ca -0.01 -0.08 0.01 0.00 0.08 0.00 0.00 57.88 57.87 1uom h LEU 540 Cb 0.27 -0.17 -0.03 0.00 1.08 0.00 0.00 40.66 41.82 1uom h LEU 540 CO -0.00 0.55 -0.33 0.25 -1.08 0.00 0.00 178.44 177.82 1uom h LEU 541 N 0.71 -0.99 -1.04 1.67 5.85 0.04 0.04 115.31 121.58 1uom h LEU 541 Ca 0.19 0.10 0.28 0.00 0.84 0.00 0.00 57.88 59.29 1uom h LEU 541 Cb 0.03 0.36 -0.13 0.00 0.37 0.00 0.00 40.66 41.29 1uom h LEU 541 CO -0.03 -0.36 0.60 -0.08 -0.34 0.00 0.00 178.44 178.22 1uom h GLU 542 N -0.50 0.44 -0.31 1.25 4.57 -1.20 0.20 114.58 119.02 1uom h GLU 542 Ca -0.01 -0.03 -0.17 0.00 -1.18 0.00 0.00 59.36 57.98 1uom h GLU 542 Cb 0.49 -0.10 -0.00 0.00 -0.16 0.00 0.00 28.75 28.98 1uom h GLU 542 CO -0.16 0.29 -0.46 0.52 -1.18 0.00 0.00 179.01 178.02 1uom h MET 543 N 0.45 0.87 0.11 1.92 2.86 -1.11 -3.33 114.93 116.70 1uom h MET 543 Ca 0.68 -0.51 -0.01 0.00 -2.06 0.00 0.00 59.70 57.81 1uom h MET 543 Cb 1.47 0.04 0.00 0.00 0.06 0.00 0.00 31.60 33.17 1uom h MET 543 CO -0.51 1.15 -0.06 -0.07 1.06 0.00 0.00 176.91 178.48 1uom h LEU 544 N 0.66 -0.13 -7.79 1.22 -0.00 0.12 -3.39 115.31 105.99 1uom h LEU 544 Ca 0.03 -0.38 -0.47 0.00 -0.00 0.00 0.00 57.88 57.06 1uom h LEU 544 Cb 1.06 0.03 -0.05 0.00 -0.00 0.00 0.00 40.66 41.71 1uom h LEU 544 CO 0.11 0.35 1.57 -0.67 -0.00 0.00 0.00 178.44 179.80 1uom n ASP 545 N -4.94 3.65 -4.95 -0.43 2.03 0.41 -4.94 116.55 107.39 1uom n ASP 545 Ca -0.09 -2.77 -0.20 0.00 0.52 0.00 0.00 54.79 52.25 1uom n ASP 545 Cb 0.26 -1.70 0.04 0.00 -0.72 0.00 0.00 41.12 39.00 1uom n ASP 545 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1uom s ALA 546 N 8.32 4.14 0.00 -1.67 0.00 -1.26 -4.87 121.76 126.41 1uom s ALA 546 Ca 0.63 -1.57 0.00 0.00 0.00 0.00 0.00 51.96 51.02 1uom s ALA 546 Cb 0.02 -1.87 0.00 0.00 0.00 0.00 0.00 23.12 21.27 1uom s ALA 546 CO 0.11 -0.72 0.00 -2.39 0.00 0.00 0.00 175.76 172.76