#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2fff h TYR 338 N 0.00 0.76 0.15 2.11 0.05 -1.98 -3.06 116.97 115.00 2fff h TYR 338 Ca 0.00 0.03 0.01 0.00 0.05 0.00 0.00 58.73 58.82 2fff h TYR 338 Cb 0.00 -0.22 -0.02 0.00 1.01 0.00 0.00 36.73 37.50 2fff h TYR 338 CO 0.00 0.07 -0.21 1.25 -1.05 0.00 0.00 178.16 178.22 2fff h LEU 339 N 0.45 -0.58 -0.34 3.88 5.85 -1.98 0.15 115.31 122.75 2fff h LEU 339 Ca 0.61 0.06 0.06 0.00 0.84 0.00 0.00 57.88 59.45 2fff h LEU 339 Cb 1.41 0.21 -0.06 0.00 0.37 0.00 0.00 40.66 42.60 2fff h LEU 339 CO -0.34 -0.30 -0.05 0.22 -0.34 0.00 0.00 178.44 177.62 2fff h TYR 340 N -0.42 -0.12 0.02 1.25 5.03 -1.97 -1.60 116.97 119.16 2fff h TYR 340 Ca 0.02 0.03 -0.21 0.00 2.58 0.00 0.00 58.73 61.14 2fff h TYR 340 Cb 0.42 0.10 -0.01 0.00 1.55 0.00 0.00 36.73 38.80 2fff h TYR 340 CO -0.18 -0.11 -0.94 0.74 -1.32 0.00 0.00 178.16 176.35 2fff h PHE 341 N 0.03 0.37 0.44 -3.82 0.04 -1.51 0.13 116.94 112.63 2fff h PHE 341 Ca 0.16 -0.21 -0.02 0.00 2.80 0.00 0.00 57.97 60.70 2fff h PHE 341 Cb 0.24 -0.04 0.00 0.00 2.20 0.00 0.00 35.95 38.36 2fff h PHE 341 CO -0.28 1.05 -0.21 1.15 -0.60 0.00 0.00 178.31 179.41 2fff h THR 342 N 0.13 0.46 -0.29 -1.55 2.02 -0.61 -1.77 112.91 111.30 2fff h THR 342 Ca -0.06 -0.47 0.06 0.00 0.77 0.00 0.00 66.41 66.71 2fff h THR 342 Cb 1.58 0.65 -0.06 0.00 -1.74 0.00 0.00 68.15 68.58 2fff h THR 342 CO 0.15 0.07 -0.10 0.74 0.37 0.00 0.00 175.52 176.75 2fff h THR 343 N -0.91 0.66 -0.87 3.16 2.02 -1.34 -2.58 112.91 113.05 2fff h THR 343 Ca -0.06 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.09 2fff h THR 343 Cb 0.57 0.66 -0.04 0.00 -1.74 0.00 0.00 68.15 67.60 2fff h THR 343 CO 0.10 0.00 0.44 0.25 0.37 0.00 0.00 175.52 176.68 2fff h LEU 344 N -0.04 1.11 -0.56 2.58 5.85 -0.77 -1.93 115.31 121.56 2fff h LEU 344 Ca 0.14 -0.12 -0.11 0.00 0.84 0.00 0.00 57.88 58.63 2fff h LEU 344 Cb 0.25 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 40.98 2fff h LEU 344 CO -0.32 0.91 -0.08 0.00 -0.34 0.00 0.00 178.44 178.62 2fff h ALA 345 N 1.24 0.77 -0.13 1.25 0.00 -1.13 0.34 119.26 121.60 2fff h ALA 345 Ca 0.30 -0.34 -0.23 0.00 0.00 0.00 0.00 54.91 54.64 2fff h ALA 345 Cb 0.08 -0.20 0.01 0.00 0.00 0.00 0.00 17.79 17.67 2fff h ALA 345 CO -0.04 0.66 -0.81 1.49 0.00 0.00 0.00 179.25 180.54 2fff h GLU 346 N 0.93 0.75 -0.64 0.00 4.81 -1.40 -0.47 114.58 118.56 2fff h GLU 346 Ca 0.15 -0.64 0.03 0.00 -0.13 0.00 0.00 59.36 58.77 2fff h GLU 346 Cb 0.64 0.14 -0.04 0.00 0.63 0.00 0.00 28.75 30.12 2fff h GLU 346 CO 0.04 1.24 0.39 0.00 -0.73 0.00 0.00 179.01 179.96 2fff h ALA 347 N 0.57 0.83 0.00 2.92 0.00 -1.24 -0.72 119.26 121.62 2fff h ALA 347 Ca -0.06 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 2fff h ALA 347 Cb 1.44 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 19.04 2fff h ALA 347 CO 0.16 0.14 -0.03 -0.56 0.00 0.00 0.00 179.25 178.97 2fff h GLN 348 N 0.77 0.00 -0.40 0.00 3.07 -0.91 -1.70 115.11 115.95 2fff h GLN 348 Ca 0.26 0.00 -0.07 0.00 0.09 0.00 0.00 58.65 58.92 2fff h GLN 348 Cb 0.02 0.00 -0.02 0.00 0.08 0.00 0.00 27.48 27.56 2fff h GLN 348 CO -0.11 0.03 -0.07 0.93 0.09 0.00 0.00 178.83 179.71 2fff h GLU 349 N 0.00 0.67 -0.10 0.06 5.08 -0.64 -1.80 114.58 117.84 2fff h GLU 349 Ca -0.00 -0.19 -0.11 0.00 -1.00 0.00 0.00 59.36 58.06 2fff h GLU 349 Cb 0.96 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 30.14 2fff h GLU 349 CO 0.00 0.73 -0.35 0.00 -1.00 0.00 0.00 179.01 178.39 2fff h ARG 350 N 0.62 0.42 -0.43 2.33 2.47 -0.58 -2.81 114.38 116.40 2fff h ARG 350 Ca 0.12 -0.32 0.05 0.00 -1.26 0.00 0.00 59.98 58.57 2fff h ARG 350 Cb 0.49 0.06 -0.05 0.00 -1.65 0.00 0.00 29.97 28.82 2fff h ARG 350 CO 0.03 0.94 0.17 1.98 0.56 0.00 0.00 179.97 183.64 2fff h MET 351 N -0.01 0.33 -0.45 0.04 4.05 -1.35 0.61 114.93 118.16 2fff h MET 351 Ca -0.01 -0.02 0.06 0.00 -0.28 0.00 0.00 59.70 59.45 2fff h MET 351 Cb 0.98 -0.07 -0.09 0.00 -0.80 0.00 0.00 31.60 31.62 2fff h MET 351 CO 0.08 0.22 -0.52 -0.92 0.23 0.00 0.00 176.91 176.00 2fff h TYR 352 N 0.34 -1.56 -0.36 1.39 5.03 -1.35 0.19 116.97 120.65 2fff h TYR 352 Ca 0.20 0.08 0.05 0.00 2.58 0.00 0.00 58.73 61.64 2fff h TYR 352 Cb 0.17 0.74 -0.05 0.00 1.55 0.00 0.00 36.73 39.15 2fff h TYR 352 CO -0.14 -0.47 0.09 -0.44 -1.32 0.00 0.00 178.16 175.88 2fff h ASP 353 N -0.35 0.05 -0.32 -2.11 3.32 -1.19 -0.86 116.42 114.95 2fff h ASP 353 Ca 0.10 0.05 0.06 0.00 0.02 0.00 0.00 57.03 57.27 2fff h ASP 353 Cb 0.59 0.06 -0.06 0.00 0.22 0.00 0.00 39.33 40.14 2fff h ASP 353 CO -0.62 0.06 -0.03 0.22 -1.72 0.00 0.00 179.24 177.15 2fff h TYR 354 N 0.22 -0.08 -0.08 4.55 5.03 0.10 -3.12 116.97 123.58 2fff h TYR 354 Ca 0.17 0.03 -0.02 0.00 2.58 0.00 0.00 58.73 61.48 2fff h TYR 354 Cb 0.18 0.09 -0.00 0.00 1.55 0.00 0.00 36.73 38.54 2fff h TYR 354 CO -0.17 -0.09 -0.03 -0.07 -1.32 0.00 0.00 178.16 176.47 2fff h LEU 355 N 0.05 0.17 -0.13 2.82 3.38 -0.21 -0.54 115.31 120.85 2fff h LEU 355 Ca 0.16 -0.40 0.00 0.00 0.09 0.00 0.00 57.88 57.73 2fff h LEU 355 Cb 0.22 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 40.93 2fff h LEU 355 CO -0.29 0.53 0.23 0.00 0.09 0.00 0.00 178.44 178.99 2fff n ALA 356 N -2.33 0.58 -0.07 1.53 0.00 -0.37 -0.41 120.51 119.44 2fff n ALA 356 Ca -0.07 0.02 -0.07 0.00 0.00 0.00 0.00 53.44 53.32 2fff n ALA 356 Cb 0.25 -0.61 -0.02 0.00 0.00 0.00 0.00 19.45 19.07 2fff n ALA 356 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 2fff n GLN 357 N -1.41 0.41 0.00 0.00 3.00 -0.82 -1.40 117.38 117.16 2fff n GLN 357 Ca -0.00 0.16 0.00 0.00 -0.01 0.00 0.00 57.00 57.15 2fff n GLN 357 Cb 0.23 -1.21 0.00 0.00 0.00 0.00 0.00 30.24 29.26 2fff n GLN 357 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.06 174.93 2fff n ARG 358 N -4.08 0.00 -0.33 -1.09 0.63 -0.27 -0.97 116.66 110.56 2fff n ARG 358 Ca -0.11 0.06 -0.04 0.00 -0.92 0.00 0.00 57.85 56.84 2fff n ARG 358 Cb 0.40 -0.63 -0.05 0.00 0.45 0.00 0.00 32.46 32.63 2fff n ARG 358 CO 0.00 0.00 0.00 -0.25 -2.51 0.00 0.00 177.63 174.87 2fff n ASP 359 N -0.18 1.78 0.00 6.15 9.92 0.45 -4.05 116.55 130.63 2fff n ASP 359 Ca 0.00 -1.80 0.00 0.00 -0.53 0.00 0.00 54.79 52.46 2fff n ASP 359 Cb 0.00 -0.47 0.00 0.00 -0.64 0.00 0.00 41.12 40.01 2fff n ASP 359 CO 0.00 0.00 0.00 0.59 0.13 0.00 0.00 177.20 177.92 2fff n ASN 360 N 2.74 0.00 -3.78 -2.24 5.03 -1.21 -4.69 115.26 111.11 2fff n ASN 360 Ca 0.13 0.00 -0.31 0.00 0.87 0.00 0.00 54.58 55.27 2fff n ASN 360 Cb 0.30 0.00 0.02 0.00 -1.02 0.00 0.00 39.78 39.08 2fff n ASN 360 CO 0.00 0.00 0.00 1.33 -1.83 0.00 0.00 177.26 176.76 2fff n VAL 361 N 0.00 -4.58 -2.54 2.41 0.24 -0.14 -4.86 118.33 108.86 2fff n VAL 361 Ca 0.00 -0.51 -0.41 0.00 -2.04 0.00 0.00 64.34 61.39 2fff n VAL 361 Cb 0.00 -3.55 -0.04 0.00 -1.47 0.00 0.00 33.84 28.77 2fff n VAL 361 CO 0.00 0.00 0.00 -0.44 -2.14 0.00 0.00 176.83 174.25 2fff s SER 362 N -3.30 7.32 1.27 -1.34 0.01 -0.50 -5.02 113.70 112.15 2fff s SER 362 Ca 0.30 2.11 -0.17 0.00 1.31 0.00 0.00 55.95 59.49 2fff s SER 362 Cb -0.14 -2.61 0.32 0.00 0.21 0.00 0.00 66.02 63.80 2fff s SER 362 CO 0.90 -0.15 0.99 0.00 0.41 0.00 0.00 173.24 175.39 2fff s ALA 363 N -0.57 -0.49 0.41 1.44 0.00 -1.26 -4.71 121.76 116.58 2fff s ALA 363 Ca 0.47 -0.49 0.00 0.00 0.00 0.00 0.00 51.96 51.94 2fff s ALA 363 Cb -0.29 -3.09 0.00 0.00 0.00 0.00 0.00 23.12 19.74 2fff s ALA 363 CO 0.36 -4.11 0.77 0.36 0.00 0.00 0.00 175.76 173.14 2fff n LYS 364 N -5.18 0.02 -0.19 0.00 0.00 -1.26 0.80 118.16 112.34 2fff n LYS 364 Ca 0.07 0.58 0.26 0.00 -0.00 0.00 0.00 58.31 59.23 2fff n LYS 364 Cb 0.57 -2.20 0.41 0.00 -0.00 0.00 0.00 35.03 33.81 2fff n LYS 364 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.40 175.49 2fff n GLU 365 N -1.87 0.01 0.08 -1.58 4.07 -1.26 -0.79 120.64 119.30 2fff n GLU 365 Ca 0.00 1.00 0.07 0.00 -0.06 0.00 0.00 57.16 58.17 2fff n GLU 365 Cb 0.77 -2.48 0.35 0.00 -0.06 0.00 0.00 31.44 30.01 2fff n GLU 365 CO 0.00 0.00 0.00 -0.11 -0.06 0.00 0.00 177.13 176.96 2fff n LEU 366 N -3.17 0.32 -0.63 4.31 7.94 0.24 -0.19 117.00 125.80 2fff n LEU 366 Ca 0.22 0.62 0.12 0.00 -1.11 0.00 0.00 56.01 55.86 2fff n LEU 366 Cb 1.49 -0.62 0.39 0.00 0.53 0.00 0.00 43.42 45.20 2fff n LEU 366 CO 0.22 -0.60 0.79 1.17 -1.11 0.00 0.00 177.39 177.85 2fff n LYS 367 N -1.89 1.86 -3.23 1.96 4.81 0.03 -4.76 118.16 116.93 2fff n LYS 367 Ca 0.01 -1.26 -0.39 0.00 -0.87 0.00 0.00 58.31 55.80 2fff n LYS 367 Cb 0.09 -1.45 -0.06 0.00 0.02 0.00 0.00 35.03 33.64 2fff n LYS 367 CO 0.00 0.00 0.00 1.21 1.17 0.00 0.00 177.40 179.78 2fff s ASN 368 N -1.78 7.02 0.39 3.14 2.47 0.73 -4.98 114.94 121.92 2fff s ASN 368 Ca 0.35 1.21 0.18 0.00 0.42 0.00 0.00 52.86 55.01 2fff s ASN 368 Cb 0.20 -2.36 0.78 0.00 -1.45 0.00 0.00 41.25 38.41 2fff s ASN 368 CO 0.30 0.18 1.80 -0.08 -3.72 0.00 0.00 177.10 175.58 2fff h GLU 369 N 5.14 0.00 0.10 0.43 4.81 -1.91 -1.49 114.58 121.66 2fff h GLU 369 Ca -0.47 0.00 -0.27 0.00 -0.13 0.00 0.00 59.36 58.49 2fff h GLU 369 Cb 1.21 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 30.58 2fff h GLU 369 CO 0.67 0.36 -1.25 0.00 -0.73 0.00 0.00 179.01 178.06 2fff h ALA 370 N 1.64 0.18 -0.33 2.92 0.00 -1.93 -2.20 119.26 119.55 2fff h ALA 370 Ca -0.00 -0.94 -0.16 0.00 0.00 0.00 0.00 54.91 53.81 2fff h ALA 370 Cb 0.76 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.58 2fff h ALA 370 CO 0.05 1.06 -0.41 1.15 0.00 0.00 0.00 179.25 181.10 2fff h THR 371 N 0.06 1.28 0.16 0.00 2.02 -1.78 -2.19 112.91 112.46 2fff h THR 371 Ca -0.13 -1.59 0.00 0.00 0.77 0.00 0.00 66.41 65.46 2fff h THR 371 Cb 1.94 1.47 -0.01 0.00 -1.74 0.00 0.00 68.15 69.81 2fff h THR 371 CO 0.18 0.52 -0.15 1.56 0.37 0.00 0.00 175.52 178.00 2fff h GLN 372 N 0.66 -0.32 -0.84 6.66 4.20 -1.25 -1.63 115.11 122.59 2fff h GLN 372 Ca 0.05 0.02 0.01 0.00 0.06 0.00 0.00 58.65 58.79 2fff h GLN 372 Cb 0.98 0.07 -0.04 0.00 0.30 0.00 0.00 27.48 28.80 2fff h GLN 372 CO 0.09 -0.22 0.55 -0.22 -0.67 0.00 0.00 178.83 178.37 2fff h LYS 373 N -0.33 1.11 -0.18 1.46 3.64 -1.42 -1.86 116.57 118.98 2fff h LYS 373 Ca 0.00 -0.07 0.02 0.00 -1.27 0.00 0.00 60.65 59.33 2fff h LYS 373 Cb 0.32 -0.25 -0.02 0.00 -0.41 0.00 0.00 32.23 31.87 2fff h LYS 373 CO -0.04 0.74 0.06 0.35 -2.27 0.00 0.00 179.45 178.29 2fff h PHE 374 N 1.14 0.11 0.00 1.91 3.57 -1.00 0.16 116.94 122.82 2fff h PHE 374 Ca 0.31 0.01 -0.07 0.00 3.53 0.00 0.00 57.97 61.75 2fff h PHE 374 Cb -0.13 -0.02 -0.01 0.00 2.79 0.00 0.00 35.95 38.58 2fff h PHE 374 CO -0.01 0.05 -0.33 1.88 -2.23 0.00 0.00 178.31 177.67 2fff h TYR 375 N 0.15 0.00 0.01 0.41 0.05 -1.20 0.62 116.97 117.01 2fff h TYR 375 Ca 0.08 0.00 -0.00 0.00 0.05 0.00 0.00 58.73 58.86 2fff h TYR 375 Cb 0.05 0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.79 2fff h TYR 375 CO -0.12 0.33 -0.01 0.00 -1.05 0.00 0.00 178.16 177.32 2fff h ARG 376 N 0.00 -0.02 -0.70 4.88 3.08 -0.72 0.16 114.38 121.07 2fff h ARG 376 Ca -0.00 0.00 0.05 0.00 0.07 0.00 0.00 59.98 60.10 2fff h ARG 376 Cb 0.80 0.00 -0.05 0.00 0.08 0.00 0.00 29.97 30.80 2fff h ARG 376 CO 0.04 0.47 0.41 -0.44 -1.07 0.00 0.00 179.97 179.38 2fff h ASP 377 N -0.51 0.64 -0.36 7.04 3.45 -0.61 -0.28 116.42 125.78 2fff h ASP 377 Ca -0.00 0.02 -0.04 0.00 0.43 0.00 0.00 57.03 57.43 2fff h ASP 377 Cb 0.49 -0.11 -0.01 0.00 -0.56 0.00 0.00 39.33 39.14 2fff h ASP 377 CO 0.00 0.42 0.06 0.25 -1.57 0.00 0.00 179.24 178.40 2fff h LEU 378 N 0.77 0.57 -0.43 1.55 5.85 -0.86 -0.04 115.31 122.72 2fff h LEU 378 Ca 0.30 -0.26 0.04 0.00 0.84 0.00 0.00 57.88 58.80 2fff h LEU 378 Cb 0.13 -0.15 -0.04 0.00 0.37 0.00 0.00 40.66 40.97 2fff h LEU 378 CO -0.16 0.69 0.20 0.00 -0.34 0.00 0.00 178.44 178.83 2fff h ALA 379 N 0.90 0.53 -0.06 1.25 0.00 -0.43 0.25 119.26 121.71 2fff h ALA 379 Ca 0.11 0.03 0.02 0.00 0.00 0.00 0.00 54.91 55.06 2fff h ALA 379 Cb 0.36 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 2fff h ALA 379 CO 0.01 -0.17 -0.04 0.00 0.00 0.00 0.00 179.25 179.06 2fff h ALA 380 N 1.24 0.02 -0.52 0.00 0.00 -0.93 -2.47 119.26 116.60 2fff h ALA 380 Ca 0.19 0.03 -0.00 0.00 0.00 0.00 0.00 54.91 55.12 2fff h ALA 380 Cb 0.12 0.08 -0.03 0.00 0.00 0.00 0.00 17.79 17.96 2fff h ALA 380 CO -0.15 -0.51 0.30 0.87 0.00 0.00 0.00 179.25 179.76 2fff h LYS 381 N -0.04 0.70 -0.39 0.00 1.79 -0.64 -2.34 116.57 115.65 2fff h LYS 381 Ca 0.04 -0.06 0.00 0.00 -2.18 0.00 0.00 60.65 58.45 2fff h LYS 381 Cb 0.09 -0.15 -0.02 0.00 -1.58 0.00 0.00 32.23 30.57 2fff h LYS 381 CO -0.08 0.50 0.26 0.93 -1.08 0.00 0.00 179.45 179.97 2fff h GLU 382 N 0.71 0.51 -0.04 3.15 4.39 -0.11 -2.52 114.58 120.67 2fff h GLU 382 Ca 0.19 -0.03 -0.14 0.00 0.34 0.00 0.00 59.36 59.71 2fff h GLU 382 Cb -0.01 -0.11 0.01 0.00 -0.10 0.00 0.00 28.75 28.53 2fff h GLU 382 CO -0.03 0.34 -0.52 0.82 -1.16 0.00 0.00 179.01 178.46 2fff h ILE 383 N 0.52 1.42 -0.86 3.13 2.04 -1.12 0.40 117.51 123.04 2fff h ILE 383 Ca 0.14 -1.96 0.20 0.00 1.00 0.00 0.00 64.86 64.24 2fff h ILE 383 Cb -0.06 2.46 -0.12 0.00 -0.74 0.00 0.00 36.82 38.37 2fff h ILE 383 CO -0.03 0.57 0.35 -0.33 0.00 0.00 0.00 178.15 178.72 2fff h GLU 384 N -0.07 0.38 0.00 2.37 5.08 -1.47 -3.33 114.58 117.54 2fff h GLU 384 Ca -0.06 -0.02 -0.35 0.00 -1.00 0.00 0.00 59.36 57.93 2fff h GLU 384 Cb 1.21 -0.09 -0.06 0.00 0.50 0.00 0.00 28.75 30.31 2fff h GLU 384 CO 0.11 0.25 -2.31 0.09 -1.00 0.00 0.00 179.01 176.15 2fff n ASN 385 N -5.05 1.46 0.00 1.42 3.02 -0.95 -4.63 115.26 110.53 2fff n ASN 385 Ca 0.20 -0.08 0.05 0.00 -0.03 0.00 0.00 54.58 54.72 2fff n ASN 385 Cb 0.59 0.17 0.29 0.00 -0.61 0.00 0.00 39.78 40.23 2fff n ASN 385 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2fff n GLY 386 N 2.16 -0.52 3.79 7.41 0.00 0.14 -4.85 105.19 113.31 2fff n GLY 386 Ca -0.37 -0.06 -0.25 0.00 0.00 0.00 0.00 46.02 45.34 2fff n GLY 386 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2fff n GLY 387 N 0.04 -0.39 3.81 -0.02 0.00 -1.26 -3.05 105.19 104.31 2fff n GLY 387 Ca 0.07 0.16 -0.34 0.00 0.00 0.00 0.00 46.02 45.91 2fff n GLY 387 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2fff s TYR 388 N -3.49 3.44 -0.32 1.61 2.02 -1.26 -2.82 117.35 116.52 2fff s TYR 388 Ca 0.32 1.67 -0.11 0.00 -0.37 0.00 0.00 57.07 58.58 2fff s TYR 388 Cb -0.16 -2.88 -0.01 0.00 -0.40 0.00 0.00 41.96 38.51 2fff s TYR 388 CO 0.82 -0.01 0.18 0.21 -1.57 0.00 0.00 175.55 175.17 2fff s LYS 389 N -2.77 3.38 -0.41 -0.62 2.20 0.86 -4.96 119.74 117.41 2fff s LYS 389 Ca 0.58 -0.70 -0.08 0.00 -0.36 0.00 0.00 55.97 55.41 2fff s LYS 389 Cb -0.13 -3.64 0.08 0.00 -1.51 0.00 0.00 37.83 32.63 2fff s LYS 389 CO 0.17 -0.43 0.23 0.42 -0.36 0.00 0.00 175.35 175.38 2fff s ILE 390 N 1.65 3.99 -0.22 5.43 1.01 -1.26 -1.09 121.20 130.71 2fff s ILE 390 Ca 0.05 -1.47 -0.23 0.00 0.00 0.00 0.00 60.65 59.00 2fff s ILE 390 Cb -0.17 -3.46 -0.01 0.00 0.01 0.00 0.00 42.46 38.82 2fff s ILE 390 CO 0.08 -0.49 0.74 -0.89 0.00 0.00 0.00 174.94 174.38 2fff s THR 391 N 1.37 4.92 0.55 2.92 2.01 -0.16 -5.00 115.64 122.26 2fff s THR 391 Ca 0.03 1.39 0.05 0.00 0.31 0.00 0.00 61.69 63.47 2fff s THR 391 Cb -0.23 -4.04 0.06 0.00 0.01 0.00 0.00 72.50 68.30 2fff s THR 391 CO 0.01 0.02 0.76 0.42 -0.69 0.00 0.00 174.62 175.14 2fff s THR 392 N 2.39 2.54 -0.85 -0.82 -4.23 -1.26 -1.48 115.64 111.93 2fff s THR 392 Ca 0.32 -0.82 0.24 0.00 -1.18 0.00 0.00 61.69 60.25 2fff s THR 392 Cb -0.16 -2.72 -0.05 0.00 1.34 0.00 0.00 72.50 70.91 2fff s THR 392 CO 0.09 0.00 1.24 0.35 -0.54 0.00 0.00 174.62 175.76 2fff n THR 393 N -2.28 0.09 -1.75 3.99 -2.24 0.28 -4.67 114.28 107.72 2fff n THR 393 Ca 0.11 -0.10 -0.42 0.00 -2.27 0.00 0.00 64.05 61.37 2fff n THR 393 Cb 0.60 0.28 -0.03 0.00 -2.10 0.00 0.00 70.33 69.08 2fff n THR 393 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 2fff s ILE 394 N -3.07 3.13 -0.00 2.28 -1.09 -1.23 -4.41 121.20 116.80 2fff s ILE 394 Ca 0.08 0.17 -0.30 0.00 -2.23 0.00 0.00 60.65 58.37 2fff s ILE 394 Cb 0.16 -3.11 -0.04 0.00 -1.58 0.00 0.00 42.46 37.89 2fff s ILE 394 CO 0.75 -0.01 1.15 -0.62 -1.23 0.00 0.00 174.94 174.98 2fff s ASP 395 N 4.14 7.13 -0.01 3.58 -1.08 -0.29 -4.98 116.67 125.17 2fff s ASP 395 Ca 0.85 1.85 -0.23 0.00 -0.52 0.00 0.00 52.55 54.50 2fff s ASP 395 Cb -0.41 -2.57 -0.19 0.00 -1.46 0.00 0.00 42.92 38.29 2fff s ASP 395 CO 0.39 -0.47 1.20 -0.61 0.52 0.00 0.00 175.17 176.19 2fff h GLN 396 N 7.06 0.21 -0.42 4.34 -0.00 -1.93 -1.69 115.11 122.69 2fff h GLN 396 Ca -0.38 -0.15 -0.07 0.00 -0.00 0.00 0.00 58.65 58.05 2fff h GLN 396 Cb 1.19 0.02 -0.01 0.00 0.00 0.00 0.00 27.48 28.68 2fff h GLN 396 CO 0.83 0.76 0.00 0.87 0.00 0.00 0.00 178.83 181.29 2fff h LYS 397 N -0.31 0.73 -0.14 1.69 1.57 -1.93 -2.24 116.57 115.94 2fff h LYS 397 Ca -0.00 -0.23 -0.02 0.00 -1.87 0.00 0.00 60.65 58.52 2fff h LYS 397 Cb 0.77 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 33.01 2fff h LYS 397 CO 0.03 0.81 0.01 0.82 -0.57 0.00 0.00 179.45 180.55 2fff h ILE 398 N 0.57 1.24 -0.15 1.86 2.04 -1.83 -0.23 117.51 121.01 2fff h ILE 398 Ca 0.12 -0.79 -0.01 0.00 1.00 0.00 0.00 64.86 65.18 2fff h ILE 398 Cb 0.48 1.49 -0.01 0.00 -0.74 0.00 0.00 36.82 38.04 2fff h ILE 398 CO 0.02 0.23 0.06 -0.74 0.00 0.00 0.00 178.15 177.73 2fff h HIS 399 N -0.00 0.23 -0.66 1.37 2.76 -1.33 0.20 115.15 117.71 2fff h HIS 399 Ca 0.04 -0.02 0.07 0.00 -2.20 0.00 0.00 60.37 58.26 2fff h HIS 399 Cb 0.35 -0.07 -0.06 0.00 1.55 0.00 0.00 27.41 29.18 2fff h HIS 399 CO 0.03 0.30 0.35 1.03 -1.30 0.00 0.00 177.93 178.35 2fff h SER 400 N 0.09 0.51 -0.54 3.26 0.87 -1.45 -0.77 113.55 115.52 2fff h SER 400 Ca 0.05 0.04 -0.00 0.00 -1.23 0.00 0.00 61.79 60.65 2fff h SER 400 Cb 0.17 -0.06 -0.03 0.00 -0.44 0.00 0.00 62.40 62.04 2fff h SER 400 CO -0.00 0.32 0.33 0.00 -0.53 0.00 0.00 176.83 176.95 2fff h ALA 401 N 1.36 1.54 -0.36 6.23 0.00 -0.49 -1.93 119.26 125.62 2fff h ALA 401 Ca 0.30 -0.07 -0.12 0.00 0.00 0.00 0.00 54.91 55.03 2fff h ALA 401 Cb 0.23 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 2fff h ALA 401 CO -0.20 0.40 -0.26 0.52 0.00 0.00 0.00 179.25 179.71 2fff h MET 402 N 0.76 0.73 -0.33 0.00 2.86 -0.11 -0.64 114.93 118.20 2fff h MET 402 Ca 0.20 -0.31 -0.10 0.00 -2.06 0.00 0.00 59.70 57.44 2fff h MET 402 Cb -0.03 -0.03 -0.02 0.00 0.06 0.00 0.00 31.60 31.59 2fff h MET 402 CO -0.04 0.91 -0.20 1.96 1.06 0.00 0.00 176.91 180.60 2fff h GLN 403 N 0.63 0.62 -0.35 1.72 1.08 -0.79 -2.42 115.11 115.60 2fff h GLN 403 Ca 0.08 -0.22 -0.16 0.00 -1.45 0.00 0.00 58.65 56.90 2fff h GLN 403 Cb 0.76 -0.04 -0.01 0.00 -0.05 0.00 0.00 27.48 28.15 2fff h GLN 403 CO 0.06 0.78 -0.41 0.77 -0.95 0.00 0.00 178.83 179.08 2fff h SER 404 N 0.55 0.93 -0.52 1.46 0.02 -1.23 -2.79 113.55 111.96 2fff h SER 404 Ca 0.09 -0.43 -0.01 0.00 -0.84 0.00 0.00 61.79 60.60 2fff h SER 404 Cb 0.65 -0.26 -0.03 0.00 0.14 0.00 0.00 62.40 62.90 2fff h SER 404 CO 0.05 1.21 0.31 0.00 -1.14 0.00 0.00 176.83 177.26 2fff h ALA 405 N 0.82 0.67 -0.08 3.77 0.00 -0.93 0.42 119.26 123.93 2fff h ALA 405 Ca 0.05 -0.08 -0.16 0.00 0.00 0.00 0.00 54.91 54.72 2fff h ALA 405 Cb 0.99 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.56 2fff h ALA 405 CO 0.10 0.17 -0.65 -0.24 0.00 0.00 0.00 179.25 178.63 2fff h VAL 406 N 0.70 1.38 -0.48 0.00 3.04 -1.52 0.52 116.25 119.90 2fff h VAL 406 Ca 0.19 -2.04 -0.05 0.00 -1.01 0.00 0.00 66.70 63.78 2fff h VAL 406 Cb 0.01 2.03 -0.02 0.00 -2.01 0.00 0.00 31.29 31.30 2fff h VAL 406 CO -0.03 0.61 0.10 0.00 -1.01 0.00 0.00 177.57 177.23 2fff h ALA 407 N 1.09 0.64 0.02 3.17 0.00 -1.27 0.76 119.26 123.66 2fff h ALA 407 Ca -0.01 -0.22 -0.24 0.00 0.00 0.00 0.00 54.91 54.44 2fff h ALA 407 Cb 1.18 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 18.76 2fff h ALA 407 CO 0.11 0.35 -1.19 -0.44 0.00 0.00 0.00 179.25 178.08 2fff h ASP 408 N 0.67 0.07 0.00 0.00 3.32 -0.85 -3.40 116.42 116.23 2fff h ASP 408 Ca 0.15 -0.08 0.00 0.00 0.02 0.00 0.00 57.03 57.11 2fff h ASP 408 Cb 0.36 -0.02 0.00 0.00 0.22 0.00 0.00 39.33 39.89 2fff h ASP 408 CO 0.01 1.07 0.00 -1.22 -1.72 0.00 0.00 179.24 177.37 2fff n TYR 409 N -3.32 0.00 0.20 4.55 4.01 0.17 -4.69 117.16 118.08 2fff n TYR 409 Ca -0.05 -0.02 0.14 0.00 -0.16 0.00 0.00 57.90 57.81 2fff n TYR 409 Cb 0.98 -0.00 0.75 0.00 -0.31 0.00 0.00 39.34 40.75 2fff n TYR 409 CO 0.00 0.00 0.00 0.78 -0.46 0.00 0.00 176.86 177.18 2fff h GLY 410 N 0.00 0.00 2.00 2.72 0.00 -0.93 -2.05 103.07 104.81 2fff h GLY 410 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 47.30 2fff h GLY 410 CO 0.00 0.00 -0.16 0.10 0.00 0.00 0.00 176.54 176.48 2fff h TYR 411 N 0.00 0.00 -0.05 5.60 -0.00 -1.84 -0.93 116.97 119.75 2fff h TYR 411 Ca 0.07 0.00 0.02 0.00 -0.00 0.00 0.00 58.73 58.82 2fff h TYR 411 Cb 0.32 0.00 -0.00 0.00 -0.00 0.00 0.00 36.73 37.05 2fff h TYR 411 CO 0.00 0.16 0.12 -0.07 -0.00 0.00 0.00 178.16 178.37 2fff h LEU 412 N 0.00 0.00 -0.04 0.10 3.38 -1.72 -2.09 115.31 114.94 2fff h LEU 412 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2fff h LEU 412 Cb 0.37 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.12 2fff h LEU 412 CO 0.02 0.00 0.00 0.18 0.09 0.00 0.00 178.44 178.73 2fff n LEU 413 N -3.36 0.35 -4.71 1.67 4.77 -0.35 -4.77 117.00 110.59 2fff n LEU 413 Ca -0.01 0.54 -0.38 0.00 -0.03 0.00 0.00 56.01 56.12 2fff n LEU 413 Cb 0.21 -0.43 -0.06 0.00 -2.33 0.00 0.00 43.42 40.80 2fff n LEU 413 CO 0.22 -0.12 0.22 -1.81 -1.33 0.00 0.00 177.39 174.57 2fff s ASP 414 N -3.66 6.72 -0.05 -1.43 1.01 -0.79 -4.69 116.67 113.79 2fff s ASP 414 Ca 0.12 0.87 0.07 0.00 0.71 0.00 0.00 52.55 54.32 2fff s ASP 414 Cb 0.15 -2.31 0.11 0.00 1.01 0.00 0.00 42.92 41.89 2fff s ASP 414 CO 0.53 -0.04 1.01 -0.90 0.21 0.00 0.00 175.17 175.98 2fff n ASP 415 N 3.81 1.08 0.00 0.27 5.68 -1.26 -4.97 116.55 121.16 2fff n ASP 415 Ca -0.06 -2.32 0.00 0.00 -0.50 0.00 0.00 54.79 51.91 2fff n ASP 415 Cb 0.51 -0.25 0.00 0.00 -1.14 0.00 0.00 41.12 40.24 2fff n ASP 415 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2fff n GLY 416 N -0.60 1.33 0.26 6.12 0.00 -1.26 -4.87 105.19 106.18 2fff n GLY 416 Ca 0.06 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.20 2fff n GLY 416 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2fff n THR 417 N -2.00 0.00 0.00 2.61 -2.24 -1.26 -5.04 114.28 106.35 2fff n THR 417 Ca 0.00 -0.13 0.00 0.00 -2.27 0.00 0.00 64.05 61.65 2fff n THR 417 Cb 0.00 0.60 0.00 0.00 -2.10 0.00 0.00 70.33 68.83 2fff n THR 417 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2fff n GLY 418 N 1.38 0.92 3.55 3.38 0.00 -1.26 -4.93 105.19 108.23 2fff n GLY 418 Ca 0.10 -1.95 -0.41 0.00 0.00 0.00 0.00 46.02 43.76 2fff n GLY 418 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2fff s ARG 419 N -1.79 3.48 0.13 1.61 3.52 -1.26 -4.48 118.95 120.16 2fff s ARG 419 Ca 0.00 -0.91 -0.32 0.00 -0.13 0.00 0.00 55.73 54.37 2fff s ARG 419 Cb 0.00 -5.01 -0.11 0.00 -1.56 0.00 0.00 34.95 28.27 2fff s ARG 419 CO 0.00 -2.17 1.81 0.28 -0.81 0.00 0.00 175.30 174.41 2fff n VAL 420 N 6.68 0.30 -2.49 7.11 0.31 -1.26 -4.97 118.33 124.00 2fff n VAL 420 Ca 0.24 -0.05 -0.28 0.00 -0.01 0.00 0.00 64.34 64.24 2fff n VAL 420 Cb 0.50 -2.06 0.01 0.00 -0.91 0.00 0.00 33.84 31.39 2fff n VAL 420 CO 0.00 0.00 0.00 -1.61 -1.32 0.00 0.00 176.83 173.90 2fff s GLU 421 N 2.44 3.37 -0.02 5.55 0.41 0.61 -4.84 118.70 126.22 2fff s GLU 421 Ca 0.81 0.19 -0.11 0.00 -0.41 0.00 0.00 54.97 55.46 2fff s GLU 421 Cb -0.51 -2.32 0.01 0.00 -1.78 0.00 0.00 34.13 29.54 2fff s GLU 421 CO 0.37 -0.39 0.23 0.54 -0.49 0.00 0.00 175.26 175.52 2fff s VAL 422 N -2.86 0.06 -0.07 2.63 0.11 -1.26 -1.95 120.40 117.06 2fff s VAL 422 Ca 0.50 -0.49 -0.04 0.00 -2.93 0.00 0.00 61.98 59.02 2fff s VAL 422 Cb -0.10 -0.50 0.03 0.00 -1.53 0.00 0.00 36.38 34.28 2fff s VAL 422 CO 0.46 -0.27 0.16 -0.83 -3.33 0.00 0.00 175.10 171.29 2fff s GLY 423 N -1.11 -0.07 0.00 6.54 0.00 -0.38 -2.99 107.32 109.31 2fff s GLY 423 Ca -0.12 0.64 -0.01 0.00 0.00 0.00 0.00 44.72 45.24 2fff s GLY 423 CO 0.02 0.84 0.00 -1.31 0.00 0.00 0.00 173.10 172.66 2fff s ASN 424 N 0.86 0.07 -0.03 1.64 0.01 -0.75 -1.25 114.94 115.48 2fff s ASN 424 Ca -0.06 -0.16 -0.00 0.00 -0.71 0.00 0.00 52.86 51.92 2fff s ASN 424 Cb -0.08 0.06 0.03 0.00 0.41 0.00 0.00 41.25 41.67 2fff s ASN 424 CO -0.04 -0.12 0.02 -0.69 -1.51 0.00 0.00 177.10 174.76 2fff s VAL 425 N -0.54 0.06 -0.22 1.60 1.01 -1.00 -0.26 120.40 121.04 2fff s VAL 425 Ca -0.06 0.20 -0.07 0.00 0.00 0.00 0.00 61.98 62.05 2fff s VAL 425 Cb -0.04 -0.20 -0.03 0.00 0.00 0.00 0.00 36.38 36.11 2fff s VAL 425 CO -0.00 0.14 0.05 -0.22 0.00 0.00 0.00 175.10 175.07 2fff s LEU 426 N 1.32 3.44 -0.05 3.92 2.96 0.18 -1.40 118.68 129.05 2fff s LEU 426 Ca -0.06 -0.16 0.03 0.00 -0.22 0.00 0.00 54.13 53.72 2fff s LEU 426 Cb -0.13 -1.90 0.01 0.00 0.50 0.00 0.00 46.19 44.67 2fff s LEU 426 CO -0.03 0.02 -0.14 -0.32 -1.32 0.00 0.00 176.35 174.57 2fff s MET 427 N 1.25 1.71 -0.15 1.98 -2.45 0.12 -0.50 119.30 121.27 2fff s MET 427 Ca 0.04 -0.49 -0.29 0.00 -1.25 0.00 0.00 55.69 53.70 2fff s MET 427 Cb -0.15 -1.44 -0.03 0.00 1.25 0.00 0.00 34.83 34.46 2fff s MET 427 CO 0.03 0.12 1.50 0.34 1.05 0.00 0.00 175.02 178.06 2fff s ASP 428 N 0.36 6.68 0.46 1.11 -1.08 0.72 -1.13 116.67 123.79 2fff s ASP 428 Ca -0.10 1.83 0.23 0.00 -0.52 0.00 0.00 52.55 54.00 2fff s ASP 428 Cb -0.13 -2.53 1.08 0.00 -1.46 0.00 0.00 42.92 39.87 2fff s ASP 428 CO 0.03 -0.97 1.91 0.78 0.52 0.00 0.00 175.17 177.44 2fff h ASN 429 N 9.41 0.00 0.39 -0.34 2.35 -1.01 -1.02 115.58 125.36 2fff h ASN 429 Ca -0.33 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.42 2fff h ASN 429 Cb 1.14 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.51 2fff h ASN 429 CO 0.98 0.22 -0.28 0.00 -1.65 0.00 0.00 177.43 176.70 2fff n GLN 430 N -3.59 0.50 0.00 0.81 3.00 -1.26 -4.46 117.38 112.38 2fff n GLN 430 Ca -0.01 -0.26 0.00 0.00 -0.01 0.00 0.00 57.00 56.72 2fff n GLN 430 Cb 0.36 -1.49 0.00 0.00 0.00 0.00 0.00 30.24 29.11 2fff n GLN 430 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.06 177.31 2fff n THR 431 N -1.03 0.00 -0.96 5.09 -2.24 -1.06 -4.99 114.28 109.10 2fff n THR 431 Ca 0.10 -0.02 0.00 0.00 -2.27 0.00 0.00 64.05 61.86 2fff n THR 431 Cb 0.33 0.30 0.00 0.00 -2.10 0.00 0.00 70.33 68.86 2fff n THR 431 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2fff n GLY 432 N 0.33 0.67 3.71 3.38 0.00 -0.41 -4.57 105.19 108.30 2fff n GLY 432 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 2fff n GLY 432 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fff s ALA 433 N -2.81 3.65 -0.40 4.61 0.00 -1.25 -2.20 121.76 123.36 2fff s ALA 433 Ca 0.00 1.15 -0.23 0.00 0.00 0.00 0.00 51.96 52.88 2fff s ALA 433 Cb 0.00 -3.59 0.02 0.00 0.00 0.00 0.00 23.12 19.54 2fff s ALA 433 CO 0.00 -0.78 0.78 0.42 0.00 0.00 0.00 175.76 176.18 2fff s ILE 434 N 1.56 4.71 -0.18 0.00 1.01 -0.74 -0.20 121.20 127.37 2fff s ILE 434 Ca 0.67 0.69 0.20 0.00 0.00 0.00 0.00 60.65 62.21 2fff s ILE 434 Cb -0.38 -4.25 -0.07 0.00 0.01 0.00 0.00 42.46 37.77 2fff s ILE 434 CO 0.30 -0.54 0.93 0.18 0.00 0.00 0.00 174.94 175.81 2fff n LEU 435 N 6.52 0.85 -3.60 2.97 4.77 0.35 -3.58 117.00 125.28 2fff n LEU 435 Ca 0.02 0.35 -0.04 0.00 -0.03 0.00 0.00 56.01 56.32 2fff n LEU 435 Cb 0.48 0.01 -0.02 0.00 -2.33 0.00 0.00 43.42 41.56 2fff n LEU 435 CO 0.55 -0.02 1.03 -0.83 -1.33 0.00 0.00 177.39 176.79 2fff s GLY 436 N -4.58 -0.29 0.14 -0.72 0.00 -1.23 -1.13 107.32 99.51 2fff s GLY 436 Ca -0.02 1.59 -0.14 0.00 0.00 0.00 0.00 44.72 46.16 2fff s GLY 436 CO 0.80 0.53 0.36 -0.11 0.00 0.00 0.00 173.10 174.67 2fff s PHE 437 N -2.38 -0.01 -0.24 1.90 -0.12 -1.26 -0.64 117.98 115.22 2fff s PHE 437 Ca 0.10 -0.34 -0.01 0.00 -0.05 0.00 0.00 56.93 56.62 2fff s PHE 437 Cb -0.01 0.16 0.02 0.00 -0.63 0.00 0.00 43.02 42.57 2fff s PHE 437 CO -0.04 -0.71 -0.08 0.08 -0.05 0.00 0.00 175.22 174.42 2fff s VAL 438 N -3.86 2.82 -0.48 -2.49 1.01 0.64 -4.76 120.40 113.29 2fff s VAL 438 Ca 0.07 -0.96 0.24 0.00 0.00 0.00 0.00 61.98 61.32 2fff s VAL 438 Cb 0.02 -2.39 0.33 0.00 0.00 0.00 0.00 36.38 34.34 2fff s VAL 438 CO -0.08 0.26 1.64 1.23 0.00 0.00 0.00 175.10 178.15 2fff h GLY 439 N 8.01 0.00 0.00 4.51 0.00 -1.84 -2.00 103.07 111.75 2fff h GLY 439 Ca -0.35 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.98 2fff h GLY 439 CO 0.58 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.73 2fff n GLY 440 N 1.12 -1.50 0.25 4.60 0.00 -1.16 -0.46 105.19 108.03 2fff n GLY 440 Ca 0.04 -1.34 -0.14 0.00 0.00 0.00 0.00 46.02 44.57 2fff n GLY 440 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2fff h ARG 441 N 0.93 0.87 -0.68 1.61 2.47 -1.88 -3.45 114.38 114.24 2fff h ARG 441 Ca 0.00 -0.52 0.16 0.00 -1.26 0.00 0.00 59.98 58.35 2fff h ARG 441 Cb 0.00 0.05 -0.21 0.00 -1.65 0.00 0.00 29.97 28.16 2fff h ARG 441 CO 0.00 1.16 -0.08 1.21 0.56 0.00 0.00 179.97 182.82 2fff s ASN 442 N -6.87 -0.96 0.25 7.04 3.04 -1.26 -4.81 114.94 111.37 2fff s ASN 442 Ca -0.11 0.58 -0.03 0.00 0.04 0.00 0.00 52.86 53.34 2fff s ASN 442 Cb 0.10 1.80 0.43 0.00 -1.54 0.00 0.00 41.25 42.04 2fff s ASN 442 CO 0.88 -0.18 1.82 0.22 -3.04 0.00 0.00 177.10 176.80 2fff h TYR 443 N 7.99 0.93 -0.00 0.43 5.03 -1.87 -1.85 116.97 127.63 2fff h TYR 443 Ca -0.18 0.03 0.00 0.00 2.58 0.00 0.00 58.73 61.16 2fff h TYR 443 Cb 1.17 -0.29 -0.00 0.00 1.55 0.00 0.00 36.73 39.16 2fff h TYR 443 CO 0.09 0.38 0.00 1.96 -1.32 0.00 0.00 178.16 179.27 2fff h GLN 444 N 0.85 0.00 0.00 1.82 4.20 -1.99 -3.05 115.11 116.94 2fff h GLN 444 Ca 0.42 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.13 2fff h GLN 444 Cb 0.38 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.16 2fff h GLN 444 CO -0.25 0.00 -0.78 0.39 -0.67 0.00 0.00 178.83 177.52 2fff n GLU 445 N -4.34 2.46 -3.49 1.46 1.02 -0.94 -4.89 120.64 111.91 2fff n GLU 445 Ca -0.03 -0.02 -0.10 0.00 -0.02 0.00 0.00 57.16 56.99 2fff n GLU 445 Cb 0.09 -1.12 -0.09 0.00 -0.02 0.00 0.00 31.44 30.30 2fff n GLU 445 CO 0.00 0.00 0.00 1.21 1.18 0.00 0.00 177.13 179.52 2fff s ASN 446 N -2.41 0.13 0.00 1.62 3.84 -0.74 -5.05 114.94 112.33 2fff s ASN 446 Ca 0.03 0.51 0.28 0.00 0.21 0.00 0.00 52.86 53.88 2fff s ASN 446 Cb 0.09 1.12 1.03 0.00 -0.55 0.00 0.00 41.25 42.94 2fff s ASN 446 CO 0.50 -0.27 1.74 0.00 -2.79 0.00 0.00 177.10 176.28 2fff n GLN 447 N 5.37 0.51 -1.91 0.43 3.00 -1.23 -4.04 117.38 119.51 2fff n GLN 447 Ca -0.06 -0.21 -0.42 0.00 -0.01 0.00 0.00 57.00 56.31 2fff n GLN 447 Cb 0.50 -1.50 -0.03 0.00 0.00 0.00 0.00 30.24 29.21 2fff n GLN 447 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.06 176.26 2fff s ASN 448 N -2.63 6.58 -0.61 1.08 0.02 -1.26 -4.94 114.94 113.16 2fff s ASN 448 Ca 0.23 2.58 -0.23 0.00 -1.02 0.00 0.00 52.86 54.43 2fff s ASN 448 Cb 0.19 -2.58 0.06 0.00 0.02 0.00 0.00 41.25 38.94 2fff s ASN 448 CO 0.53 -0.86 0.93 0.21 0.02 0.00 0.00 177.10 177.92 2fff s ASN 449 N 1.72 6.22 0.00 -1.22 3.84 -1.26 -4.67 114.94 119.57 2fff s ASN 449 Ca 0.72 -0.80 0.30 0.00 0.21 0.00 0.00 52.86 53.29 2fff s ASN 449 Cb -0.43 -2.41 1.42 0.00 -0.55 0.00 0.00 41.25 39.29 2fff s ASN 449 CO 0.32 -1.33 1.96 1.41 -2.79 0.00 0.00 177.10 176.67 2fff n HIS 450 N 7.49 0.00 -0.01 0.43 8.25 0.40 -1.20 115.22 130.58 2fff n HIS 450 Ca -0.03 0.00 -0.22 0.00 -0.26 0.00 0.00 57.72 57.22 2fff n HIS 450 Cb 0.46 -0.07 -0.14 0.00 1.12 0.00 0.00 29.99 31.36 2fff n HIS 450 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2fff h ALA 451 N 3.94 0.28 0.00 -1.41 0.00 -1.73 -3.39 119.26 116.95 2fff h ALA 451 Ca 0.00 -1.21 -0.10 0.00 0.00 0.00 0.00 54.91 53.60 2fff h ALA 451 Cb 0.27 0.60 -0.02 0.00 0.00 0.00 0.00 17.79 18.64 2fff h ALA 451 CO 0.00 0.98 -1.38 1.19 0.00 0.00 0.00 179.25 180.04 2fff n PHE 452 N -3.85 0.00 -0.10 0.00 3.72 -1.22 -0.89 117.46 115.12 2fff n PHE 452 Ca -0.28 0.00 -0.14 0.00 -0.05 0.00 0.00 57.45 56.97 2fff n PHE 452 Cb 0.92 -0.27 -0.09 0.00 -0.94 0.00 0.00 39.48 39.10 2fff n PHE 452 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 176.76 176.46 2fff n ASP 453 N -2.32 2.39 -4.75 4.37 8.00 -0.34 -4.87 116.55 119.03 2fff n ASP 453 Ca -0.10 -0.10 -0.40 0.00 0.71 0.00 0.00 54.79 54.90 2fff n ASP 453 Cb 0.67 -0.33 -0.05 0.00 -0.02 0.00 0.00 41.12 41.38 2fff n ASP 453 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 2fff s THR 454 N -2.41 3.91 -0.08 -3.53 -4.23 -0.94 -4.92 115.64 103.44 2fff s THR 454 Ca -0.28 1.87 0.04 0.00 -1.18 0.00 0.00 61.69 62.15 2fff s THR 454 Cb 0.07 -4.19 -0.00 0.00 1.34 0.00 0.00 72.50 69.72 2fff s THR 454 CO 0.47 0.42 -0.22 -0.54 -0.54 0.00 0.00 174.62 174.21 2fff s LYS 455 N -1.09 2.64 -0.01 3.99 1.02 -1.26 -4.05 119.74 120.97 2fff s LYS 455 Ca 0.43 -0.81 -0.16 0.00 0.02 0.00 0.00 55.97 55.46 2fff s LYS 455 Cb -0.28 -2.09 0.03 0.00 -0.52 0.00 0.00 37.83 34.97 2fff s LYS 455 CO 0.35 0.23 0.33 1.03 -0.92 0.00 0.00 175.35 176.36 2fff s ARG 456 N 0.20 0.71 0.08 1.68 1.81 -1.02 -4.72 118.95 117.69 2fff s ARG 456 Ca -0.13 -0.21 -0.34 0.00 -1.72 0.00 0.00 55.73 53.33 2fff s ARG 456 Cb -0.16 0.32 -0.13 0.00 -0.45 0.00 0.00 34.95 34.52 2fff s ARG 456 CO 0.06 -0.20 1.65 0.45 -0.68 0.00 0.00 175.30 176.58 2fff n SER 457 N 1.15 3.10 0.00 0.23 2.88 -1.22 -0.62 113.62 119.14 2fff n SER 457 Ca -0.21 1.05 0.06 0.00 -1.33 0.00 0.00 58.87 58.44 2fff n SER 457 Cb 0.57 -1.39 0.30 0.00 -0.75 0.00 0.00 64.21 62.93 2fff n SER 457 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 2fff n PRO 458 N 4.33 0.21 0.00 -1.46 -0.04 -1.26 -4.90 135.00 131.88 2fff n PRO 458 Ca 0.19 0.14 0.00 0.00 -0.04 0.00 0.00 63.50 63.78 2fff n PRO 458 Cb 0.28 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.24 2fff n PRO 458 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2fff n ALA 459 N -1.21 0.00 0.28 0.55 0.00 -1.26 -1.84 120.51 117.02 2fff n ALA 459 Ca 0.06 0.00 0.11 0.00 0.00 0.00 0.00 53.44 53.61 2fff n ALA 459 Cb 0.08 0.00 0.53 0.00 0.00 0.00 0.00 19.45 20.06 2fff n ALA 459 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 2fff n SER 460 N 0.96 0.61 0.02 0.00 7.64 -1.25 -2.18 113.62 119.41 2fff n SER 460 Ca 0.00 0.71 0.08 0.00 1.01 0.00 0.00 58.87 60.67 2fff n SER 460 Cb 0.00 -0.82 0.33 0.00 -1.01 0.00 0.00 64.21 62.72 2fff n SER 460 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 2fff n THR 461 N -2.24 0.98 0.21 0.44 -2.24 -0.77 -1.83 114.28 108.83 2fff n THR 461 Ca 0.00 0.25 0.05 0.00 -2.27 0.00 0.00 64.05 62.08 2fff n THR 461 Cb 0.13 -1.02 0.45 0.00 -2.10 0.00 0.00 70.33 67.79 2fff n THR 461 CO 0.00 0.00 0.00 0.74 -0.57 0.00 0.00 175.07 175.24 2fff h THR 462 N 0.00 1.10 0.42 4.28 2.02 -1.56 -3.39 112.91 115.79 2fff h THR 462 Ca 0.00 -0.99 -0.02 0.00 0.77 0.00 0.00 66.41 66.17 2fff h THR 462 Cb 0.27 1.55 0.00 0.00 -1.74 0.00 0.00 68.15 68.23 2fff h THR 462 CO 0.00 0.27 -0.20 0.11 0.37 0.00 0.00 175.52 176.07 2fff h LYS 463 N 0.00 -0.54 -0.53 6.66 1.57 -1.29 0.45 116.57 122.89 2fff h LYS 463 Ca -0.00 0.04 0.11 0.00 -1.87 0.00 0.00 60.65 58.93 2fff h LYS 463 Cb 0.52 0.12 -0.03 0.00 0.08 0.00 0.00 32.23 32.93 2fff h LYS 463 CO 0.04 -0.34 0.37 -1.35 -0.57 0.00 0.00 179.45 177.59 2fff h PRO 464 N -0.60 0.22 0.07 3.15 0.11 -1.79 -1.68 132.00 131.47 2fff h PRO 464 Ca -0.06 -0.01 -0.24 0.00 0.11 0.00 0.00 66.00 65.79 2fff h PRO 464 Cb 0.45 -0.05 -0.01 0.00 0.11 0.00 0.00 31.00 31.50 2fff h PRO 464 CO 0.09 0.14 -1.29 -0.07 -0.21 0.00 0.00 178.00 176.67 2fff h LEU 465 N 0.22 0.23 0.00 2.35 3.38 -1.69 0.15 115.31 119.95 2fff h LEU 465 Ca 0.25 -0.77 -0.18 0.00 0.09 0.00 0.00 57.88 57.27 2fff h LEU 465 Cb 0.69 -0.07 -0.03 0.00 0.09 0.00 0.00 40.66 41.34 2fff h LEU 465 CO -0.05 1.54 -1.64 -0.11 0.09 0.00 0.00 178.44 178.28 2fff n LEU 466 N -4.10 0.63 0.00 1.67 0.00 0.11 -4.01 117.00 111.30 2fff n LEU 466 Ca -0.26 0.28 0.00 0.00 0.00 0.00 0.00 56.01 56.02 2fff n LEU 466 Cb 0.81 0.13 0.00 0.00 0.00 0.00 0.00 43.42 44.36 2fff n LEU 466 CO 0.33 0.18 0.00 0.00 0.00 0.00 0.00 177.39 177.91 2fff n ALA 467 N -2.44 1.80 -0.11 1.96 0.00 -0.70 -4.64 120.51 116.38 2fff n ALA 467 Ca -0.13 -0.02 -0.10 0.00 0.00 0.00 0.00 53.44 53.19 2fff n ALA 467 Cb 0.86 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 20.29 2fff n ALA 467 CO 0.00 0.00 0.00 1.88 0.00 0.00 0.00 177.50 179.38 2fff h TYR 468 N 0.00 0.52 -0.65 0.00 0.05 -1.54 -0.30 116.97 115.05 2fff h TYR 468 Ca 0.00 -0.04 0.01 0.00 0.05 0.00 0.00 58.73 58.75 2fff h TYR 468 Cb 0.00 -0.15 -0.03 0.00 1.01 0.00 0.00 36.73 37.55 2fff h TYR 468 CO 0.00 0.48 0.42 0.78 -1.05 0.00 0.00 178.16 178.79 2fff h GLY 469 N 0.40 0.92 0.96 3.88 0.00 -0.89 -0.43 103.07 107.91 2fff h GLY 469 Ca 0.11 -0.33 -0.10 0.00 0.00 0.00 0.00 47.33 47.01 2fff h GLY 469 CO -0.01 0.31 -0.18 -2.22 0.00 0.00 0.00 176.54 174.44 2fff h ILE 470 N 0.85 1.29 -0.70 2.60 2.04 -1.58 -0.94 117.51 121.06 2fff h ILE 470 Ca 0.24 -1.30 -0.05 0.00 1.00 0.00 0.00 64.86 64.76 2fff h ILE 470 Cb -0.07 1.42 -0.03 0.00 -0.74 0.00 0.00 36.82 37.40 2fff h ILE 470 CO -0.07 0.42 0.25 0.00 0.00 0.00 0.00 178.15 178.76 2fff h ALA 471 N 0.77 1.12 -0.52 1.87 0.00 -0.75 -0.78 119.26 120.97 2fff h ALA 471 Ca 0.07 -0.20 -0.05 0.00 0.00 0.00 0.00 54.91 54.73 2fff h ALA 471 Cb 0.72 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 18.21 2fff h ALA 471 CO 0.05 0.62 0.12 0.82 0.00 0.00 0.00 179.25 180.86 2fff h ILE 472 N 1.03 1.24 0.00 0.00 2.04 -1.02 -0.44 117.51 120.36 2fff h ILE 472 Ca 0.23 -0.86 -0.02 0.00 1.00 0.00 0.00 64.86 65.21 2fff h ILE 472 Cb 0.24 0.81 -0.00 0.00 -0.74 0.00 0.00 36.82 37.13 2fff h ILE 472 CO -0.01 0.31 -0.10 -0.78 0.00 0.00 0.00 178.15 177.57 2fff h ASP 473 N 0.72 0.00 -0.42 1.72 3.58 0.08 -2.28 116.42 119.82 2fff h ASP 473 Ca 0.16 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.61 2fff h ASP 473 Cb 0.34 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.39 2fff h ASP 473 CO 0.00 0.10 0.00 0.00 -2.88 0.00 0.00 179.24 176.46 2fff n GLN 474 N -3.52 2.22 -2.18 0.28 1.13 -0.42 -4.91 117.38 109.98 2fff n GLN 474 Ca -0.02 -1.87 -0.14 0.00 -1.94 0.00 0.00 57.00 53.04 2fff n GLN 474 Cb 0.24 -1.44 -0.01 0.00 0.11 0.00 0.00 30.24 29.13 2fff n GLN 474 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2fff n GLY 475 N 1.36 -0.04 0.00 1.08 0.00 -0.86 -4.93 105.19 101.81 2fff n GLY 475 Ca 0.18 -0.30 0.09 0.00 0.00 0.00 0.00 46.02 45.99 2fff n GLY 475 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2fff n LEU 476 N -1.99 0.51 -3.47 0.99 4.77 -0.19 -4.98 117.00 112.65 2fff n LEU 476 Ca -0.17 -0.29 -0.12 0.00 -0.03 0.00 0.00 56.01 55.40 2fff n LEU 476 Cb 0.61 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.67 2fff n LEU 476 CO 0.20 0.13 0.37 0.00 -1.33 0.00 0.00 177.39 176.75 2fff s MET 477 N -2.98 1.22 0.29 3.23 0.23 -1.13 -4.94 119.30 115.21 2fff s MET 477 Ca 0.01 -0.42 0.01 0.00 -1.03 0.00 0.00 55.69 54.26 2fff s MET 477 Cb 0.13 0.56 -0.00 0.00 -1.53 0.00 0.00 34.83 33.99 2fff s MET 477 CO 0.77 -0.51 0.03 0.41 -2.03 0.00 0.00 175.02 173.69 2fff n GLY 478 N -0.20 3.74 0.30 3.16 0.00 -1.26 -4.24 105.19 106.69 2fff n GLY 478 Ca -0.17 -2.22 0.02 0.00 0.00 0.00 0.00 46.02 43.65 2fff n GLY 478 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2fff h SER 479 N 0.81 0.49 -0.60 1.61 4.64 -1.35 -1.47 113.55 117.67 2fff h SER 479 Ca -0.23 -0.04 -0.27 0.00 -0.47 0.00 0.00 61.79 60.78 2fff h SER 479 Cb 0.76 -0.12 -0.16 0.00 -0.31 0.00 0.00 62.40 62.56 2fff h SER 479 CO 0.38 0.43 0.21 -0.62 -0.87 0.00 0.00 176.83 176.36 2fff n GLU 480 N -4.40 2.38 -2.43 4.77 -0.58 -1.26 -4.20 120.64 114.92 2fff n GLU 480 Ca 0.03 -3.08 -0.38 0.00 -0.42 0.00 0.00 57.16 53.30 2fff n GLU 480 Cb 0.12 -2.00 -0.03 0.00 -0.57 0.00 0.00 31.44 28.96 2fff n GLU 480 CO 0.00 0.00 0.00 0.99 -0.48 0.00 0.00 177.13 177.64 2fff s THR 481 N -3.18 3.43 0.02 2.62 2.01 -0.56 -4.33 115.64 115.66 2fff s THR 481 Ca 0.50 1.25 -0.18 0.00 0.31 0.00 0.00 61.69 63.57 2fff s THR 481 Cb 0.43 -3.72 -0.06 0.00 0.01 0.00 0.00 72.50 69.16 2fff s THR 481 CO 0.06 0.16 0.53 -0.63 -0.69 0.00 0.00 174.62 174.05 2fff s ILE 482 N -1.40 4.88 0.17 1.82 -1.09 -1.26 -1.51 121.20 122.82 2fff s ILE 482 Ca 0.53 1.12 0.09 0.00 -2.23 0.00 0.00 60.65 60.16 2fff s ILE 482 Cb -0.29 -3.86 -0.04 0.00 -1.58 0.00 0.00 42.46 36.69 2fff s ILE 482 CO 0.36 0.51 -0.20 -0.76 -1.23 0.00 0.00 174.94 173.62 2fff s LEU 483 N -0.74 2.43 -0.01 2.97 1.02 -0.39 -0.76 118.68 123.20 2fff s LEU 483 Ca 0.28 -0.86 -0.27 0.00 0.02 0.00 0.00 54.13 53.30 2fff s LEU 483 Cb -0.18 -0.94 -0.04 0.00 0.02 0.00 0.00 46.19 45.05 2fff s LEU 483 CO 0.17 0.02 0.87 -0.55 0.02 0.00 0.00 176.35 176.88 2fff s SER 484 N -2.65 7.24 -0.16 2.29 0.15 0.16 -2.02 113.70 118.72 2fff s SER 484 Ca 0.17 1.50 0.18 0.00 0.70 0.00 0.00 55.95 58.50 2fff s SER 484 Cb -0.07 -2.51 0.40 0.00 -1.71 0.00 0.00 66.02 62.13 2fff s SER 484 CO 0.08 -0.18 1.27 -3.20 1.20 0.00 0.00 173.24 172.41 2fff n ASN 485 N 3.68 2.98 -4.76 5.45 4.05 0.90 -3.21 115.26 124.36 2fff n ASN 485 Ca 0.03 -3.09 -0.37 0.00 0.45 0.00 0.00 54.58 51.59 2fff n ASN 485 Cb 0.51 -0.49 0.03 0.00 1.23 0.00 0.00 39.78 41.06 2fff n ASN 485 CO 0.00 0.00 0.00 -0.31 -3.05 0.00 0.00 177.26 173.90 2fff s TYR 486 N -2.88 2.46 -0.15 1.20 1.51 -1.23 0.56 117.35 118.82 2fff s TYR 486 Ca 0.37 1.45 -0.41 0.00 -1.01 0.00 0.00 57.07 57.47 2fff s TYR 486 Cb 0.31 -3.62 -0.18 0.00 -0.11 0.00 0.00 41.96 38.36 2fff s TYR 486 CO 0.05 -2.38 1.40 -2.30 -1.11 0.00 0.00 175.55 171.21 2fff n PRO 487 N -1.03 0.53 -3.83 -1.71 -0.02 -1.22 -4.82 135.00 122.90 2fff n PRO 487 Ca 0.10 0.19 -0.09 0.00 -2.02 0.00 0.00 63.50 61.69 2fff n PRO 487 Cb 0.47 -1.77 -0.07 0.00 -0.02 0.00 0.00 33.50 32.11 2fff n PRO 487 CO 0.00 0.00 0.00 -0.08 1.98 0.00 0.00 175.50 177.40 2fff s THR 488 N 1.54 0.13 0.21 3.45 -1.32 -1.26 -5.00 115.64 113.38 2fff s THR 488 Ca 0.94 -1.09 0.08 0.00 -1.21 0.00 0.00 61.69 60.41 2fff s THR 488 Cb -1.20 -1.30 -0.04 0.00 -1.51 0.00 0.00 72.50 68.45 2fff s THR 488 CO 0.62 -0.60 0.01 0.20 -2.21 0.00 0.00 174.62 172.64 2fff s ASN 489 N -2.82 4.76 0.91 8.08 0.01 -1.26 -1.37 114.94 123.26 2fff s ASN 489 Ca 0.04 -0.46 -0.12 0.00 -0.71 0.00 0.00 52.86 51.62 2fff s ASN 489 Cb 0.04 -0.99 0.14 0.00 0.41 0.00 0.00 41.25 40.85 2fff s ASN 489 CO -0.11 0.06 1.10 -0.36 -1.51 0.00 0.00 177.10 176.27 2fff s PHE 490 N -1.92 2.35 0.30 2.20 0.08 0.18 -4.85 117.98 116.32 2fff s PHE 490 Ca 0.29 1.11 -0.01 0.00 0.12 0.00 0.00 56.93 58.44 2fff s PHE 490 Cb -0.08 -3.21 0.47 0.00 -0.57 0.00 0.00 43.02 39.63 2fff s PHE 490 CO 0.19 -2.45 1.95 0.00 -0.10 0.00 0.00 175.22 174.81 2fff h ALA 491 N -1.58 1.45 0.00 5.36 0.00 -2.00 0.13 119.26 122.61 2fff h ALA 491 Ca -0.51 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.36 2fff h ALA 491 Cb 1.30 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 18.78 2fff h ALA 491 CO 0.57 0.47 0.00 0.27 0.00 0.00 0.00 179.25 180.56 2fff n ASN 492 N -4.44 0.00 0.00 0.00 0.23 -1.26 -4.87 115.26 104.92 2fff n ASN 492 Ca 0.11 -0.21 0.00 0.00 -0.53 0.00 0.00 54.58 53.95 2fff n ASN 492 Cb 0.09 -0.07 0.00 0.00 -2.08 0.00 0.00 39.78 37.72 2fff n ASN 492 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2fff n GLY 493 N -0.36 0.75 3.83 4.83 0.00 0.44 -5.06 105.19 109.61 2fff n GLY 493 Ca 0.07 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.73 2fff n GLY 493 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2fff s ASN 494 N -2.79 6.96 0.38 1.61 0.02 -1.26 -4.77 114.94 115.10 2fff s ASN 494 Ca 0.00 1.23 -0.26 0.00 -1.02 0.00 0.00 52.86 52.81 2fff s ASN 494 Cb 0.00 -2.35 -0.09 0.00 0.02 0.00 0.00 41.25 38.84 2fff s ASN 494 CO 0.00 0.14 1.12 -2.16 0.02 0.00 0.00 177.10 176.22 2fff s PRO 495 N -1.70 4.20 -0.25 -0.60 0.04 -1.26 0.51 135.00 135.94 2fff s PRO 495 Ca 0.36 1.73 -0.29 0.00 0.04 0.00 0.00 61.00 62.84 2fff s PRO 495 Cb -0.17 -2.73 -0.00 0.00 0.04 0.00 0.00 34.50 31.64 2fff s PRO 495 CO 0.20 -0.16 1.24 0.42 0.04 0.00 0.00 177.00 178.74 2fff s ILE 496 N -1.44 4.28 0.20 0.56 1.01 -0.47 -4.78 121.20 120.55 2fff s ILE 496 Ca 0.55 1.49 0.05 0.00 0.00 0.00 0.00 60.65 62.74 2fff s ILE 496 Cb -0.28 -4.16 -0.04 0.00 0.01 0.00 0.00 42.46 38.00 2fff s ILE 496 CO 0.36 -0.34 0.23 -0.04 0.00 0.00 0.00 174.94 175.14 2fff s MET 497 N 3.81 3.14 -0.23 2.79 -1.94 -1.26 -4.68 119.30 120.92 2fff s MET 497 Ca 0.53 -0.83 -0.04 0.00 -1.71 0.00 0.00 55.69 53.64 2fff s MET 497 Cb -0.17 -2.75 0.09 0.00 2.01 0.00 0.00 34.83 34.00 2fff s MET 497 CO 0.18 0.46 0.14 -0.47 -0.01 0.00 0.00 175.02 175.32 2fff s TYR 498 N -1.89 0.13 0.00 -0.03 5.04 0.31 -4.75 117.35 116.16 2fff s TYR 498 Ca 0.33 -0.45 0.00 0.00 -2.44 0.00 0.00 57.07 54.50 2fff s TYR 498 Cb -0.10 -0.71 0.00 0.00 0.35 0.00 0.00 41.96 41.50 2fff s TYR 498 CO 0.26 -0.68 0.00 0.00 -1.34 0.00 0.00 175.55 173.79 2fff n ALA 499 N 5.28 0.00 1.05 3.97 0.00 -1.26 -0.87 120.51 128.67 2fff n ALA 499 Ca -0.06 0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.50 2fff n ALA 499 Cb 0.46 0.00 0.09 0.00 0.00 0.00 0.00 19.45 20.00 2fff n ALA 499 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2fff n ASN 500 N 6.90 2.16 -4.73 0.00 3.02 -1.26 -4.95 115.26 116.40 2fff n ASN 500 Ca 0.00 -1.58 -0.40 0.00 -0.03 0.00 0.00 54.58 52.56 2fff n ASN 500 Cb 0.00 0.29 -0.04 0.00 -0.61 0.00 0.00 39.78 39.41 2fff n ASN 500 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 2fff s SER 501 N -2.33 7.25 0.00 6.41 0.15 -0.05 -4.95 113.70 120.18 2fff s SER 501 Ca 0.23 1.51 0.30 0.00 0.70 0.00 0.00 55.95 58.68 2fff s SER 501 Cb 0.19 -2.50 1.51 0.00 -1.71 0.00 0.00 66.02 63.51 2fff s SER 501 CO 0.48 -0.08 2.00 0.29 1.20 0.00 0.00 173.24 177.14 2fff n LYS 502 N 3.18 1.30 0.00 5.44 5.02 -1.26 -0.53 118.16 131.31 2fff n LYS 502 Ca 0.00 -0.44 0.00 0.00 -2.02 0.00 0.00 58.31 55.85 2fff n LYS 502 Cb 0.50 -1.49 0.00 0.00 -0.02 0.00 0.00 35.03 34.02 2fff n LYS 502 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2fff n GLY 503 N 1.08 0.82 0.00 0.72 0.00 -1.26 -3.39 105.19 103.16 2fff n GLY 503 Ca 0.22 -2.27 0.00 0.00 0.00 0.00 0.00 46.02 43.96 2fff n GLY 503 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2fff n THR 504 N -0.82 0.00 -1.31 2.61 -2.24 0.19 -4.74 114.28 107.98 2fff n THR 504 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 2fff n THR 504 Cb 0.00 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.23 2fff n THR 504 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2fff n GLY 505 N 2.33 5.18 3.78 3.38 0.00 -1.25 -3.85 105.19 114.76 2fff n GLY 505 Ca 0.00 -0.96 -0.36 0.00 0.00 0.00 0.00 46.02 44.70 2fff n GLY 505 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2fff s MET 506 N 2.86 3.76 0.08 1.61 -1.94 -1.26 -0.07 119.30 124.34 2fff s MET 506 Ca 0.00 1.67 -0.24 0.00 -1.71 0.00 0.00 55.69 55.41 2fff s MET 506 Cb 0.00 -2.33 0.06 0.00 2.01 0.00 0.00 34.83 34.57 2fff s MET 506 CO 0.00 -0.52 0.58 0.00 -0.01 0.00 0.00 175.02 175.07 2fff s MET 507 N -2.81 1.15 0.78 2.03 0.23 -0.86 -4.89 119.30 114.93 2fff s MET 507 Ca 0.64 -0.28 -0.11 0.00 -1.03 0.00 0.00 55.69 54.92 2fff s MET 507 Cb -0.26 0.53 0.06 0.00 -1.53 0.00 0.00 34.83 33.63 2fff s MET 507 CO 0.31 -0.45 1.10 0.95 -2.03 0.00 0.00 175.02 174.89 2fff s THR 508 N -2.88 3.22 0.25 3.16 -4.23 -1.26 -1.26 115.64 112.63 2fff s THR 508 Ca -0.03 0.41 -0.03 0.00 -1.18 0.00 0.00 61.69 60.86 2fff s THR 508 Cb -0.00 -2.86 0.22 0.00 1.34 0.00 0.00 72.50 71.20 2fff s THR 508 CO -0.05 -0.50 1.79 0.25 -0.54 0.00 0.00 174.62 175.56 2fff h LEU 509 N -1.10 0.60 0.08 4.79 5.85 -1.47 -0.23 115.31 123.84 2fff h LEU 509 Ca -0.44 0.07 0.02 0.00 0.84 0.00 0.00 57.88 58.37 2fff h LEU 509 Cb 1.24 -0.04 -0.03 0.00 0.37 0.00 0.00 40.66 42.19 2fff h LEU 509 CO 0.51 0.31 -0.24 1.23 -0.34 0.00 0.00 178.44 179.91 2fff h GLY 510 N 0.71 -0.41 0.77 3.75 0.00 -1.87 -0.60 103.07 105.42 2fff h GLY 510 Ca 0.42 0.28 0.05 0.00 0.00 0.00 0.00 47.33 48.08 2fff h GLY 510 CO -0.30 -0.21 0.45 -2.09 0.00 0.00 0.00 176.54 174.39 2fff h GLU 511 N -0.42 0.81 -0.79 4.80 4.81 -1.87 0.17 114.58 122.10 2fff h GLU 511 Ca 0.04 -0.05 0.01 0.00 -0.13 0.00 0.00 59.36 59.23 2fff h GLU 511 Cb 0.46 -0.18 -0.04 0.00 0.63 0.00 0.00 28.75 29.62 2fff h GLU 511 CO -0.16 0.54 0.52 0.00 -0.73 0.00 0.00 179.01 179.18 2fff h ALA 512 N 1.34 1.00 0.04 2.92 0.00 -0.62 -2.21 119.26 121.74 2fff h ALA 512 Ca 0.31 -0.06 -0.25 0.00 0.00 0.00 0.00 54.91 54.91 2fff h ALA 512 Cb 0.11 -0.32 0.01 0.00 0.00 0.00 0.00 17.79 17.59 2fff h ALA 512 CO -0.15 0.43 -1.05 -0.07 0.00 0.00 0.00 179.25 178.41 2fff h LEU 513 N 1.07 0.59 -0.76 0.00 3.38 -0.86 0.21 115.31 118.95 2fff h LEU 513 Ca 0.29 -0.51 -0.08 0.00 0.09 0.00 0.00 57.88 57.67 2fff h LEU 513 Cb -0.11 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.43 2fff h LEU 513 CO -0.06 1.33 0.06 0.78 0.09 0.00 0.00 178.44 180.64 2fff h ASN 514 N 0.22 0.97 0.98 -0.43 -0.26 -0.77 -2.88 115.58 113.41 2fff h ASN 514 Ca -0.11 -0.24 -0.15 0.00 -0.56 0.00 0.00 56.30 55.24 2fff h ASN 514 Cb 1.71 -0.26 -0.02 0.00 -1.06 0.00 0.00 38.32 38.69 2fff h ASN 514 CO 0.19 0.99 -1.09 1.88 -1.06 0.00 0.00 177.43 178.34 2fff h TYR 515 N 0.94 0.00 -4.78 1.19 -1.99 -1.50 -3.37 116.97 107.45 2fff h TYR 515 Ca 0.18 0.00 -0.31 0.00 2.00 0.00 0.00 58.73 60.60 2fff h TYR 515 Cb 0.46 0.00 0.11 0.00 2.00 0.00 0.00 36.73 39.30 2fff h TYR 515 CO 0.03 0.57 -0.54 0.45 -0.00 0.00 0.00 178.16 178.68 2fff n SER 516 N -3.02 -5.15 -4.65 3.88 2.88 0.66 -4.96 113.62 103.25 2fff n SER 516 Ca -0.05 -0.43 -0.36 0.00 -1.33 0.00 0.00 58.87 56.70 2fff n SER 516 Cb 0.81 -4.04 0.08 0.00 -0.75 0.00 0.00 64.21 60.31 2fff n SER 516 CO 0.00 0.00 0.00 0.79 -1.23 0.00 0.00 175.04 174.60 2fff n TRP 517 N -4.38 1.08 -0.09 0.66 7.02 -0.70 -4.96 117.44 116.06 2fff n TRP 517 Ca -0.01 0.41 -0.17 0.00 -1.02 0.00 0.00 57.50 56.70 2fff n TRP 517 Cb 0.55 -2.14 -0.13 0.00 -2.42 0.00 0.00 31.31 27.17 2fff n TRP 517 CO 0.00 0.00 0.00 0.09 -2.02 0.00 0.00 177.69 175.76 2fff n ASN 518 N -1.79 1.70 -0.14 -0.99 3.02 -1.26 -4.45 115.26 111.35 2fff n ASN 518 Ca 0.14 -0.01 -0.07 0.00 -0.03 0.00 0.00 54.58 54.62 2fff n ASN 518 Cb 0.49 -0.32 0.02 0.00 -0.61 0.00 0.00 39.78 39.36 2fff n ASN 518 CO 0.00 0.00 0.00 0.40 -2.62 0.00 0.00 177.26 175.04 2fff h ILE 519 N 0.02 1.04 -0.41 2.41 2.04 -1.90 -1.33 117.51 119.38 2fff h ILE 519 Ca -0.52 -0.17 0.07 0.00 1.00 0.00 0.00 64.86 65.23 2fff h ILE 519 Cb 1.98 0.48 -0.02 0.00 -0.74 0.00 0.00 36.82 38.53 2fff h ILE 519 CO -0.02 0.09 0.28 -0.65 0.00 0.00 0.00 178.15 177.85 2fff h PRO 520 N 0.51 0.27 -0.06 2.37 0.11 -1.78 -0.24 132.00 133.18 2fff h PRO 520 Ca 0.17 -0.02 -0.09 0.00 0.11 0.00 0.00 66.00 66.17 2fff h PRO 520 Cb 0.02 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 31.07 2fff h PRO 520 CO -0.08 0.18 -0.33 0.00 -0.21 0.00 0.00 178.00 177.56 2fff h ALA 521 N 1.78 0.12 -0.39 -0.75 0.00 -1.63 -1.92 119.26 116.47 2fff h ALA 521 Ca 0.18 -0.45 0.08 0.00 0.00 0.00 0.00 54.91 54.72 2fff h ALA 521 Cb 0.38 -0.00 -0.07 0.00 0.00 0.00 0.00 17.79 18.09 2fff h ALA 521 CO -0.04 0.19 -0.03 -0.92 0.00 0.00 0.00 179.25 178.45 2fff h TYR 522 N -0.17 -0.09 0.00 0.00 3.20 -0.51 -1.83 116.97 117.57 2fff h TYR 522 Ca -0.02 0.03 -0.07 0.00 3.14 0.00 0.00 58.73 61.81 2fff h TYR 522 Cb 0.99 0.10 -0.01 0.00 1.54 0.00 0.00 36.73 39.35 2fff h TYR 522 CO 0.13 -0.11 -0.31 -1.49 -1.64 0.00 0.00 178.16 174.74 2fff h TRP 523 N 0.07 0.00 -0.06 -3.82 4.06 -1.03 -1.66 115.95 113.50 2fff h TRP 523 Ca 0.19 0.00 -0.08 0.00 2.06 0.00 0.00 58.89 61.06 2fff h TRP 523 Cb 0.28 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.45 2fff h TRP 523 CO -0.29 0.31 -0.28 1.15 -3.56 0.00 0.00 178.44 175.77 2fff h THR 524 N 0.00 1.43 -0.19 1.49 2.02 -0.76 -1.83 112.91 115.07 2fff h THR 524 Ca -0.00 -1.70 -0.13 0.00 0.77 0.00 0.00 66.41 65.35 2fff h THR 524 Cb 0.57 2.34 -0.01 0.00 -1.74 0.00 0.00 68.15 69.31 2fff h THR 524 CO 0.04 0.48 -0.43 0.22 0.37 0.00 0.00 175.52 176.20 2fff h TYR 525 N -0.21 0.54 -0.92 3.16 3.20 -1.25 -1.91 116.97 119.58 2fff h TYR 525 Ca -0.02 -0.16 -0.00 0.00 3.14 0.00 0.00 58.73 61.69 2fff h TYR 525 Cb 0.93 -0.11 -0.04 0.00 1.54 0.00 0.00 36.73 39.04 2fff h TYR 525 CO 0.13 0.81 0.57 -0.09 -1.64 0.00 0.00 178.16 177.94 2fff h ARG 526 N 0.37 1.25 -0.65 1.82 2.43 -1.26 -0.57 114.38 117.77 2fff h ARG 526 Ca 0.03 -0.10 -0.08 0.00 -0.81 0.00 0.00 59.98 59.01 2fff h ARG 526 Cb 0.91 -0.27 -0.03 0.00 -0.42 0.00 0.00 29.97 30.17 2fff h ARG 526 CO 0.08 0.86 0.10 1.98 -1.51 0.00 0.00 179.97 181.48 2fff h MET 527 N 1.27 1.07 -0.75 0.20 4.05 -0.80 -0.88 114.93 119.10 2fff h MET 527 Ca 0.33 -0.29 -0.04 0.00 -0.28 0.00 0.00 59.70 59.42 2fff h MET 527 Cb -0.07 -0.12 -0.03 0.00 -0.80 0.00 0.00 31.60 30.57 2fff h MET 527 CO -0.06 1.00 0.33 -0.07 0.23 0.00 0.00 176.91 178.33 2fff h LEU 528 N 0.99 1.01 0.50 3.39 3.38 -0.68 -1.83 115.31 122.06 2fff h LEU 528 Ca 0.19 -0.16 -0.02 0.00 0.09 0.00 0.00 57.88 57.98 2fff h LEU 528 Cb 0.45 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 40.94 2fff h LEU 528 CO 0.01 0.88 -0.24 0.03 0.09 0.00 0.00 178.44 179.22 2fff h ARG 529 N 1.06 -0.65 -0.61 1.13 3.08 -1.00 -0.37 114.38 117.02 2fff h ARG 529 Ca 0.25 0.04 0.15 0.00 0.07 0.00 0.00 59.98 60.50 2fff h ARG 529 Cb 0.17 0.15 -0.03 0.00 0.08 0.00 0.00 29.97 30.34 2fff h ARG 529 CO -0.03 -0.41 0.43 0.93 -1.07 0.00 0.00 179.97 179.82 2fff h GLU 530 N -0.72 0.15 -0.73 0.04 5.08 -1.07 -1.07 114.58 116.26 2fff h GLU 530 Ca -0.07 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.28 2fff h GLU 530 Cb 0.54 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.75 2fff h GLU 530 CO 0.11 0.10 0.00 0.09 -1.00 0.00 0.00 179.01 178.31 2fff n ASN 531 N -4.41 3.95 -2.20 1.42 4.13 -0.70 -4.97 115.26 112.48 2fff n ASN 531 Ca 0.11 -2.02 -0.17 0.00 1.68 0.00 0.00 54.58 54.19 2fff n ASN 531 Cb 0.58 -0.49 0.02 0.00 -1.54 0.00 0.00 39.78 38.34 2fff n ASN 531 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2fff n GLY 532 N 1.64 -0.25 3.73 7.41 0.00 -0.41 -4.97 105.19 112.35 2fff n GLY 532 Ca 0.24 -0.13 -0.41 0.00 0.00 0.00 0.00 46.02 45.73 2fff n GLY 532 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2fff s VAL 533 N -2.96 3.90 -1.44 1.61 1.01 -0.21 -4.92 120.40 117.39 2fff s VAL 533 Ca 0.16 1.60 -0.14 0.00 0.00 0.00 0.00 61.98 63.60 2fff s VAL 533 Cb -0.07 -4.02 0.05 0.00 0.00 0.00 0.00 36.38 32.34 2fff s VAL 533 CO 0.20 0.25 2.17 -0.67 0.00 0.00 0.00 175.10 177.06 2fff n ASP 534 N 2.58 4.02 -0.32 3.32 2.03 -1.26 -4.69 116.55 122.23 2fff n ASP 534 Ca 0.03 -2.86 -0.04 0.00 0.52 0.00 0.00 54.79 52.45 2fff n ASP 534 Cb 0.46 -1.66 0.08 0.00 -0.72 0.00 0.00 41.12 39.29 2fff n ASP 534 CO 0.00 0.00 0.00 0.58 -1.92 0.00 0.00 177.20 175.86 2fff h VAL 535 N 4.11 1.24 -0.67 5.18 2.07 -1.94 -2.21 116.25 124.03 2fff h VAL 535 Ca 0.55 -0.49 0.11 0.00 0.82 0.00 0.00 66.70 67.69 2fff h VAL 535 Cb 0.66 -0.00 -0.08 0.00 -1.52 0.00 0.00 31.29 30.35 2fff h VAL 535 CO 1.84 0.24 0.26 0.50 0.02 0.00 0.00 177.57 180.43 2fff h LYS 536 N 1.19 0.42 -0.19 1.57 3.64 -2.00 -1.70 116.57 119.49 2fff h LYS 536 Ca 0.31 -0.03 0.04 0.00 -1.27 0.00 0.00 60.65 59.71 2fff h LYS 536 Cb -0.07 -0.09 -0.04 0.00 -0.41 0.00 0.00 32.23 31.61 2fff h LYS 536 CO -0.06 0.28 -0.08 0.78 -2.27 0.00 0.00 179.45 178.09 2fff h GLY 537 N 0.43 0.09 0.56 5.01 0.00 -1.79 -0.12 103.07 107.26 2fff h GLY 537 Ca 0.35 0.10 0.00 0.00 0.00 0.00 0.00 47.33 47.78 2fff h GLY 537 CO -0.34 -0.10 -0.37 -0.97 0.00 0.00 0.00 176.54 174.75 2fff h TYR 538 N -0.05 -1.01 -0.63 5.60 0.05 -1.21 -1.75 116.97 117.96 2fff h TYR 538 Ca 0.10 0.01 0.03 0.00 0.05 0.00 0.00 58.73 58.92 2fff h TYR 538 Cb 0.21 0.40 -0.04 0.00 1.01 0.00 0.00 36.73 38.31 2fff h TYR 538 CO -0.24 -0.51 0.39 0.52 -1.05 0.00 0.00 178.16 177.26 2fff h MET 539 N -0.73 0.73 -0.04 4.88 2.86 -1.18 -2.69 114.93 118.76 2fff h MET 539 Ca -0.02 -0.04 -0.08 0.00 -2.06 0.00 0.00 59.70 57.50 2fff h MET 539 Cb 0.68 -0.17 -0.01 0.00 0.06 0.00 0.00 31.60 32.16 2fff h MET 539 CO -0.09 0.49 -0.37 0.93 1.06 0.00 0.00 176.91 178.92 2fff h GLU 540 N 0.76 0.07 0.00 1.72 5.08 -0.99 -1.19 114.58 120.03 2fff h GLU 540 Ca 0.26 -0.03 -0.02 0.00 -1.00 0.00 0.00 59.36 58.56 2fff h GLU 540 Cb 0.03 -0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.28 2fff h GLU 540 CO -0.11 0.43 -0.11 0.87 -1.00 0.00 0.00 179.01 179.10 2fff h LYS 541 N 0.06 0.00 -0.07 2.33 1.57 -0.99 -0.68 116.57 118.80 2fff h LYS 541 Ca 0.01 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.79 2fff h LYS 541 Cb 0.68 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.99 2fff h LYS 541 CO 0.05 0.11 0.00 -1.33 -0.57 0.00 0.00 179.45 177.71 2fff n MET 542 N -3.88 1.96 -0.33 3.15 2.81 -0.71 -4.96 117.12 115.16 2fff n MET 542 Ca -0.02 -1.40 0.00 0.00 -1.81 0.00 0.00 57.70 54.46 2fff n MET 542 Cb 0.20 -1.47 0.00 0.00 -0.71 0.00 0.00 33.22 31.25 2fff n MET 542 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2fff n GLY 543 N 1.25 0.81 3.72 3.03 0.00 -0.26 -4.75 105.19 109.00 2fff n GLY 543 Ca 0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 2fff n GLY 543 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2fff s TYR 544 N -2.09 3.62 -0.36 1.61 1.51 -0.53 -4.96 117.35 116.15 2fff s TYR 544 Ca 0.00 1.59 -0.09 0.00 -1.01 0.00 0.00 57.07 57.56 2fff s TYR 544 Cb 0.00 -3.22 0.03 0.00 -0.11 0.00 0.00 41.96 38.66 2fff s TYR 544 CO 0.00 -0.43 0.16 -1.21 -1.11 0.00 0.00 175.55 172.96 2fff s GLU 545 N 0.51 2.77 -0.13 -0.62 2.02 -1.26 -4.02 118.70 117.96 2fff s GLU 545 Ca 0.52 -1.10 -0.00 0.00 0.02 0.00 0.00 54.97 54.41 2fff s GLU 545 Cb -0.26 -3.62 0.03 0.00 0.10 0.00 0.00 34.13 30.38 2fff s GLU 545 CO 0.30 -0.67 -0.10 0.42 0.02 0.00 0.00 175.26 175.23 2fff s ILE 546 N 1.50 1.28 0.22 -1.63 1.01 -1.26 -4.81 121.20 117.50 2fff s ILE 546 Ca 0.01 -0.47 -0.02 0.00 0.00 0.00 0.00 60.65 60.17 2fff s ILE 546 Cb -0.19 -1.26 -0.02 0.00 0.01 0.00 0.00 42.46 41.01 2fff s ILE 546 CO 0.05 0.39 1.57 1.55 0.00 0.00 0.00 174.94 178.50 2fff h PRO 547 N 8.12 0.55 -3.41 2.79 0.13 -1.98 -3.42 132.00 134.78 2fff h PRO 547 Ca -0.33 -0.30 -0.43 0.00 -0.87 0.00 0.00 66.00 64.08 2fff h PRO 547 Cb 1.13 0.01 -0.39 0.00 0.13 0.00 0.00 31.00 31.88 2fff h PRO 547 CO 0.46 0.89 -0.75 -2.00 -0.23 0.00 0.00 178.00 176.36 2fff s GLU 548 N -4.17 0.26 0.12 0.86 2.56 -1.26 -5.01 118.70 112.06 2fff s GLU 548 Ca -0.07 0.10 0.25 0.00 0.00 0.00 0.00 54.97 55.25 2fff s GLU 548 Cb 0.12 -1.13 0.62 0.00 2.00 0.00 0.00 34.13 35.74 2fff s GLU 548 CO 0.83 -0.43 1.55 0.66 -0.56 0.00 0.00 175.26 177.30 2fff n TYR 549 N 5.22 0.54 -0.93 5.30 4.02 -1.26 -4.50 117.16 125.55 2fff n TYR 549 Ca -0.06 0.16 -0.12 0.00 -0.01 0.00 0.00 57.90 57.87 2fff n TYR 549 Cb 0.49 -0.68 -0.15 0.00 -0.02 0.00 0.00 39.34 38.99 2fff n TYR 549 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2fff n GLY 550 N 1.37 2.88 2.94 2.72 0.00 -1.26 -4.84 105.19 109.00 2fff n GLY 550 Ca 0.05 -1.12 -0.24 0.00 0.00 0.00 0.00 46.02 44.71 2fff n GLY 550 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2fff s ILE 551 N 1.24 0.92 0.39 -0.61 1.01 -1.26 -5.04 121.20 117.85 2fff s ILE 551 Ca 0.61 -0.30 0.14 0.00 0.00 0.00 0.00 60.65 61.10 2fff s ILE 551 Cb 0.29 -0.91 0.13 0.00 0.01 0.00 0.00 42.46 41.98 2fff s ILE 551 CO -0.00 0.33 1.89 -0.33 0.00 0.00 0.00 174.94 176.82 2fff h GLU 552 N 7.50 0.00 -0.64 2.79 5.08 -1.94 -2.46 114.58 124.91 2fff h GLU 552 Ca -0.31 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.05 2fff h GLU 552 Cb 1.16 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.41 2fff h GLU 552 CO 0.44 0.30 0.00 -1.13 -1.00 0.00 0.00 179.01 177.62 2fff n SER 553 N -4.11 3.74 -0.10 1.42 3.41 -1.26 -4.52 113.62 112.20 2fff n SER 553 Ca -0.02 -2.16 -0.06 0.00 -0.26 0.00 0.00 58.87 56.37 2fff n SER 553 Cb 0.35 -0.47 0.00 0.00 -0.26 0.00 0.00 64.21 63.83 2fff n SER 553 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 2fff h LEU 554 N 3.65 -0.43 -2.26 1.04 5.85 -1.54 -0.59 115.31 121.03 2fff h LEU 554 Ca 0.00 0.12 0.00 0.00 0.84 0.00 0.00 57.88 58.84 2fff h LEU 554 Cb 1.04 0.26 0.00 0.00 0.37 0.00 0.00 40.66 42.33 2fff h LEU 554 CO 0.09 -0.15 0.00 1.55 -0.34 0.00 0.00 178.44 179.58 2fff h PRO 555 N -0.05 0.00 -0.48 5.25 0.13 -1.84 0.10 132.00 135.11 2fff h PRO 555 Ca 0.17 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.30 2fff h PRO 555 Cb 0.31 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.44 2fff h PRO 555 CO -0.38 0.00 0.00 -1.33 -0.23 0.00 0.00 178.00 176.06 2fff n MET 556 N -2.92 2.16 -0.50 0.86 2.81 -0.34 -3.07 117.12 116.13 2fff n MET 556 Ca -0.02 -1.68 0.00 0.00 -1.81 0.00 0.00 57.70 54.19 2fff n MET 556 Cb 0.13 -1.40 0.00 0.00 -0.71 0.00 0.00 33.22 31.24 2fff n MET 556 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2fff n GLY 557 N 1.18 0.75 3.70 3.03 0.00 0.02 -3.92 105.19 109.95 2fff n GLY 557 Ca 0.16 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.75 2fff n GLY 557 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2fff s GLY 558 N -1.56 1.83 -1.15 -0.02 0.00 -0.56 -2.80 107.32 103.06 2fff s GLY 558 Ca 0.00 1.09 0.00 0.00 0.00 0.00 0.00 44.72 45.81 2fff s GLY 558 CO 0.00 2.51 0.00 0.61 0.00 0.00 0.00 173.10 176.22 2fff n GLY 559 N 3.65 0.79 3.08 0.20 0.00 -1.26 -3.83 105.19 107.82 2fff n GLY 559 Ca 0.13 -0.46 -0.22 0.00 0.00 0.00 0.00 46.02 45.47 2fff n GLY 559 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2fff s ILE 560 N -2.48 1.05 -0.01 -0.61 1.01 -1.12 -4.62 121.20 114.42 2fff s ILE 560 Ca 0.00 -0.55 0.00 0.00 0.00 0.00 0.00 60.65 60.11 2fff s ILE 560 Cb 0.00 -0.89 0.01 0.00 0.01 0.00 0.00 42.46 41.59 2fff s ILE 560 CO 0.00 0.30 0.00 -1.83 0.00 0.00 0.00 174.94 173.41 2fff s GLU 561 N -0.16 0.06 0.03 2.79 -1.05 -1.26 -3.39 118.70 115.72 2fff s GLU 561 Ca 0.02 0.02 -0.03 0.00 -0.15 0.00 0.00 54.97 54.84 2fff s GLU 561 Cb -0.07 -0.13 -0.02 0.00 -0.44 0.00 0.00 34.13 33.48 2fff s GLU 561 CO 0.00 -0.03 0.03 0.14 0.95 0.00 0.00 175.26 176.35 2fff s VAL 562 N 0.27 0.14 0.56 1.83 -7.23 0.21 -4.65 120.40 111.54 2fff s VAL 562 Ca -0.02 -1.17 -0.15 0.00 -1.81 0.00 0.00 61.98 58.83 2fff s VAL 562 Cb -0.04 -0.81 -0.06 0.00 0.56 0.00 0.00 36.38 36.03 2fff s VAL 562 CO -0.01 -0.64 1.01 0.42 -0.31 0.00 0.00 175.10 175.57 2fff s THR 563 N -2.48 4.45 0.21 5.32 -4.23 -1.26 -2.43 115.64 115.23 2fff s THR 563 Ca -0.06 1.05 -0.09 0.00 -1.18 0.00 0.00 61.69 61.41 2fff s THR 563 Cb -0.02 -3.69 0.17 0.00 1.34 0.00 0.00 72.50 70.29 2fff s THR 563 CO -0.04 -0.79 1.84 0.58 -0.54 0.00 0.00 174.62 175.66 2fff h VAL 564 N 0.43 1.24 -0.76 2.29 2.07 -1.71 -1.27 116.25 118.54 2fff h VAL 564 Ca -0.46 -0.58 0.00 0.00 0.82 0.00 0.00 66.70 66.49 2fff h VAL 564 Cb 1.19 0.15 -0.04 0.00 -1.52 0.00 0.00 31.29 31.07 2fff h VAL 564 CO 0.61 0.26 0.49 0.00 0.02 0.00 0.00 177.57 178.95 2fff h ALA 565 N 1.24 0.97 -0.31 1.67 0.00 -1.35 0.96 119.26 122.43 2fff h ALA 565 Ca 0.29 -0.07 -0.16 0.00 0.00 0.00 0.00 54.91 54.97 2fff h ALA 565 Cb 0.02 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 17.50 2fff h ALA 565 CO -0.05 0.41 -0.43 0.37 0.00 0.00 0.00 179.25 179.55 2fff h GLN 566 N 1.04 0.83 0.00 0.00 5.75 -1.80 -2.73 115.11 118.21 2fff h GLN 566 Ca 0.28 -0.48 -0.12 0.00 -0.15 0.00 0.00 58.65 58.17 2fff h GLN 566 Cb -0.09 0.04 -0.02 0.00 1.07 0.00 0.00 27.48 28.49 2fff h GLN 566 CO -0.06 1.12 -0.57 1.25 -2.65 0.00 0.00 178.83 177.93 2fff h HIS 567 N 0.61 0.00 -0.69 3.99 2.76 -0.75 -2.22 115.15 118.85 2fff h HIS 567 Ca 0.03 0.00 -0.03 0.00 -2.20 0.00 0.00 60.37 58.18 2fff h HIS 567 Cb 1.02 0.00 -0.03 0.00 1.55 0.00 0.00 27.41 29.95 2fff h HIS 567 CO 0.07 0.57 0.32 1.15 -1.30 0.00 0.00 177.93 178.74 2fff h THR 568 N 0.00 1.23 -0.50 6.26 2.02 -0.73 -2.95 112.91 118.24 2fff h THR 568 Ca -0.01 -0.66 -0.05 0.00 0.77 0.00 0.00 66.41 66.47 2fff h THR 568 Cb 1.05 0.36 -0.02 0.00 -1.74 0.00 0.00 68.15 67.79 2fff h THR 568 CO 0.07 0.27 0.10 -1.13 0.37 0.00 0.00 175.52 175.21 2fff h ASN 569 N 0.98 0.71 -0.35 4.18 -0.73 -1.09 0.55 115.58 119.84 2fff h ASN 569 Ca 0.24 -0.13 0.01 0.00 1.87 0.00 0.00 56.30 58.28 2fff h ASN 569 Cb 0.12 -0.19 -0.02 0.00 0.27 0.00 0.00 38.32 38.51 2fff h ASN 569 CO -0.03 0.72 0.23 1.23 -0.37 0.00 0.00 177.43 179.21 2fff h GLY 570 N 0.94 0.49 1.51 1.57 0.00 -1.37 -1.81 103.07 104.39 2fff h GLY 570 Ca 0.16 -0.18 -0.08 0.00 0.00 0.00 0.00 47.33 47.24 2fff h GLY 570 CO 0.00 0.17 -0.10 -0.97 0.00 0.00 0.00 176.54 175.64 2fff h TYR 571 N 0.47 0.64 -0.46 5.60 -1.99 -1.35 -2.60 116.97 117.28 2fff h TYR 571 Ca 0.13 -0.10 0.07 0.00 2.00 0.00 0.00 58.73 60.83 2fff h TYR 571 Cb -0.05 -0.17 -0.06 0.00 2.00 0.00 0.00 36.73 38.46 2fff h TYR 571 CO -0.06 0.68 0.13 0.37 -0.00 0.00 0.00 178.16 179.28 2fff h GLN 572 N 0.55 0.27 -0.20 4.88 -0.00 -0.79 0.17 115.11 119.99 2fff h GLN 572 Ca 0.10 -0.02 0.05 0.00 -0.00 0.00 0.00 58.65 58.78 2fff h GLN 572 Cb 0.51 -0.06 -0.05 0.00 0.00 0.00 0.00 27.48 27.87 2fff h GLN 572 CO 0.03 0.18 -0.15 1.15 0.00 0.00 0.00 178.83 180.04 2fff h THR 573 N 0.28 0.58 -0.69 2.39 2.02 -0.98 0.13 112.91 116.64 2fff h THR 573 Ca 0.22 0.00 -0.06 0.00 0.77 0.00 0.00 66.41 67.34 2fff h THR 573 Cb 0.26 0.58 -0.03 0.00 -1.74 0.00 0.00 68.15 67.22 2fff h THR 573 CO -0.26 0.00 0.19 -0.07 0.37 0.00 0.00 175.52 175.75 2fff h LEU 574 N -0.15 1.03 -0.66 2.58 3.38 -1.09 -1.16 115.31 119.24 2fff h LEU 574 Ca 0.12 -0.22 -0.03 0.00 0.09 0.00 0.00 57.88 57.84 2fff h LEU 574 Cb 0.32 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.77 2fff h LEU 574 CO -0.29 0.98 0.30 0.00 0.09 0.00 0.00 178.44 179.52 2fff h ALA 575 N 1.09 0.86 -0.30 1.53 0.00 -0.20 -3.16 119.26 119.08 2fff h ALA 575 Ca 0.22 -0.16 -0.34 0.00 0.00 0.00 0.00 54.91 54.63 2fff h ALA 575 Cb 0.34 -0.26 -0.12 0.00 0.00 0.00 0.00 17.79 17.74 2fff h ALA 575 CO -0.00 0.44 0.07 -1.71 0.00 0.00 0.00 179.25 178.05 2fff n ASN 576 N -4.44 5.94 -4.34 0.00 5.15 0.42 -4.76 115.26 113.23 2fff n ASN 576 Ca 0.05 -2.88 -0.38 0.00 -0.60 0.00 0.00 54.58 50.77 2fff n ASN 576 Cb 0.15 -1.29 -0.05 0.00 -0.53 0.00 0.00 39.78 38.06 2fff n ASN 576 CO 0.00 0.00 0.00 0.59 1.40 0.00 0.00 177.26 179.25 2fff n ASN 577 N 1.51 -2.46 0.00 1.20 3.02 -1.19 -1.23 115.26 116.10 2fff n ASN 577 Ca 0.43 -1.11 0.00 0.00 -0.03 0.00 0.00 54.58 53.87 2fff n ASN 577 Cb 0.70 -2.28 0.00 0.00 -0.61 0.00 0.00 39.78 37.58 2fff n ASN 577 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2fff n GLY 578 N -1.34 0.77 3.41 7.41 0.00 -0.45 -4.00 105.19 110.98 2fff n GLY 578 Ca 0.06 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.66 2fff n GLY 578 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2fff s VAL 579 N -3.00 5.03 0.18 1.61 1.01 -0.36 -0.72 120.40 124.14 2fff s VAL 579 Ca 0.00 -0.84 -0.31 0.00 0.00 0.00 0.00 61.98 60.84 2fff s VAL 579 Cb 0.00 -3.86 -0.09 0.00 0.00 0.00 0.00 36.38 32.43 2fff s VAL 579 CO 0.00 -0.36 1.40 -0.47 0.00 0.00 0.00 175.10 175.67 2fff s TYR 580 N 1.63 3.17 -0.10 5.22 5.04 0.64 -4.52 117.35 128.43 2fff s TYR 580 Ca 0.04 1.01 0.02 0.00 -2.44 0.00 0.00 57.07 55.70 2fff s TYR 580 Cb -0.20 -3.72 0.01 0.00 0.35 0.00 0.00 41.96 38.39 2fff s TYR 580 CO 0.08 -2.44 -0.15 -1.01 -1.34 0.00 0.00 175.55 170.68 2fff s HIS 581 N 0.54 1.94 0.29 4.97 3.76 -1.26 -1.59 115.29 123.94 2fff s HIS 581 Ca 0.62 -0.87 -0.30 0.00 -0.15 0.00 0.00 55.06 54.36 2fff s HIS 581 Cb -0.39 -1.39 -0.11 0.00 1.11 0.00 0.00 32.58 31.80 2fff s HIS 581 CO 0.36 -0.44 1.50 -1.14 -0.85 0.00 0.00 174.74 174.17 2fff s GLN 582 N 0.88 4.20 0.48 1.40 0.74 -1.26 -4.24 119.66 121.84 2fff s GLN 582 Ca -0.09 2.44 -0.23 0.00 0.05 0.00 0.00 55.36 57.52 2fff s GLN 582 Cb -0.15 -3.06 -0.07 0.00 1.10 0.00 0.00 33.01 30.83 2fff s GLN 582 CO 0.00 -0.50 1.27 -1.59 -0.55 0.00 0.00 175.29 173.92 2fff s LYS 583 N -0.70 3.59 -0.12 1.67 -2.85 -1.26 -4.55 119.74 115.53 2fff s LYS 583 Ca 0.60 2.05 -0.30 0.00 -1.00 0.00 0.00 55.97 57.31 2fff s LYS 583 Cb -0.45 -2.45 0.11 0.00 -2.06 0.00 0.00 37.83 32.99 2fff s LYS 583 CO 0.48 -0.77 0.93 -3.38 0.10 0.00 0.00 175.35 172.71 2fff s HIS 584 N -1.38 -0.41 -0.17 1.78 -3.43 -0.94 -5.01 115.29 105.72 2fff s HIS 584 Ca 0.65 0.64 0.06 0.00 -0.80 0.00 0.00 55.06 55.61 2fff s HIS 584 Cb -0.35 0.46 -0.08 0.00 -1.43 0.00 0.00 32.58 31.17 2fff s HIS 584 CO 0.43 -0.42 0.21 1.55 -2.00 0.00 0.00 174.74 174.52 2fff n VAL 585 N 0.60 0.00 -4.18 -5.38 3.14 -1.26 -1.79 118.33 109.46 2fff n VAL 585 Ca -0.11 -0.27 -0.34 0.00 -2.96 0.00 0.00 64.34 60.66 2fff n VAL 585 Cb 0.58 0.73 -0.13 0.00 -1.06 0.00 0.00 33.84 33.96 2fff n VAL 585 CO 0.00 0.00 0.00 -0.63 -6.46 0.00 0.00 176.83 169.74 2fff s ILE 586 N -1.95 3.69 -0.16 1.55 -1.09 -1.26 -0.55 121.20 121.43 2fff s ILE 586 Ca 0.00 -0.41 0.16 0.00 -2.23 0.00 0.00 60.65 58.18 2fff s ILE 586 Cb 0.04 -2.65 -0.23 0.00 -1.58 0.00 0.00 42.46 38.05 2fff s ILE 586 CO 0.26 0.45 0.11 -1.54 -1.23 0.00 0.00 174.94 172.99 2fff n SER 587 N 4.16 0.64 -3.63 3.58 3.41 -0.55 -4.76 113.62 116.48 2fff n SER 587 Ca -0.18 0.00 -0.16 0.00 -0.26 0.00 0.00 58.87 58.28 2fff n SER 587 Cb 0.52 1.06 -0.07 0.00 -0.26 0.00 0.00 64.21 65.45 2fff n SER 587 CO 0.00 0.00 0.00 -0.75 -0.16 0.00 0.00 175.04 174.13 2fff s LYS 588 N -2.54 0.85 -0.19 4.33 2.20 -1.11 -1.18 119.74 122.10 2fff s LYS 588 Ca -0.08 0.31 -0.01 0.00 -0.36 0.00 0.00 55.97 55.83 2fff s LYS 588 Cb 0.06 0.40 0.05 0.00 -1.51 0.00 0.00 37.83 36.83 2fff s LYS 588 CO 0.73 -0.22 -0.03 0.42 -0.36 0.00 0.00 175.35 175.89 2fff s ILE 589 N -0.78 1.09 -0.17 5.43 1.01 -0.20 -0.99 121.20 126.60 2fff s ILE 589 Ca -0.08 -0.77 -0.04 0.00 0.00 0.00 0.00 60.65 59.76 2fff s ILE 589 Cb -0.03 -1.36 -0.02 0.00 0.01 0.00 0.00 42.46 41.06 2fff s ILE 589 CO 0.06 -0.00 -0.04 -1.61 0.00 0.00 0.00 174.94 173.34 2fff s GLU 590 N 1.62 3.58 0.70 2.79 2.02 -0.25 -1.14 118.70 128.02 2fff s GLU 590 Ca -0.01 -0.56 -0.13 0.00 0.02 0.00 0.00 54.97 54.28 2fff s GLU 590 Cb -0.17 -2.93 0.02 0.00 0.10 0.00 0.00 34.13 31.16 2fff s GLU 590 CO -0.07 0.12 1.11 0.00 0.02 0.00 0.00 175.26 176.44 2fff s ALA 591 N 0.67 2.37 0.39 5.21 0.00 0.61 -0.10 121.76 130.90 2fff s ALA 591 Ca -0.02 0.47 0.19 0.00 0.00 0.00 0.00 51.96 52.60 2fff s ALA 591 Cb -0.15 -3.31 1.12 0.00 0.00 0.00 0.00 23.12 20.78 2fff s ALA 591 CO 0.02 -1.49 1.74 0.00 0.00 0.00 0.00 175.76 176.04 2fff h ALA 592 N -0.39 2.24 -0.19 0.00 0.00 -1.44 0.23 119.26 119.71 2fff h ALA 592 Ca -0.46 0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.53 2fff h ALA 592 Cb 1.24 0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.09 2fff h ALA 592 CO 0.53 -0.69 0.00 -0.40 0.00 0.00 0.00 179.25 178.69 2fff n ASP 593 N -4.68 1.74 0.00 0.00 3.85 -1.26 -4.90 116.55 111.30 2fff n ASP 593 Ca 0.27 -2.13 0.00 0.00 -0.71 0.00 0.00 54.79 52.22 2fff n ASP 593 Cb 0.94 -0.34 0.00 0.00 -1.35 0.00 0.00 41.12 40.36 2fff n ASP 593 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 2fff n GLY 594 N 0.52 2.41 3.78 6.12 0.00 0.80 -5.07 105.19 113.75 2fff n GLY 594 Ca 0.08 -0.26 -0.34 0.00 0.00 0.00 0.00 46.02 45.49 2fff n GLY 594 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2fff s ARG 595 N 0.00 3.46 -0.56 1.61 0.52 -1.25 -4.57 118.95 118.16 2fff s ARG 595 Ca 0.00 1.48 -0.18 0.00 -0.52 0.00 0.00 55.73 56.51 2fff s ARG 595 Cb 0.00 -2.03 0.10 0.00 0.52 0.00 0.00 34.95 33.54 2fff s ARG 595 CO 0.00 -0.74 0.63 0.08 0.02 0.00 0.00 175.30 175.29 2fff s VAL 596 N -1.94 4.93 -0.47 3.52 1.01 -1.26 -0.29 120.40 125.91 2fff s VAL 596 Ca 0.70 -1.03 0.24 0.00 0.00 0.00 0.00 61.98 61.89 2fff s VAL 596 Cb -0.21 -4.41 0.22 0.00 0.00 0.00 0.00 36.38 31.99 2fff s VAL 596 CO 0.26 -0.99 1.48 -0.37 0.00 0.00 0.00 175.10 175.48 2fff h VAL 597 N 5.90 0.00 -2.69 2.92 -1.51 -1.51 -3.45 116.25 115.90 2fff h VAL 597 Ca -0.29 -0.85 -0.12 0.00 -1.23 0.00 0.00 66.70 64.22 2fff h VAL 597 Cb 1.09 1.68 -0.24 0.00 -2.13 0.00 0.00 31.29 31.70 2fff h VAL 597 CO 1.05 0.00 -0.21 -0.47 -1.23 0.00 0.00 177.57 176.72 2fff s TYR 598 N -3.22 -0.47 -0.17 5.19 6.14 -1.16 -4.89 117.35 118.77 2fff s TYR 598 Ca 0.06 1.16 -0.12 0.00 0.64 0.00 0.00 57.07 58.81 2fff s TYR 598 Cb 0.08 0.16 0.05 0.00 0.42 0.00 0.00 41.96 42.68 2fff s TYR 598 CO 0.69 -0.23 0.43 -2.00 0.64 0.00 0.00 175.55 175.08 2fff s GLU 599 N 0.21 0.44 0.15 4.97 2.12 -1.26 -1.03 118.70 124.31 2fff s GLU 599 Ca -0.00 0.73 -0.34 0.00 0.36 0.00 0.00 54.97 55.72 2fff s GLU 599 Cb -0.03 0.08 -0.14 0.00 0.26 0.00 0.00 34.13 34.30 2fff s GLU 599 CO 0.01 -0.12 1.57 0.98 -0.54 0.00 0.00 175.26 177.16 2fff n TYR 600 N 3.74 2.24 -4.63 5.30 9.36 -0.32 -5.01 117.16 127.82 2fff n TYR 600 Ca -0.19 0.28 -0.30 0.00 3.32 0.00 0.00 57.90 61.01 2fff n TYR 600 Cb 0.56 -2.54 -0.13 0.00 -0.63 0.00 0.00 39.34 36.60 2fff n TYR 600 CO 0.00 0.00 0.00 -1.14 0.22 0.00 0.00 176.86 175.94 2fff s GLN 601 N 0.97 1.80 -0.17 2.98 0.74 -1.26 -5.07 119.66 119.64 2fff s GLN 601 Ca 0.79 -1.13 -0.27 0.00 0.05 0.00 0.00 55.36 54.80 2fff s GLN 601 Cb -0.69 -2.05 -0.01 0.00 1.10 0.00 0.00 33.01 31.36 2fff s GLN 601 CO 0.39 0.50 0.91 0.16 -0.55 0.00 0.00 175.29 176.70 2fff s ASP 602 N -1.61 7.03 -0.65 6.67 1.47 -1.26 -4.95 116.67 123.38 2fff s ASP 602 Ca 0.14 1.28 0.05 0.00 1.18 0.00 0.00 52.55 55.20 2fff s ASP 602 Cb -0.10 -2.49 0.17 0.00 -0.34 0.00 0.00 42.92 40.16 2fff s ASP 602 CO 0.05 -0.47 0.48 0.29 0.68 0.00 0.00 175.17 176.20 2fff n LYS 603 N 5.48 1.56 -2.09 2.11 5.02 -1.26 -5.10 118.16 123.88 2fff n LYS 603 Ca 0.07 -4.25 -0.37 0.00 -2.02 0.00 0.00 58.31 51.74 2fff n LYS 603 Cb 0.48 -2.16 0.01 0.00 -0.02 0.00 0.00 35.03 33.34 2fff n LYS 603 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 2fff s PRO 604 N -1.24 3.39 -0.08 1.97 0.04 -1.26 -4.72 135.00 133.10 2fff s PRO 604 Ca 0.27 1.88 -0.01 0.00 0.04 0.00 0.00 61.00 63.18 2fff s PRO 604 Cb -0.01 -2.22 0.03 0.00 0.04 0.00 0.00 34.50 32.33 2fff s PRO 604 CO -0.17 -0.88 -0.01 0.08 0.04 0.00 0.00 177.00 176.06 2fff s VAL 605 N -1.52 0.48 -1.06 -0.36 1.01 -0.62 -4.97 120.40 113.36 2fff s VAL 605 Ca 0.69 0.05 -0.22 0.00 0.00 0.00 0.00 61.98 62.51 2fff s VAL 605 Cb -0.31 -0.61 0.06 0.00 0.00 0.00 0.00 36.38 35.51 2fff s VAL 605 CO 0.37 0.28 1.48 -1.58 0.00 0.00 0.00 175.10 175.64 2fff s GLN 606 N 1.90 3.65 -0.06 2.72 2.00 -1.26 -0.26 119.66 128.34 2fff s GLN 606 Ca 0.04 -1.29 -0.24 0.00 -2.00 0.00 0.00 55.36 51.88 2fff s GLN 606 Cb -0.12 -5.36 -0.27 0.00 0.80 0.00 0.00 33.01 28.06 2fff s GLN 606 CO -0.06 -2.19 0.94 0.28 -0.50 0.00 0.00 175.29 173.76 2fff h VAL 607 N 6.56 1.58 -3.23 1.34 2.07 -1.30 -3.44 116.25 119.82 2fff h VAL 607 Ca 0.23 -2.25 -0.64 0.00 0.82 0.00 0.00 66.70 64.87 2fff h VAL 607 Cb 0.99 3.03 -0.12 0.00 -1.52 0.00 0.00 31.29 33.66 2fff h VAL 607 CO 1.42 0.62 -0.68 -0.31 0.02 0.00 0.00 177.57 178.64 2fff s TYR 608 N -2.71 2.89 0.72 1.57 1.51 -1.08 -5.02 117.35 115.22 2fff s TYR 608 Ca -0.15 -0.09 -0.16 0.00 -1.01 0.00 0.00 57.07 55.65 2fff s TYR 608 Cb 0.00 -1.46 0.02 0.00 -0.11 0.00 0.00 41.96 40.42 2fff s TYR 608 CO 0.77 0.48 1.21 -1.13 -1.11 0.00 0.00 175.55 175.77 2fff n SER 609 N 0.35 1.44 0.22 2.29 3.41 -1.26 -4.50 113.62 115.57 2fff n SER 609 Ca -0.11 0.72 0.09 0.00 -0.26 0.00 0.00 58.87 59.31 2fff n SER 609 Cb 0.53 -1.51 0.62 0.00 -0.26 0.00 0.00 64.21 63.59 2fff n SER 609 CO 0.00 0.00 0.00 0.11 -0.16 0.00 0.00 175.04 174.99 2fff h LYS 610 N -0.09 0.05 -0.10 4.33 1.57 -1.94 -1.11 116.57 119.27 2fff h LYS 610 Ca -0.49 -0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.29 2fff h LYS 610 Cb 1.33 -0.01 -0.00 0.00 0.08 0.00 0.00 32.23 33.62 2fff h LYS 610 CO 0.50 0.03 0.05 0.00 -0.57 0.00 0.00 179.45 179.46 2fff h ALA 611 N 1.96 0.13 0.05 3.86 0.00 -1.90 -1.57 119.26 121.79 2fff h ALA 611 Ca 0.03 -0.07 0.01 0.00 0.00 0.00 0.00 54.91 54.88 2fff h ALA 611 Cb 0.07 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 2fff h ALA 611 CO -0.00 -0.31 -0.11 1.15 0.00 0.00 0.00 179.25 179.98 2fff h THR 612 N 0.04 0.74 -0.62 0.00 2.02 -1.68 -1.48 112.91 111.92 2fff h THR 612 Ca 0.03 0.00 -0.04 0.00 0.77 0.00 0.00 66.41 67.17 2fff h THR 612 Cb 0.12 0.74 -0.03 0.00 -1.74 0.00 0.00 68.15 67.24 2fff h THR 612 CO -0.00 0.00 0.23 0.00 0.37 0.00 0.00 175.52 176.11 2fff h ALA 613 N 0.72 0.81 -0.44 6.16 0.00 -1.17 -0.14 119.26 125.19 2fff h ALA 613 Ca 0.02 -0.18 -0.14 0.00 0.00 0.00 0.00 54.91 54.61 2fff h ALA 613 Cb 0.23 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 2fff h ALA 613 CO -0.08 0.45 -0.27 1.79 0.00 0.00 0.00 179.25 181.14 2fff h THR 614 N 0.87 1.27 -0.76 0.00 1.35 -1.17 -0.53 112.91 113.94 2fff h THR 614 Ca 0.20 -1.44 0.00 0.00 -0.55 0.00 0.00 66.41 64.62 2fff h THR 614 Cb 0.24 1.22 -0.04 0.00 -1.73 0.00 0.00 68.15 67.84 2fff h THR 614 CO -0.01 0.49 0.48 0.40 -0.25 0.00 0.00 175.52 176.63 2fff h ILE 615 N 0.81 1.21 -0.37 6.82 2.04 -0.87 -2.50 117.51 124.64 2fff h ILE 615 Ca 0.09 -0.42 -0.06 0.00 1.00 0.00 0.00 64.86 65.47 2fff h ILE 615 Cb 0.86 0.12 -0.02 0.00 -0.74 0.00 0.00 36.82 37.04 2fff h ILE 615 CO 0.08 0.21 -0.01 -0.03 0.00 0.00 0.00 178.15 178.39 2fff h MET 616 N 1.04 0.59 -0.55 2.37 4.05 -0.62 -2.52 114.93 119.28 2fff h MET 616 Ca 0.28 -0.14 0.02 0.00 -0.28 0.00 0.00 59.70 59.58 2fff h MET 616 Cb -0.07 -0.08 -0.03 0.00 -0.80 0.00 0.00 31.60 30.61 2fff h MET 616 CO -0.06 0.62 0.34 1.96 0.23 0.00 0.00 176.91 180.01 2fff h GLN 617 N 0.56 0.67 -0.33 0.39 4.20 -0.67 0.11 115.11 120.04 2fff h GLN 617 Ca 0.12 -0.04 -0.05 0.00 0.06 0.00 0.00 58.65 58.73 2fff h GLN 617 Cb 0.38 -0.15 -0.02 0.00 0.30 0.00 0.00 27.48 27.99 2fff h GLN 617 CO 0.01 0.44 -0.03 0.78 -0.67 0.00 0.00 178.83 179.37 2fff h GLY 618 N 0.69 0.57 0.83 3.46 0.00 -1.25 -0.86 103.07 106.50 2fff h GLY 618 Ca 0.22 -0.34 -0.05 0.00 0.00 0.00 0.00 47.33 47.15 2fff h GLY 618 CO -0.08 0.32 -0.05 1.41 0.00 0.00 0.00 176.54 178.14 2fff h LEU 619 N 0.50 0.43 -1.24 3.11 3.38 -0.91 -3.19 115.31 117.39 2fff h LEU 619 Ca 0.10 -0.36 -0.07 0.00 0.09 0.00 0.00 57.88 57.64 2fff h LEU 619 Cb 0.36 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 40.99 2fff h LEU 619 CO 0.01 0.69 -0.34 -0.07 0.09 0.00 0.00 178.44 178.83 2fff h LEU 620 N 0.16 0.00 -0.13 1.67 3.38 -0.84 -2.40 115.31 117.15 2fff h LEU 620 Ca 0.06 0.00 0.03 0.00 0.09 0.00 0.00 57.88 58.06 2fff h LEU 620 Cb 0.50 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.22 2fff h LEU 620 CO 0.02 0.34 -0.08 -0.09 0.09 0.00 0.00 178.44 178.72 2fff h ARG 621 N 0.00 -0.07 0.00 1.13 2.43 -1.20 -2.64 114.38 114.03 2fff h ARG 621 Ca -0.00 0.00 -0.05 0.00 -0.81 0.00 0.00 59.98 59.12 2fff h ARG 621 Cb 0.71 0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 30.27 2fff h ARG 621 CO 0.04 -0.05 -0.25 0.93 -1.51 0.00 0.00 179.97 179.14 2fff h GLU 622 N -0.07 0.00 -0.57 0.20 4.39 -1.47 -1.06 114.58 116.00 2fff h GLU 622 Ca 0.08 0.00 0.05 0.00 0.34 0.00 0.00 59.36 59.83 2fff h GLU 622 Cb 0.19 0.00 -0.05 0.00 -0.10 0.00 0.00 28.75 28.79 2fff h GLU 622 CO -0.18 0.25 0.30 0.28 -1.16 0.00 0.00 179.01 178.50 2fff h VAL 623 N 0.00 0.96 0.01 3.13 2.07 -1.22 0.52 116.25 121.72 2fff h VAL 623 Ca -0.00 -0.20 -0.13 0.00 0.82 0.00 0.00 66.70 67.19 2fff h VAL 623 Cb 0.55 0.34 0.01 0.00 -1.52 0.00 0.00 31.29 30.66 2fff h VAL 623 CO 0.03 0.10 -0.52 -0.07 0.02 0.00 0.00 177.57 177.13 2fff h LEU 624 N 0.57 0.44 -1.10 2.57 3.38 -1.32 -3.32 115.31 116.53 2fff h LEU 624 Ca 0.25 -0.79 -0.07 0.00 0.09 0.00 0.00 57.88 57.36 2fff h LEU 624 Cb 0.16 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 40.76 2fff h LEU 624 CO -0.17 1.17 -0.14 0.28 0.09 0.00 0.00 178.44 179.68 2fff h SER 625 N -0.25 0.46 0.05 -0.43 0.02 -1.13 -2.43 113.55 109.84 2fff h SER 625 Ca -0.07 -0.12 -0.03 0.00 -0.84 0.00 0.00 61.79 60.73 2fff h SER 625 Cb 1.27 -0.12 -0.01 0.00 0.14 0.00 0.00 62.40 63.68 2fff h SER 625 CO 0.10 0.63 -0.09 0.77 -1.14 0.00 0.00 176.83 177.10 2fff h SER 626 N 0.44 0.10 -0.60 3.07 4.64 -1.01 -3.47 113.55 116.72 2fff h SER 626 Ca 0.08 -0.01 -0.26 0.00 -0.47 0.00 0.00 61.79 61.13 2fff h SER 626 Cb 0.50 -0.02 -0.10 0.00 -0.31 0.00 0.00 62.40 62.46 2fff h SER 626 CO 0.03 0.20 -0.24 0.54 -0.87 0.00 0.00 176.83 176.50 2fff n ARG 627 N -4.37 -0.94 -0.01 4.77 1.74 -0.92 -4.88 116.66 112.05 2fff n ARG 627 Ca -0.02 0.94 -0.17 0.00 -0.77 0.00 0.00 57.85 57.83 2fff n ARG 627 Cb 0.20 -5.00 -0.10 0.00 -1.02 0.00 0.00 32.46 26.55 2fff n ARG 627 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 2fff h VAL 628 N 0.00 1.38 -0.13 1.55 2.07 -1.82 -3.35 116.25 115.95 2fff h VAL 628 Ca -0.26 -1.95 0.00 0.00 0.82 0.00 0.00 66.70 65.31 2fff h VAL 628 Cb 0.86 2.35 0.00 0.00 -1.52 0.00 0.00 31.29 32.98 2fff h VAL 628 CO 0.38 0.58 0.00 0.35 0.02 0.00 0.00 177.57 178.90 2fff n THR 629 N -4.19 0.35 -3.64 2.57 -2.24 -1.26 -4.99 114.28 100.88 2fff n THR 629 Ca -0.09 -0.68 -0.06 0.00 -2.27 0.00 0.00 64.05 60.95 2fff n THR 629 Cb 0.65 0.97 -0.07 0.00 -2.10 0.00 0.00 70.33 69.78 2fff n THR 629 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 2fff s THR 630 N -0.93 0.00 -2.17 4.28 -1.32 -1.26 -4.28 115.64 109.96 2fff s THR 630 Ca 0.16 0.00 0.20 0.00 -1.21 0.00 0.00 61.69 60.84 2fff s THR 630 Cb 0.10 -1.00 0.49 0.00 -1.51 0.00 0.00 72.50 70.58 2fff s THR 630 CO 0.14 0.00 1.63 0.35 -2.21 0.00 0.00 174.62 174.53 2fff n THR 631 N 3.46 0.12 -0.31 5.08 -2.24 -0.51 -4.33 114.28 115.55 2fff n THR 631 Ca -0.17 -0.20 -0.10 0.00 -2.27 0.00 0.00 64.05 61.31 2fff n THR 631 Cb 0.57 0.11 -0.08 0.00 -2.10 0.00 0.00 70.33 68.83 2fff n THR 631 CO 0.00 0.00 0.00 0.15 -0.57 0.00 0.00 175.07 174.65 2fff h PHE 632 N 1.33 -1.57 -0.38 4.78 3.04 -1.81 -0.00 116.94 122.33 2fff h PHE 632 Ca 0.00 0.10 -0.00 0.00 3.98 0.00 0.00 57.97 62.05 2fff h PHE 632 Cb 0.29 0.78 -0.02 0.00 2.56 0.00 0.00 35.95 39.57 2fff h PHE 632 CO 0.06 -0.33 0.23 0.87 -2.02 0.00 0.00 178.31 177.11 2fff h LYS 633 N -0.06 0.50 -0.00 1.11 1.57 -1.83 0.35 116.57 118.20 2fff h LYS 633 Ca 0.12 -0.04 -0.00 0.00 -1.87 0.00 0.00 60.65 58.86 2fff h LYS 633 Cb 0.38 -0.11 -0.00 0.00 0.08 0.00 0.00 32.23 32.58 2fff h LYS 633 CO -0.74 0.35 0.00 0.77 -0.57 0.00 0.00 179.45 179.26 2fff h SER 634 N 0.51 0.00 -0.51 0.86 0.02 -1.65 -1.92 113.55 110.86 2fff h SER 634 Ca 0.14 -0.28 0.07 0.00 -0.84 0.00 0.00 61.79 60.89 2fff h SER 634 Cb -0.02 -0.00 -0.06 0.00 0.14 0.00 0.00 62.40 62.46 2fff h SER 634 CO -0.03 0.28 0.16 0.78 -1.14 0.00 0.00 176.83 176.88 2fff h ASN 635 N -0.27 0.14 -0.49 3.07 2.35 -0.04 -1.77 115.58 118.57 2fff h ASN 635 Ca 0.00 0.07 -0.08 0.00 -0.55 0.00 0.00 56.30 55.74 2fff h ASN 635 Cb 0.28 0.06 -0.02 0.00 0.05 0.00 0.00 38.32 38.69 2fff h ASN 635 CO 0.00 0.11 0.03 0.25 -1.65 0.00 0.00 177.43 176.16 2fff h LEU 636 N 0.33 0.87 -0.72 1.61 5.85 -1.01 -2.85 115.31 119.39 2fff h LEU 636 Ca 0.25 -0.21 -0.03 0.00 0.84 0.00 0.00 57.88 58.73 2fff h LEU 636 Cb 0.29 -0.23 -0.03 0.00 0.37 0.00 0.00 40.66 41.05 2fff h LEU 636 CO -0.27 0.91 0.33 0.74 -0.34 0.00 0.00 178.44 179.81 2fff h THR 637 N 0.84 1.24 0.00 1.05 2.02 -0.65 0.13 112.91 117.53 2fff h THR 637 Ca 0.16 -0.69 -0.03 0.00 0.77 0.00 0.00 66.41 66.62 2fff h THR 637 Cb 0.46 0.36 -0.00 0.00 -1.74 0.00 0.00 68.15 67.22 2fff h THR 637 CO 0.02 0.29 -0.15 0.77 0.37 0.00 0.00 175.52 176.82 2fff h SER 638 N 1.02 0.00 0.07 4.18 4.64 -1.12 -2.87 113.55 119.46 2fff h SER 638 Ca 0.25 0.00 -0.25 0.00 -0.47 0.00 0.00 61.79 61.32 2fff h SER 638 Cb 0.14 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.22 2fff h SER 638 CO -0.03 0.15 -1.31 -0.07 -0.87 0.00 0.00 176.83 174.70 2fff h LEU 639 N 0.00 0.22 -5.56 5.97 3.38 -1.22 -3.46 115.31 114.64 2fff h LEU 639 Ca -0.00 -0.76 -0.22 0.00 0.09 0.00 0.00 57.88 56.99 2fff h LEU 639 Cb 0.40 -0.07 -0.21 0.00 0.09 0.00 0.00 40.66 40.87 2fff h LEU 639 CO 0.02 1.55 -0.57 0.21 0.09 0.00 0.00 178.44 179.74 2fff s ASN 640 N -6.90 -0.77 0.32 -0.43 3.04 0.38 -5.03 114.94 105.54 2fff s ASN 640 Ca -0.23 -1.71 0.07 0.00 0.04 0.00 0.00 52.86 51.03 2fff s ASN 640 Cb 0.05 1.43 0.78 0.00 -1.54 0.00 0.00 41.25 41.97 2fff s ASN 640 CO 0.70 -0.12 1.78 -0.65 -3.04 0.00 0.00 177.10 175.77 2fff h PRO 641 N 5.75 0.70 -0.33 0.43 0.11 -1.67 0.03 132.00 137.01 2fff h PRO 641 Ca 0.09 -0.04 -0.14 0.00 0.11 0.00 0.00 66.00 66.02 2fff h PRO 641 Cb 1.09 -0.16 -0.01 0.00 0.11 0.00 0.00 31.00 32.03 2fff h PRO 641 CO 0.10 0.46 -0.35 1.15 -0.21 0.00 0.00 178.00 179.16 2fff h THR 642 N 0.72 1.28 -0.27 -1.15 2.02 -1.93 -2.68 112.91 110.90 2fff h THR 642 Ca 0.57 -1.51 -0.18 0.00 0.77 0.00 0.00 66.41 66.07 2fff h THR 642 Cb 0.95 1.40 -0.00 0.00 -1.74 0.00 0.00 68.15 68.75 2fff h THR 642 CO -0.36 0.49 -0.54 0.25 0.37 0.00 0.00 175.52 175.73 2fff h LEU 643 N 0.63 0.88 -1.98 2.58 5.85 -1.80 -2.53 115.31 118.95 2fff h LEU 643 Ca 0.06 -0.47 0.19 0.00 0.84 0.00 0.00 57.88 58.50 2fff h LEU 643 Cb 0.89 -0.25 -0.03 0.00 0.37 0.00 0.00 40.66 41.64 2fff h LEU 643 CO 0.08 1.25 0.53 0.00 -0.34 0.00 0.00 178.44 179.96 2fff h ALA 644 N 0.77 2.53 -0.04 1.25 0.00 -0.74 -0.98 119.26 122.05 2fff h ALA 644 Ca 0.01 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2fff h ALA 644 Cb 1.13 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.97 2fff h ALA 644 CO 0.12 -0.87 0.00 0.09 0.00 0.00 0.00 179.25 178.59 2fff n ASN 645 N -4.08 1.03 -4.66 0.00 3.02 -0.95 -4.82 115.26 104.80 2fff n ASN 645 Ca 0.13 -1.41 -0.30 0.00 -0.03 0.00 0.00 54.58 52.96 2fff n ASN 645 Cb 0.78 -0.02 0.16 0.00 -0.61 0.00 0.00 39.78 40.09 2fff n ASN 645 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2fff s ALA 646 N -1.96 1.23 -1.07 5.41 0.00 -0.37 -4.90 121.76 120.09 2fff s ALA 646 Ca 0.38 0.22 -0.17 0.00 0.00 0.00 0.00 51.96 52.39 2fff s ALA 646 Cb 0.20 -3.31 0.14 0.00 0.00 0.00 0.00 23.12 20.15 2fff s ALA 646 CO 0.32 -2.71 1.31 0.34 0.00 0.00 0.00 175.76 175.02 2fff s ASP 647 N -2.96 6.82 -0.04 0.00 2.15 -1.26 -4.97 116.67 116.40 2fff s ASP 647 Ca 0.65 -2.42 -0.22 0.00 0.43 0.00 0.00 52.55 50.99 2fff s ASP 647 Cb -0.21 -2.42 -0.04 0.00 -0.30 0.00 0.00 42.92 39.95 2fff s ASP 647 CO 0.59 -0.96 0.66 0.26 -0.17 0.00 0.00 175.17 175.54 2fff s TRP 648 N 2.45 3.63 0.14 -5.34 0.52 -1.26 -4.31 118.94 114.77 2fff s TRP 648 Ca 0.39 1.23 0.06 0.00 0.02 0.00 0.00 56.10 57.80 2fff s TRP 648 Cb -0.03 -2.72 -0.04 0.00 -1.15 0.00 0.00 33.47 29.53 2fff s TRP 648 CO -0.05 0.20 -0.13 0.96 0.02 0.00 0.00 176.95 177.96 2fff s ILE 649 N 0.36 1.35 -1.19 2.03 -4.36 -0.41 -4.49 121.20 114.49 2fff s ILE 649 Ca 0.35 -1.90 0.00 0.00 -0.26 0.00 0.00 60.65 58.84 2fff s ILE 649 Cb -0.18 -1.70 0.00 0.00 1.25 0.00 0.00 42.46 41.83 2fff s ILE 649 CO 0.18 -0.54 0.00 0.61 0.24 0.00 0.00 174.94 175.43 2fff n GLY 650 N 0.18 -1.40 3.15 6.27 0.00 -1.02 -0.41 105.19 111.96 2fff n GLY 650 Ca -0.13 -0.99 -0.13 0.00 0.00 0.00 0.00 46.02 44.77 2fff n GLY 650 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2fff s LYS 651 N -1.23 0.39 0.24 1.61 2.47 -0.90 -4.52 119.74 117.80 2fff s LYS 651 Ca 0.00 0.13 0.04 0.00 -1.56 0.00 0.00 55.97 54.58 2fff s LYS 651 Cb 0.00 0.18 -0.03 0.00 -1.46 0.00 0.00 37.83 36.52 2fff s LYS 651 CO 0.00 -0.07 0.37 0.95 0.16 0.00 0.00 175.35 176.76 2fff s THR 652 N -0.38 5.25 -0.00 3.43 -4.23 -1.26 -1.23 115.64 117.22 2fff s THR 652 Ca -0.05 -0.83 -0.15 0.00 -1.18 0.00 0.00 61.69 59.48 2fff s THR 652 Cb -0.03 -3.83 0.02 0.00 1.34 0.00 0.00 72.50 70.00 2fff s THR 652 CO 0.01 -0.31 0.32 -0.83 -0.54 0.00 0.00 174.62 173.27 2fff s GLY 653 N -3.81 -0.15 -0.19 3.99 0.00 -0.54 -3.53 107.32 103.09 2fff s GLY 653 Ca 0.35 0.27 -0.07 0.00 0.00 0.00 0.00 44.72 45.27 2fff s GLY 653 CO 0.30 0.05 0.41 -0.51 0.00 0.00 0.00 173.10 173.35 2fff s THR 654 N -1.62 -0.59 0.77 0.90 -4.23 -1.26 -1.28 115.64 108.33 2fff s THR 654 Ca -0.11 0.17 -0.13 0.00 -1.18 0.00 0.00 61.69 60.44 2fff s THR 654 Cb -0.04 -0.64 0.06 0.00 1.34 0.00 0.00 72.50 73.22 2fff s THR 654 CO 0.03 0.07 1.15 -0.89 -0.54 0.00 0.00 174.62 174.43 2fff s THR 655 N 2.52 2.65 0.33 3.99 2.01 -0.54 -4.63 115.64 121.96 2fff s THR 655 Ca -0.02 0.26 0.08 0.00 0.31 0.00 0.00 61.69 62.32 2fff s THR 655 Cb -0.12 -2.66 0.40 0.00 0.01 0.00 0.00 72.50 70.13 2fff s THR 655 CO -0.12 -0.23 1.57 0.78 -0.69 0.00 0.00 174.62 175.93 2fff h ASN 656 N -0.84 -0.23 -0.49 3.53 2.35 -1.95 0.13 115.58 118.08 2fff h ASN 656 Ca -0.45 0.28 -0.06 0.00 -0.55 0.00 0.00 56.30 55.51 2fff h ASN 656 Cb 1.26 0.42 -0.04 0.00 0.05 0.00 0.00 38.32 40.02 2fff h ASN 656 CO 0.49 -0.39 0.06 1.67 -1.65 0.00 0.00 177.43 177.61 2fff n GLN 657 N -5.42 3.73 -2.68 0.81 -0.06 -1.26 -4.93 117.38 107.57 2fff n GLN 657 Ca 0.28 -3.04 -0.21 0.00 -2.00 0.00 0.00 57.00 52.03 2fff n GLN 657 Cb 0.94 -2.08 0.01 0.00 -4.06 0.00 0.00 30.24 25.05 2fff n GLN 657 CO 0.00 0.00 0.00 -0.25 -0.20 0.00 0.00 177.06 176.61 2fff n ASP 658 N -0.08 -5.95 0.09 1.69 8.00 0.46 -4.50 116.55 116.26 2fff n ASP 658 Ca 0.29 -0.13 0.12 0.00 0.71 0.00 0.00 54.79 55.78 2fff n ASP 658 Cb 1.13 -4.89 0.17 0.00 -0.02 0.00 0.00 41.12 37.52 2fff n ASP 658 CO 0.00 0.00 0.00 1.05 -0.39 0.00 0.00 177.20 177.86 2fff h GLU 659 N -0.61 0.00 -3.49 -1.24 9.09 -1.82 0.11 114.58 116.62 2fff h GLU 659 Ca -0.51 0.00 -0.31 0.00 0.05 0.00 0.00 59.36 58.59 2fff h GLU 659 Cb 1.36 0.00 -0.35 0.00 -1.65 0.00 0.00 28.75 28.11 2fff h GLU 659 CO 0.57 0.00 -0.73 -0.80 0.05 0.00 0.00 179.01 178.10 2fff s ASN 660 N -4.69 0.26 0.00 3.06 0.01 -1.26 -4.20 114.94 108.11 2fff s ASN 660 Ca 0.06 0.05 0.08 0.00 -0.71 0.00 0.00 52.86 52.34 2fff s ASN 660 Cb 0.12 -0.08 -0.02 0.00 0.41 0.00 0.00 41.25 41.67 2fff s ASN 660 CO 0.71 -0.15 -0.26 -0.04 -1.51 0.00 0.00 177.10 175.85 2fff s MET 661 N 1.26 2.01 0.04 -0.60 -1.94 -0.80 -1.47 119.30 117.80 2fff s MET 661 Ca -0.07 -0.99 0.05 0.00 -1.71 0.00 0.00 55.69 52.97 2fff s MET 661 Cb -0.13 -2.03 -0.02 0.00 2.01 0.00 0.00 34.83 34.66 2fff s MET 661 CO -0.03 0.54 -0.13 -1.58 -0.01 0.00 0.00 175.02 173.81 2fff s TRP 662 N -0.69 1.15 -0.08 -0.03 0.52 -0.40 -1.10 118.94 118.32 2fff s TRP 662 Ca 0.11 -0.36 -0.03 0.00 0.02 0.00 0.00 56.10 55.84 2fff s TRP 662 Cb -0.10 -0.68 0.04 0.00 -1.15 0.00 0.00 33.47 31.58 2fff s TRP 662 CO 0.00 0.03 0.15 -1.17 0.02 0.00 0.00 176.95 175.97 2fff s LEU 663 N -1.16 0.12 -0.13 2.99 2.96 -0.14 -1.46 118.68 121.86 2fff s LEU 663 Ca 0.01 0.30 -0.00 0.00 -0.22 0.00 0.00 54.13 54.21 2fff s LEU 663 Cb -0.08 0.25 -0.02 0.00 0.50 0.00 0.00 46.19 46.84 2fff s LEU 663 CO 0.01 -0.22 -0.12 -0.04 -1.32 0.00 0.00 176.35 174.66 2fff s MET 664 N 2.05 3.35 -0.03 1.98 -1.94 -0.37 -1.15 119.30 123.20 2fff s MET 664 Ca 0.01 -0.66 0.04 0.00 -1.71 0.00 0.00 55.69 53.36 2fff s MET 664 Cb -0.12 -2.65 -0.00 0.00 2.01 0.00 0.00 34.83 34.07 2fff s MET 664 CO -0.05 0.25 -0.13 -0.51 -0.01 0.00 0.00 175.02 174.57 2fff s LEU 665 N 0.26 1.90 -0.01 -0.03 1.43 -0.58 -2.12 118.68 119.53 2fff s LEU 665 Ca -0.08 -0.25 0.02 0.00 -1.03 0.00 0.00 54.13 52.79 2fff s LEU 665 Cb -0.15 -0.71 -0.00 0.00 0.03 0.00 0.00 46.19 45.35 2fff s LEU 665 CO 0.05 0.12 -0.07 -0.44 0.23 0.00 0.00 176.35 176.24 2fff s SER 666 N -0.02 0.86 0.41 2.29 0.01 0.45 -0.21 113.70 117.49 2fff s SER 666 Ca -0.00 -0.13 0.08 0.00 1.31 0.00 0.00 55.95 57.20 2fff s SER 666 Cb -0.08 -0.13 -0.02 0.00 0.21 0.00 0.00 66.02 66.00 2fff s SER 666 CO 0.01 0.08 0.38 0.42 0.41 0.00 0.00 173.24 174.53 2fff s THR 667 N -0.07 2.73 0.39 1.44 -4.23 -0.05 -1.29 115.64 114.56 2fff s THR 667 Ca 0.01 -1.33 0.19 0.00 -1.18 0.00 0.00 61.69 59.38 2fff s THR 667 Cb -0.04 -3.01 0.39 0.00 1.34 0.00 0.00 72.50 71.18 2fff s THR 667 CO -0.00 -0.01 1.74 -0.65 -0.54 0.00 0.00 174.62 175.16 2fff h PRO 668 N 1.02 0.36 0.16 3.99 0.11 -1.81 -3.06 132.00 132.77 2fff h PRO 668 Ca -0.42 -0.02 -0.30 0.00 0.11 0.00 0.00 66.00 65.38 2fff h PRO 668 Cb 1.27 -0.08 0.01 0.00 0.11 0.00 0.00 31.00 32.30 2fff h PRO 668 CO 0.57 0.24 -1.46 0.00 -0.21 0.00 0.00 178.00 177.14 2fff h ARG 669 N 0.37 0.34 -5.19 1.05 3.08 -1.91 -3.44 114.38 108.68 2fff h ARG 669 Ca 0.64 -0.57 -0.41 0.00 0.07 0.00 0.00 59.98 59.70 2fff h ARG 669 Cb 1.61 0.21 -0.23 0.00 0.08 0.00 0.00 29.97 31.64 2fff h ARG 669 CO -0.35 1.27 -0.78 -0.51 -1.07 0.00 0.00 179.97 178.53 2fff s LEU 670 N -7.52 2.21 -0.08 3.04 1.43 -1.16 -0.40 118.68 116.21 2fff s LEU 670 Ca -0.17 -0.50 0.03 0.00 -1.03 0.00 0.00 54.13 52.47 2fff s LEU 670 Cb 0.04 -0.51 -0.02 0.00 0.03 0.00 0.00 46.19 45.74 2fff s LEU 670 CO 0.82 -0.03 -0.17 -0.89 0.23 0.00 0.00 176.35 176.31 2fff s THR 671 N -1.01 2.76 -0.24 5.49 2.01 -0.29 -0.87 115.64 123.50 2fff s THR 671 Ca -0.01 -0.81 0.02 0.00 0.31 0.00 0.00 61.69 61.20 2fff s THR 671 Cb -0.08 -2.09 0.06 0.00 0.01 0.00 0.00 72.50 70.40 2fff s THR 671 CO 0.01 0.57 -0.09 -0.22 -0.69 0.00 0.00 174.62 174.20 2fff s LEU 672 N -0.24 2.85 0.20 4.42 2.96 0.70 0.14 118.68 129.71 2fff s LEU 672 Ca 0.00 -1.20 -0.21 0.00 -0.22 0.00 0.00 54.13 52.51 2fff s LEU 672 Cb -0.13 -1.34 -0.08 0.00 0.50 0.00 0.00 46.19 45.14 2fff s LEU 672 CO 0.03 -0.20 0.72 -0.83 -1.32 0.00 0.00 176.35 174.75 2fff s GLY 673 N 1.28 2.67 -0.03 7.98 0.00 -0.49 -1.52 107.32 117.21 2fff s GLY 673 Ca -0.06 0.18 0.00 0.00 0.00 0.00 0.00 44.72 44.85 2fff s GLY 673 CO -0.06 0.57 0.01 -0.32 0.00 0.00 0.00 173.10 173.30 2fff s GLY 674 N -1.51 0.19 -0.03 0.20 0.00 -0.30 -2.36 107.32 103.51 2fff s GLY 674 Ca 0.40 0.22 0.07 0.00 0.00 0.00 0.00 44.72 45.41 2fff s GLY 674 CO 0.22 0.62 -0.23 0.86 0.00 0.00 0.00 173.10 174.57 2fff s TRP 675 N 1.02 2.07 0.14 1.90 -0.00 -0.38 -0.97 118.94 122.71 2fff s TRP 675 Ca -0.10 -0.44 0.07 0.00 -0.00 0.00 0.00 56.10 55.63 2fff s TRP 675 Cb -0.13 -1.34 -0.04 0.00 -0.00 0.00 0.00 33.47 31.96 2fff s TRP 675 CO -0.02 -0.07 -0.16 0.96 -0.00 0.00 0.00 176.95 177.66 2fff s ILE 676 N -0.43 1.52 -2.82 5.86 -4.36 -0.25 -1.25 121.20 119.46 2fff s ILE 676 Ca 0.06 -1.79 0.00 0.00 -0.26 0.00 0.00 60.65 58.66 2fff s ILE 676 Cb -0.10 -1.65 0.00 0.00 1.25 0.00 0.00 42.46 41.96 2fff s ILE 676 CO 0.00 -0.37 0.00 0.61 0.24 0.00 0.00 174.94 175.42 2fff n GLY 677 N 0.46 -1.34 3.29 6.27 0.00 -0.82 -1.91 105.19 111.13 2fff n GLY 677 Ca -0.15 -1.04 -0.28 0.00 0.00 0.00 0.00 46.02 44.55 2fff n GLY 677 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2fff s HIS 678 N -2.99 2.04 0.40 1.61 3.76 -1.26 -0.28 115.29 118.57 2fff s HIS 678 Ca 0.00 -0.39 0.07 0.00 -0.15 0.00 0.00 55.06 54.59 2fff s HIS 678 Cb 0.00 -1.23 0.81 0.00 1.11 0.00 0.00 32.58 33.27 2fff s HIS 678 CO 0.00 0.09 2.02 -0.44 -0.85 0.00 0.00 174.74 175.56 2fff h ASP 679 N 4.91 0.45 -0.19 1.40 3.32 -1.96 -1.30 116.42 123.05 2fff h ASP 679 Ca -0.44 -0.03 0.00 0.00 0.02 0.00 0.00 57.03 56.58 2fff h ASP 679 Cb 1.15 -0.11 0.00 0.00 0.22 0.00 0.00 39.33 40.59 2fff h ASP 679 CO 0.44 0.38 0.00 -0.90 -1.72 0.00 0.00 179.24 177.44 2fff n ASP 680 N -4.43 1.67 -0.34 6.45 3.85 -1.26 -4.95 116.55 117.55 2fff n ASP 680 Ca 0.02 -1.75 -0.04 0.00 -0.71 0.00 0.00 54.79 52.31 2fff n ASP 680 Cb 0.11 -0.13 -0.02 0.00 -1.35 0.00 0.00 41.12 39.73 2fff n ASP 680 CO 0.00 0.00 0.00 -3.20 -1.01 0.00 0.00 177.20 172.99 2fff n ASN 681 N 0.34 -3.70 -4.75 -1.12 5.15 -0.49 -4.99 115.26 105.69 2fff n ASN 681 Ca 0.15 0.11 -0.37 0.00 -0.60 0.00 0.00 54.58 53.87 2fff n ASN 681 Cb 0.32 -1.59 0.04 0.00 -0.53 0.00 0.00 39.78 38.02 2fff n ASN 681 CO 0.00 0.00 0.00 -1.00 1.40 0.00 0.00 177.26 177.66 2fff s HIS 682 N -2.11 2.30 0.27 1.20 3.76 -1.26 -4.84 115.29 114.61 2fff s HIS 682 Ca 0.00 1.46 -0.30 0.00 -0.15 0.00 0.00 55.06 56.07 2fff s HIS 682 Cb 0.00 -3.65 -0.10 0.00 1.11 0.00 0.00 32.58 29.93 2fff s HIS 682 CO 0.00 -2.61 1.46 -1.12 -0.85 0.00 0.00 174.74 171.62 2fff s SER 683 N -1.28 6.60 0.80 1.40 0.01 -1.26 -4.55 113.70 115.42 2fff s SER 683 Ca 0.76 2.74 -0.10 0.00 1.31 0.00 0.00 55.95 60.65 2fff s SER 683 Cb -0.36 -2.63 0.10 0.00 0.21 0.00 0.00 66.02 63.34 2fff s SER 683 CO 0.40 -0.74 1.14 -0.76 0.41 0.00 0.00 173.24 173.70 2fff s LEU 684 N -0.60 2.70 0.75 2.44 1.43 0.37 -4.89 118.68 120.88 2fff s LEU 684 Ca 0.59 0.47 -0.11 0.00 -1.03 0.00 0.00 54.13 54.04 2fff s LEU 684 Cb -0.43 -2.90 0.04 0.00 0.03 0.00 0.00 46.19 42.93 2fff s LEU 684 CO 0.46 -1.98 1.09 -0.94 0.23 0.00 0.00 176.35 175.21 2fff s SER 685 N -4.64 4.69 0.39 2.29 1.04 -1.26 -4.84 113.70 111.36 2fff s SER 685 Ca 0.64 1.82 0.16 0.00 0.48 0.00 0.00 55.95 59.06 2fff s SER 685 Cb -0.09 -2.52 0.79 0.00 0.10 0.00 0.00 66.02 64.30 2fff s SER 685 CO 0.48 -1.91 1.82 -0.09 0.98 0.00 0.00 173.24 174.53 2fff h ARG 686 N -0.92 0.00 -0.42 4.02 2.43 -1.98 -1.31 114.38 116.20 2fff h ARG 686 Ca -0.44 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.73 2fff h ARG 686 Cb 1.23 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.78 2fff h ARG 686 CO 0.52 0.35 0.00 2.89 -1.51 0.00 0.00 179.97 182.23 2fff n ARG 687 N -3.87 2.04 -0.27 0.20 1.85 -1.26 -4.57 116.66 110.77 2fff n ARG 687 Ca -0.01 -1.61 0.01 0.00 -1.00 0.00 0.00 57.85 55.23 2fff n ARG 687 Cb 0.42 -1.36 0.22 0.00 -1.05 0.00 0.00 32.46 30.68 2fff n ARG 687 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 2fff h ALA 688 N 3.88 1.44 0.12 2.89 0.00 -1.60 -0.44 119.26 125.55 2fff h ALA 688 Ca 0.00 -0.05 -0.32 0.00 0.00 0.00 0.00 54.91 54.54 2fff h ALA 688 Cb 0.61 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 2fff h ALA 688 CO 0.00 0.50 -1.70 0.78 0.00 0.00 0.00 179.25 178.83 2fff h GLY 689 N 1.10 0.29 0.72 0.00 0.00 -1.81 0.56 103.07 103.92 2fff h GLY 689 Ca 0.32 -0.73 0.06 0.00 0.00 0.00 0.00 47.33 46.98 2fff h GLY 689 CO -0.08 0.64 0.47 -1.82 0.00 0.00 0.00 176.54 175.75 2fff h TYR 690 N -0.16 0.87 0.00 5.60 3.20 -1.71 -3.29 116.97 121.49 2fff h TYR 690 Ca -0.37 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.53 2fff h TYR 690 Cb 1.88 -0.28 0.00 0.00 1.54 0.00 0.00 36.73 39.87 2fff h TYR 690 CO 0.10 0.44 -0.26 0.45 -1.64 0.00 0.00 178.16 177.25 2fff n SER 691 N -4.68 1.20 0.05 -2.11 2.88 -0.19 -1.42 113.62 109.35 2fff n SER 691 Ca 0.11 0.17 -0.13 0.00 -1.33 0.00 0.00 58.87 57.69 2fff n SER 691 Cb 0.17 -0.42 -0.09 0.00 -0.75 0.00 0.00 64.21 63.12 2fff n SER 691 CO 0.00 0.00 0.00 0.78 -1.23 0.00 0.00 175.04 174.59 2fff h ASN 692 N -0.26 -0.13 -0.74 -3.46 4.21 -1.41 0.15 115.58 113.93 2fff h ASN 692 Ca 0.00 -0.32 -0.03 0.00 1.21 0.00 0.00 56.30 57.16 2fff h ASN 692 Cb 0.26 0.03 -0.03 0.00 -1.12 0.00 0.00 38.32 37.46 2fff h ASN 692 CO 0.00 0.27 0.34 -1.13 -1.29 0.00 0.00 177.43 175.62 2fff h ASN 693 N -0.55 0.99 -0.34 5.81 -1.24 -1.07 0.11 115.58 119.29 2fff h ASN 693 Ca -0.02 -0.12 0.00 0.00 0.71 0.00 0.00 56.30 56.87 2fff h ASN 693 Cb 0.44 -0.25 -0.02 0.00 0.73 0.00 0.00 38.32 39.22 2fff h ASN 693 CO 0.03 0.85 0.22 0.28 -1.29 0.00 0.00 177.43 177.52 2fff h SER 694 N 1.08 0.39 0.06 1.15 0.02 -1.58 0.10 113.55 114.77 2fff h SER 694 Ca 0.26 -0.02 -0.00 0.00 -0.84 0.00 0.00 61.79 61.19 2fff h SER 694 Cb 0.14 -0.10 0.00 0.00 0.14 0.00 0.00 62.40 62.58 2fff h SER 694 CO -0.03 0.29 -0.03 -1.13 -1.14 0.00 0.00 176.83 174.79 2fff h ASN 695 N 0.45 -0.07 -0.57 3.07 -1.24 -0.44 -1.91 115.58 114.88 2fff h ASN 695 Ca 0.12 -0.39 0.12 0.00 0.71 0.00 0.00 56.30 56.86 2fff h ASN 695 Cb -0.04 0.02 -0.10 0.00 0.73 0.00 0.00 38.32 38.93 2fff h ASN 695 CO -0.03 0.37 -0.02 0.22 -1.29 0.00 0.00 177.43 176.68 2fff h TYR 696 N -0.52 -0.08 -0.16 0.67 3.20 -0.74 -2.22 116.97 117.12 2fff h TYR 696 Ca -0.01 0.04 -0.12 0.00 3.14 0.00 0.00 58.73 61.79 2fff h TYR 696 Cb 0.45 0.12 -0.01 0.00 1.54 0.00 0.00 36.73 38.83 2fff h TYR 696 CO 0.07 -0.16 -0.41 0.52 -1.64 0.00 0.00 178.16 176.54 2fff h MET 697 N 0.10 0.36 -0.91 1.82 2.86 -0.72 -0.81 114.93 117.62 2fff h MET 697 Ca 0.29 -0.18 0.05 0.00 -2.06 0.00 0.00 59.70 57.81 2fff h MET 697 Cb 0.46 -0.00 -0.06 0.00 0.06 0.00 0.00 31.60 32.06 2fff h MET 697 CO -0.50 0.71 0.60 0.00 1.06 0.00 0.00 176.91 178.78 2fff h ALA 698 N 1.27 1.47 -0.55 6.32 0.00 -0.88 0.35 119.26 127.23 2fff h ALA 698 Ca 0.03 -0.03 -0.07 0.00 0.00 0.00 0.00 54.91 54.84 2fff h ALA 698 Cb 0.85 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 18.33 2fff h ALA 698 CO 0.07 0.42 0.08 0.45 0.00 0.00 0.00 179.25 180.27 2fff h HIS 699 N 1.09 0.99 -0.30 0.00 -0.00 -0.81 -2.06 115.15 114.06 2fff h HIS 699 Ca 0.38 -0.14 -0.02 0.00 -0.00 0.00 0.00 60.37 60.59 2fff h HIS 699 Cb 0.12 -0.27 -0.01 0.00 -0.00 0.00 0.00 27.41 27.25 2fff h HIS 699 CO -0.00 0.87 0.10 1.25 -0.00 0.00 0.00 177.93 180.15 2fff h LEU 700 N 0.81 0.42 -0.70 2.43 5.85 -0.35 -1.29 115.31 122.49 2fff h LEU 700 Ca 0.17 -0.19 0.09 0.00 0.84 0.00 0.00 57.88 58.78 2fff h LEU 700 Cb 0.43 -0.11 -0.07 0.00 0.37 0.00 0.00 40.66 41.28 2fff h LEU 700 CO 0.01 0.50 0.35 0.58 -0.34 0.00 0.00 178.44 179.55 2fff h VAL 701 N 0.32 0.86 -0.40 1.05 2.07 -0.27 -1.58 116.25 118.30 2fff h VAL 701 Ca 0.10 -0.21 -0.15 0.00 0.82 0.00 0.00 66.70 67.26 2fff h VAL 701 Cb 0.23 0.20 -0.01 0.00 -1.52 0.00 0.00 31.29 30.19 2fff h VAL 701 CO -0.00 0.11 -0.35 -1.13 0.02 0.00 0.00 177.57 176.22 2fff h ASN 702 N 0.61 1.00 -0.50 0.57 -1.24 -1.13 -2.37 115.58 112.52 2fff h ASN 702 Ca 0.34 -0.45 -0.02 0.00 0.71 0.00 0.00 56.30 56.88 2fff h ASN 702 Cb 0.35 -0.28 -0.02 0.00 0.73 0.00 0.00 38.32 39.09 2fff h ASN 702 CO -0.26 1.24 0.23 0.00 -1.29 0.00 0.00 177.43 177.35 2fff h ALA 703 N 0.79 0.65 -0.60 1.57 0.00 -0.94 -0.10 119.26 120.63 2fff h ALA 703 Ca 0.07 -0.13 0.07 0.00 0.00 0.00 0.00 54.91 54.92 2fff h ALA 703 Cb 0.94 -0.20 -0.06 0.00 0.00 0.00 0.00 17.79 18.47 2fff h ALA 703 CO 0.09 0.23 0.28 0.82 0.00 0.00 0.00 179.25 180.66 2fff h ILE 704 N 0.66 0.88 -0.46 0.00 2.04 -1.26 -1.90 117.51 117.48 2fff h ILE 704 Ca 0.17 -0.18 -0.12 0.00 1.00 0.00 0.00 64.86 65.73 2fff h ILE 704 Cb 0.15 0.32 -0.01 0.00 -0.74 0.00 0.00 36.82 36.53 2fff h ILE 704 CO -0.02 0.09 -0.20 -0.61 0.00 0.00 0.00 178.15 177.41 2fff h GLN 705 N 0.51 0.93 0.00 2.37 -0.00 -0.85 -2.11 115.11 115.95 2fff h GLN 705 Ca 0.28 -0.38 -0.05 0.00 -0.00 0.00 0.00 58.65 58.51 2fff h GLN 705 Cb 0.26 -0.04 -0.01 0.00 0.00 0.00 0.00 27.48 27.70 2fff h GLN 705 CO -0.23 1.04 -0.22 1.96 0.00 0.00 0.00 178.83 181.38 2fff h GLN 706 N 0.80 0.00 0.00 1.69 1.08 -0.82 -0.50 115.11 117.37 2fff h GLN 706 Ca 0.11 0.00 -0.02 0.00 -1.45 0.00 0.00 58.65 57.29 2fff h GLN 706 Cb 0.76 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 28.19 2fff h GLN 706 CO 0.06 0.22 -0.09 0.00 -0.95 0.00 0.00 178.83 178.06 2fff h ALA 707 N 1.78 0.94 -0.62 3.87 0.00 -1.00 -3.41 119.26 120.83 2fff h ALA 707 Ca -0.00 -0.08 -0.18 0.00 0.00 0.00 0.00 54.91 54.64 2fff h ALA 707 Cb 0.45 -0.01 -0.16 0.00 0.00 0.00 0.00 17.79 18.07 2fff h ALA 707 CO 0.03 0.12 -0.50 0.45 0.00 0.00 0.00 179.25 179.35 2fff n SER 708 N -3.13 -3.20 -0.29 0.00 2.88 -0.83 -4.68 113.62 104.38 2fff n SER 708 Ca 0.04 -3.07 0.10 0.00 -1.33 0.00 0.00 58.87 54.60 2fff n SER 708 Cb 0.56 1.76 0.23 0.00 -0.75 0.00 0.00 64.21 66.01 2fff n SER 708 CO 0.00 0.00 0.00 -0.65 -1.23 0.00 0.00 175.04 173.16 2fff h PRO 709 N 4.60 0.11 -0.00 -1.46 0.11 -1.35 -1.54 132.00 132.46 2fff h PRO 709 Ca -0.02 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.08 2fff h PRO 709 Cb 1.07 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.16 2fff h PRO 709 CO 0.14 0.07 0.00 -1.13 -0.21 0.00 0.00 178.00 176.87 2fff n SER 710 N -5.35 0.04 0.10 -2.05 3.41 -1.26 -4.55 113.62 103.96 2fff n SER 710 Ca 0.18 -1.15 -0.05 0.00 -0.26 0.00 0.00 58.87 57.59 2fff n SER 710 Cb 0.61 -0.00 0.06 0.00 -0.26 0.00 0.00 64.21 64.62 2fff n SER 710 CO 0.00 0.00 0.00 -0.29 -0.16 0.00 0.00 175.04 174.59 2fff h ILE 711 N 0.06 1.48 -0.05 -1.33 6.09 -1.62 -2.72 117.51 119.43 2fff h ILE 711 Ca 0.00 -2.42 -0.19 0.00 -1.37 0.00 0.00 64.86 60.88 2fff h ILE 711 Cb 0.01 2.31 -0.00 0.00 0.47 0.00 0.00 36.82 39.61 2fff h ILE 711 CO 0.00 0.70 -0.78 -0.50 -3.07 0.00 0.00 178.15 174.50 2fff h TRP 712 N 0.08 0.53 0.00 2.19 4.06 -1.81 -3.44 115.95 117.56 2fff h TRP 712 Ca -0.02 -0.25 0.00 0.00 2.06 0.00 0.00 58.89 60.68 2fff h TRP 712 Cb 1.32 -0.08 0.00 0.00 -1.00 0.00 0.00 29.16 29.41 2fff h TRP 712 CO 0.02 1.02 0.00 0.41 -3.56 0.00 0.00 178.44 176.33 2fff n GLY 713 N 0.66 0.44 0.91 1.49 0.00 -1.03 -4.29 105.19 103.38 2fff n GLY 713 Ca -0.05 -1.70 0.09 0.00 0.00 0.00 0.00 46.02 44.36 2fff n GLY 713 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2fff n ASN 714 N -0.69 3.12 -4.76 1.61 3.02 -1.26 -4.71 115.26 111.59 2fff n ASN 714 Ca 0.00 -1.90 -0.35 0.00 -0.03 0.00 0.00 54.58 52.30 2fff n ASN 714 Cb 0.00 -0.23 0.04 0.00 -0.61 0.00 0.00 39.78 38.98 2fff n ASN 714 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 2fff s GLU 715 N -1.19 2.89 0.06 3.52 8.01 -1.26 -4.92 118.70 125.81 2fff s GLU 715 Ca 0.31 1.68 0.07 0.00 0.01 0.00 0.00 54.97 57.04 2fff s GLU 715 Cb 0.18 -1.94 -0.03 0.00 -4.31 0.00 0.00 34.13 28.03 2fff s GLU 715 CO 0.24 -1.23 -0.15 1.03 0.01 0.00 0.00 175.26 175.16 2fff s ARG 716 N -3.57 2.11 0.46 1.61 0.52 -1.26 -4.34 118.95 114.48 2fff s ARG 716 Ca 0.74 -0.98 -0.23 0.00 -0.52 0.00 0.00 55.73 54.74 2fff s ARG 716 Cb -0.27 -2.24 -0.07 0.00 0.52 0.00 0.00 34.95 32.89 2fff s ARG 716 CO 0.35 0.54 1.17 -0.06 0.02 0.00 0.00 175.30 177.32 2fff s PHE 717 N -1.01 2.86 -0.04 -0.53 0.08 -1.26 -5.00 117.98 113.08 2fff s PHE 717 Ca 0.16 1.53 -0.18 0.00 0.12 0.00 0.00 56.93 58.57 2fff s PHE 717 Cb -0.11 -3.40 0.03 0.00 -0.57 0.00 0.00 43.02 38.98 2fff s PHE 717 CO 0.07 -1.56 0.39 0.00 -0.10 0.00 0.00 175.22 174.03 2fff s ALA 718 N -1.53 -1.00 0.23 5.36 0.00 -1.26 -5.05 121.76 118.51 2fff s ALA 718 Ca 0.64 0.63 -0.32 0.00 0.00 0.00 0.00 51.96 52.92 2fff s ALA 718 Cb -0.29 -0.06 -0.14 0.00 0.00 0.00 0.00 23.12 22.64 2fff s ALA 718 CO 0.35 -0.27 1.42 1.28 0.00 0.00 0.00 175.76 178.54 2fff n LEU 719 N 1.46 3.04 -4.77 0.00 4.32 -1.26 -4.84 117.00 114.95 2fff n LEU 719 Ca -0.20 1.14 -0.38 0.00 -0.02 0.00 0.00 56.01 56.55 2fff n LEU 719 Cb 0.56 -1.42 -0.03 0.00 -1.62 0.00 0.00 43.42 40.92 2fff n LEU 719 CO 0.21 -0.50 0.81 -0.62 -1.22 0.00 0.00 177.39 176.07 2fff s ASP 720 N 0.35 6.62 0.64 -1.43 2.15 -1.26 -4.92 116.67 118.83 2fff s ASP 720 Ca 0.70 2.25 0.42 0.00 0.43 0.00 0.00 52.55 56.35 2fff s ASP 720 Cb -0.66 -2.61 2.16 0.00 -0.30 0.00 0.00 42.92 41.51 2fff s ASP 720 CO 0.48 -0.60 2.28 -0.65 -0.17 0.00 0.00 175.17 176.51 2fff h PRO 721 N 2.66 0.00 0.00 4.34 0.11 -1.96 -1.36 132.00 135.79 2fff h PRO 721 Ca -0.48 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.63 2fff h PRO 721 Cb 1.23 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.34 2fff h PRO 721 CO 0.63 0.00 0.00 -1.13 -0.21 0.00 0.00 178.00 177.29 2fff n SER 722 N -3.09 0.63 -4.74 -2.05 3.41 -1.26 -4.79 113.62 101.73 2fff n SER 722 Ca -0.02 0.72 -0.42 0.00 -0.26 0.00 0.00 58.87 58.90 2fff n SER 722 Cb 0.13 -0.83 -0.02 0.00 -0.26 0.00 0.00 64.21 63.23 2fff n SER 722 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 2fff s VAL 723 N -3.46 2.38 -0.17 -3.33 1.01 -0.51 -4.92 120.40 111.40 2fff s VAL 723 Ca 0.00 0.30 -0.11 0.00 0.00 0.00 0.00 61.98 62.18 2fff s VAL 723 Cb 0.08 -3.19 -0.05 0.00 0.00 0.00 0.00 36.38 33.22 2fff s VAL 723 CO 0.29 0.04 0.19 -0.69 0.00 0.00 0.00 175.10 174.93 2fff s VAL 724 N 0.43 5.38 -0.19 2.92 1.01 -0.88 -4.94 120.40 124.13 2fff s VAL 724 Ca 0.65 0.32 -0.06 0.00 0.00 0.00 0.00 61.98 62.89 2fff s VAL 724 Cb -0.45 -3.51 -0.03 0.00 0.00 0.00 0.00 36.38 32.38 2fff s VAL 724 CO 0.40 0.46 0.03 -0.54 0.00 0.00 0.00 175.10 175.45 2fff s LYS 725 N 0.11 3.77 -0.08 2.72 1.02 -1.26 -0.61 119.74 125.42 2fff s LYS 725 Ca 0.12 -0.45 0.02 0.00 0.02 0.00 0.00 55.97 55.68 2fff s LYS 725 Cb -0.12 -3.13 0.01 0.00 -0.52 0.00 0.00 37.83 34.08 2fff s LYS 725 CO 0.01 0.13 -0.13 -1.12 -0.92 0.00 0.00 175.35 173.32 2fff s SER 726 N 0.71 2.06 -0.20 2.83 0.01 -0.34 -4.95 113.70 113.81 2fff s SER 726 Ca 0.01 -0.35 -0.29 0.00 1.31 0.00 0.00 55.95 56.63 2fff s SER 726 Cb -0.14 -0.93 0.00 0.00 0.21 0.00 0.00 66.02 65.16 2fff s SER 726 CO 0.02 0.03 1.10 -0.70 0.41 0.00 0.00 173.24 174.09 2fff s GLU 727 N 0.79 4.27 0.11 12.44 2.12 -1.26 0.43 118.70 137.61 2fff s GLU 727 Ca -0.12 1.45 0.06 0.00 0.36 0.00 0.00 54.97 56.72 2fff s GLU 727 Cb -0.16 -3.66 -0.04 0.00 0.26 0.00 0.00 34.13 30.54 2fff s GLU 727 CO 0.02 -0.62 -0.15 0.14 -0.54 0.00 0.00 175.26 174.11 2fff s VAL 728 N 3.15 1.35 0.20 3.70 -7.23 0.40 -4.49 120.40 117.48 2fff s VAL 728 Ca 0.47 -1.65 -0.32 0.00 -1.81 0.00 0.00 61.98 58.68 2fff s VAL 728 Cb -0.17 -1.48 -0.12 0.00 0.56 0.00 0.00 36.38 35.18 2fff s VAL 728 CO 0.09 -0.35 1.69 -0.76 -0.31 0.00 0.00 175.10 175.46 2fff s LEU 729 N -2.31 4.37 0.34 1.32 1.43 0.37 0.02 118.68 124.21 2fff s LEU 729 Ca 0.07 2.82 0.04 0.00 -1.03 0.00 0.00 54.13 56.03 2fff s LEU 729 Cb -0.06 -3.60 0.66 0.00 0.03 0.00 0.00 46.19 43.22 2fff s LEU 729 CO 0.03 -0.94 1.93 0.11 0.23 0.00 0.00 176.35 177.71 2fff h LYS 730 N 6.77 0.84 -0.29 1.70 1.57 -1.54 0.31 116.57 125.92 2fff h LYS 730 Ca -0.43 -0.05 -0.14 0.00 -1.87 0.00 0.00 60.65 58.16 2fff h LYS 730 Cb 1.20 -0.19 -0.01 0.00 0.08 0.00 0.00 32.23 33.31 2fff h LYS 730 CO 0.95 0.56 -0.37 0.66 -0.57 0.00 0.00 179.45 180.67 2fff h SER 731 N 0.86 0.70 0.00 0.86 4.64 -1.91 -3.32 113.55 115.38 2fff h SER 731 Ca 0.35 -0.30 0.00 0.00 -0.47 0.00 0.00 61.79 61.37 2fff h SER 731 Cb 0.26 -0.20 0.00 0.00 -0.31 0.00 0.00 62.40 62.16 2fff h SER 731 CO -0.13 1.00 -1.49 0.35 -0.87 0.00 0.00 176.83 175.69 2fff n THR 732 N -4.05 0.00 -0.99 2.95 -2.24 -1.16 -5.00 114.28 103.79 2fff n THR 732 Ca -0.02 -0.27 0.00 0.00 -2.27 0.00 0.00 64.05 61.49 2fff n THR 732 Cb 0.51 0.27 0.00 0.00 -2.10 0.00 0.00 70.33 69.01 2fff n THR 732 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2fff n GLY 733 N 1.80 0.37 3.37 3.38 0.00 0.11 -4.34 105.19 109.87 2fff n GLY 733 Ca -0.02 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.81 2fff n GLY 733 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2fff s GLN 734 N -0.55 1.42 0.54 1.61 -0.21 -1.24 -4.62 119.66 116.61 2fff s GLN 734 Ca 0.00 -1.72 -0.20 0.00 0.02 0.00 0.00 55.36 53.45 2fff s GLN 734 Cb 0.00 -0.79 -0.05 0.00 1.00 0.00 0.00 33.01 33.17 2fff s GLN 734 CO 0.00 -0.07 1.22 0.15 -2.12 0.00 0.00 175.29 174.47 2fff s LYS 735 N -3.83 3.25 0.32 2.91 1.02 -0.40 -0.48 119.74 122.53 2fff s LYS 735 Ca 0.29 1.87 -0.29 0.00 0.02 0.00 0.00 55.97 57.86 2fff s LYS 735 Cb 0.05 -2.13 -0.12 0.00 -0.52 0.00 0.00 37.83 35.11 2fff s LYS 735 CO 0.10 -0.99 1.34 -2.30 -0.92 0.00 0.00 175.35 172.58 2fff n PRO 736 N -1.16 2.18 -3.81 -1.68 -0.02 -1.26 -1.29 135.00 127.96 2fff n PRO 736 Ca 0.11 0.77 0.04 0.00 -2.02 0.00 0.00 63.50 62.39 2fff n PRO 736 Cb 0.48 -2.38 0.01 0.00 -0.02 0.00 0.00 33.50 31.59 2fff n PRO 736 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 2fff s GLY 737 N -0.13 -0.32 0.22 -1.23 0.00 -1.15 -4.73 107.32 99.98 2fff s GLY 737 Ca 0.58 0.48 -0.09 0.00 0.00 0.00 0.00 44.72 45.69 2fff s GLY 737 CO 0.59 3.44 0.54 -1.59 0.00 0.00 0.00 173.10 176.08 2fff s LYS 738 N -2.07 3.79 -0.06 2.90 -2.85 -1.26 -0.59 119.74 119.60 2fff s LYS 738 Ca 0.23 0.25 -0.13 0.00 -1.00 0.00 0.00 55.97 55.33 2fff s LYS 738 Cb 0.03 -2.66 0.02 0.00 -2.06 0.00 0.00 37.83 33.17 2fff s LYS 738 CO -0.04 0.33 0.30 0.08 0.10 0.00 0.00 175.35 176.12 2fff s VAL 739 N -1.81 0.03 -0.18 1.79 1.01 0.14 -4.90 120.40 116.48 2fff s VAL 739 Ca 0.47 -0.28 -0.20 0.00 0.00 0.00 0.00 61.98 61.97 2fff s VAL 739 Cb -0.11 -0.53 -0.03 0.00 0.00 0.00 0.00 36.38 35.71 2fff s VAL 739 CO 0.21 -0.15 0.60 -0.55 0.00 0.00 0.00 175.10 175.21 2fff s SER 740 N -0.66 6.67 -0.30 3.32 0.15 -1.26 0.40 113.70 122.01 2fff s SER 740 Ca -0.08 0.82 0.02 0.00 0.70 0.00 0.00 55.95 57.41 2fff s SER 740 Cb -0.04 -2.33 0.09 0.00 -1.71 0.00 0.00 66.02 62.02 2fff s SER 740 CO 0.02 -0.22 0.03 -0.69 1.20 0.00 0.00 173.24 173.58 2fff s VAL 741 N 1.68 1.74 -0.57 4.45 1.01 -1.02 -4.82 120.40 122.87 2fff s VAL 741 Ca 0.28 -1.79 -0.14 0.00 0.00 0.00 0.00 61.98 60.33 2fff s VAL 741 Cb -0.16 -2.19 0.02 0.00 0.00 0.00 0.00 36.38 34.05 2fff s VAL 741 CO 0.11 -0.46 0.53 -1.84 0.00 0.00 0.00 175.10 173.44 2fff n GLU 742 N 4.51 -1.44 -0.93 2.72 0.28 -1.26 -4.49 120.64 120.04 2fff n GLU 742 Ca -0.03 0.86 0.12 0.00 -0.16 0.00 0.00 57.16 57.95 2fff n GLU 742 Cb 0.42 -1.79 -0.04 0.00 1.43 0.00 0.00 31.44 31.46 2fff n GLU 742 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 2fff n GLY 743 N -0.94 -2.08 1.95 -1.84 0.00 -1.26 -5.05 105.19 95.98 2fff n GLY 743 Ca -0.20 -1.27 0.00 0.00 0.00 0.00 0.00 46.02 44.56 2fff n GLY 743 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2fff n LYS 744 N -3.40 -4.91 -2.14 1.61 4.81 -1.26 -4.88 118.16 107.98 2fff n LYS 744 Ca -0.01 3.55 -0.42 0.00 -0.87 0.00 0.00 58.31 60.56 2fff n LYS 744 Cb 0.43 -3.89 -0.03 0.00 0.02 0.00 0.00 35.03 31.56 2fff n LYS 744 CO 0.00 0.00 0.00 -2.00 1.17 0.00 0.00 177.40 176.57 2fff s GLU 745 N -0.88 4.32 -0.13 1.64 2.12 -1.26 -2.43 118.70 122.08 2fff s GLU 745 Ca 0.00 2.13 -0.01 0.00 0.36 0.00 0.00 54.97 57.45 2fff s GLU 745 Cb 0.00 -3.21 -0.02 0.00 0.26 0.00 0.00 34.13 31.16 2fff s GLU 745 CO 0.00 -0.41 -0.11 0.08 -0.54 0.00 0.00 175.26 174.28 2fff s VAL 746 N 0.77 3.23 -0.51 3.70 1.01 0.16 -4.94 120.40 123.83 2fff s VAL 746 Ca 0.63 -0.60 -0.25 0.00 0.00 0.00 0.00 61.98 61.75 2fff s VAL 746 Cb -0.38 -2.36 0.03 0.00 0.00 0.00 0.00 36.38 33.67 2fff s VAL 746 CO 0.33 0.52 0.97 -0.70 0.00 0.00 0.00 175.10 176.23 2fff s GLU 747 N 0.26 3.47 -0.24 2.72 2.56 -1.26 -0.68 118.70 125.53 2fff s GLU 747 Ca -0.08 0.04 -0.23 0.00 0.00 0.00 0.00 54.97 54.71 2fff s GLU 747 Cb -0.15 -3.98 -0.01 0.00 2.00 0.00 0.00 34.13 31.99 2fff s GLU 747 CO 0.05 -1.37 0.74 0.08 -0.56 0.00 0.00 175.26 174.20 2fff s VAL 748 N 3.98 4.91 0.33 3.70 1.01 0.24 -4.97 120.40 129.60 2fff s VAL 748 Ca 0.36 1.38 0.06 0.00 0.00 0.00 0.00 61.98 63.78 2fff s VAL 748 Cb -0.10 -4.04 -0.02 0.00 0.00 0.00 0.00 36.38 32.21 2fff s VAL 748 CO 0.24 -0.01 0.32 0.42 0.00 0.00 0.00 175.10 176.07 2fff s THR 749 N 2.57 0.00 -4.75 3.92 -4.23 -1.26 -2.91 115.64 108.97 2fff s THR 749 Ca 0.31 -1.92 0.00 0.00 -1.18 0.00 0.00 61.69 58.90 2fff s THR 749 Cb -0.15 -2.53 0.00 0.00 1.34 0.00 0.00 72.50 71.15 2fff s THR 749 CO 0.08 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.77 2fff n GLY 750 N -0.61 0.96 3.74 3.99 0.00 -1.26 -5.05 105.19 106.96 2fff n GLY 750 Ca 0.06 -1.93 -0.41 0.00 0.00 0.00 0.00 46.02 43.74 2fff n GLY 750 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2fff s SER 751 N -4.00 6.56 0.51 1.61 0.01 -1.26 -4.89 113.70 112.24 2fff s SER 751 Ca 0.00 2.74 0.05 0.00 1.31 0.00 0.00 55.95 60.05 2fff s SER 751 Cb 0.00 -2.62 0.01 0.00 0.21 0.00 0.00 66.02 63.62 2fff s SER 751 CO 0.00 -0.78 0.28 0.42 0.41 0.00 0.00 173.24 173.57 2fff s THR 752 N 0.12 1.69 -0.05 1.44 -4.23 -1.26 -1.48 115.64 111.88 2fff s THR 752 Ca 0.62 -1.63 -0.30 0.00 -1.18 0.00 0.00 61.69 59.19 2fff s THR 752 Cb -0.44 -2.32 0.08 0.00 1.34 0.00 0.00 72.50 71.16 2fff s THR 752 CO 0.43 0.00 0.71 0.54 -0.54 0.00 0.00 174.62 175.76 2fff s VAL 753 N -2.76 0.00 -0.30 2.29 0.11 0.10 -4.72 120.40 115.13 2fff s VAL 753 Ca 0.29 0.00 -0.28 0.00 -2.93 0.00 0.00 61.98 59.07 2fff s VAL 753 Cb -0.00 -1.00 0.01 0.00 -1.53 0.00 0.00 36.38 33.86 2fff s VAL 753 CO 0.18 0.00 1.00 -0.89 -3.33 0.00 0.00 175.10 172.06 2fff s THR 754 N -1.40 4.60 -0.11 5.04 2.01 -1.26 -0.45 115.64 124.07 2fff s THR 754 Ca -0.09 1.65 -0.04 0.00 0.31 0.00 0.00 61.69 63.52 2fff s THR 754 Cb -0.00 -4.33 -0.04 0.00 0.01 0.00 0.00 72.50 68.14 2fff s THR 754 CO 0.07 -0.38 0.04 -0.55 -0.69 0.00 0.00 174.62 173.12 2fff s SER 755 N 1.58 5.57 -0.22 3.53 0.15 0.17 -4.85 113.70 119.63 2fff s SER 755 Ca 0.42 0.21 -0.10 0.00 0.70 0.00 0.00 55.95 57.18 2fff s SER 755 Cb -0.13 -1.70 -0.05 0.00 -1.71 0.00 0.00 66.02 62.43 2fff s SER 755 CO 0.13 0.36 0.14 -0.31 1.20 0.00 0.00 173.24 174.76 2fff s TYR 756 N -0.73 3.32 0.30 3.44 2.02 -1.26 -1.20 117.35 123.25 2fff s TYR 756 Ca 0.12 0.21 0.11 0.00 -0.37 0.00 0.00 57.07 57.14 2fff s TYR 756 Cb -0.12 -2.22 -0.06 0.00 -0.40 0.00 0.00 41.96 39.17 2fff s TYR 756 CO 0.02 0.11 -0.15 -1.58 -1.57 0.00 0.00 175.55 172.39 2fff s TRP 757 N 0.83 2.35 -0.17 2.71 0.52 0.22 -0.91 118.94 124.50 2fff s TRP 757 Ca 0.07 -0.39 0.14 0.00 0.02 0.00 0.00 56.10 55.94 2fff s TRP 757 Cb -0.13 -1.15 0.37 0.00 -1.15 0.00 0.00 33.47 31.41 2fff s TRP 757 CO 0.02 0.66 1.19 0.00 0.02 0.00 0.00 176.95 178.84 2fff n ALA 758 N -0.70 3.13 -2.42 0.98 0.00 -1.26 -2.07 120.51 118.17 2fff n ALA 758 Ca -0.05 -2.98 0.00 0.00 0.00 0.00 0.00 53.44 50.41 2fff n ALA 758 Cb 0.61 -0.39 0.00 0.00 0.00 0.00 0.00 19.45 19.67 2fff n ALA 758 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 2fff n ASN 759 N -1.04 0.46 -0.09 0.00 6.94 -1.26 -4.68 115.26 115.59 2fff n ASN 759 Ca 0.17 0.00 -0.12 0.00 -0.02 0.00 0.00 54.58 54.61 2fff n ASN 759 Cb 0.71 0.00 -0.09 0.00 -2.36 0.00 0.00 39.78 38.04 2fff n ASN 759 CO 0.00 0.00 0.00 2.29 -1.03 0.00 0.00 177.26 178.52 2fff n LYS 760 N 0.00 0.65 -0.04 -3.83 0.00 -1.26 -4.59 118.16 109.08 2fff n LYS 760 Ca 0.00 0.09 0.10 0.00 -0.00 0.00 0.00 58.31 58.50 2fff n LYS 760 Cb 0.00 -1.37 0.11 0.00 -0.00 0.00 0.00 35.03 33.77 2fff n LYS 760 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.40 176.27 2fff n SER 761 N -2.96 2.82 0.00 -5.58 3.41 -1.26 -4.99 113.62 105.05 2fff n SER 761 Ca -0.31 -1.86 0.00 0.00 -0.26 0.00 0.00 58.87 56.43 2fff n SER 761 Cb 0.87 -0.06 0.00 0.00 -0.26 0.00 0.00 64.21 64.76 2fff n SER 761 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2fff n GLY 762 N 1.16 0.82 3.78 5.00 0.00 -1.26 -4.83 105.19 109.86 2fff n GLY 762 Ca 0.13 -0.77 -0.36 0.00 0.00 0.00 0.00 46.02 45.02 2fff n GLY 762 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fff s ALA 763 N -1.69 3.05 0.76 4.61 0.00 -1.26 -4.97 121.76 122.27 2fff s ALA 763 Ca 0.00 0.72 -0.10 0.00 0.00 0.00 0.00 51.96 52.57 2fff s ALA 763 Cb 0.00 -3.28 0.06 0.00 0.00 0.00 0.00 23.12 19.90 2fff s ALA 763 CO 0.00 -0.28 1.12 -1.25 0.00 0.00 0.00 175.76 175.35 2fff s PRO 764 N -2.61 2.17 0.66 0.00 0.04 -1.26 -4.79 135.00 129.21 2fff s PRO 764 Ca 0.60 0.07 -0.17 0.00 0.04 0.00 0.00 61.00 61.54 2fff s PRO 764 Cb -0.22 -2.02 0.00 0.00 0.04 0.00 0.00 34.50 32.30 2fff s PRO 764 CO 0.28 -1.41 1.20 0.00 0.04 0.00 0.00 177.00 177.10 2fff s ALA 765 N -3.45 2.34 0.26 8.56 0.00 -1.26 -1.27 121.76 126.93 2fff s ALA 765 Ca 0.61 0.89 -0.30 0.00 0.00 0.00 0.00 51.96 53.15 2fff s ALA 765 Cb -0.11 -3.44 -0.11 0.00 0.00 0.00 0.00 23.12 19.46 2fff s ALA 765 CO 0.48 -1.50 1.59 0.99 0.00 0.00 0.00 175.76 177.32 2fff s THR 766 N -1.87 2.22 0.35 0.00 2.01 -0.41 -4.67 115.64 113.27 2fff s THR 766 Ca 0.75 0.18 0.04 0.00 0.31 0.00 0.00 61.69 62.97 2fff s THR 766 Cb -0.29 -3.11 -0.07 0.00 0.01 0.00 0.00 72.50 69.05 2fff s THR 766 CO 0.40 0.02 0.05 -0.94 -0.69 0.00 0.00 174.62 173.46 2fff s SER 767 N 0.66 2.79 0.13 3.53 1.04 -1.26 -4.78 113.70 115.80 2fff s SER 767 Ca 0.65 -1.39 -0.21 0.00 0.48 0.00 0.00 55.95 55.48 2fff s SER 767 Cb -0.47 -0.13 -0.02 0.00 0.10 0.00 0.00 66.02 65.51 2fff s SER 767 CO 0.43 -0.58 1.69 0.22 0.98 0.00 0.00 173.24 175.97 2fff h TYR 768 N 2.00 -0.24 -2.03 5.02 3.20 -1.95 -2.76 116.97 120.22 2fff h TYR 768 Ca -0.41 0.02 -0.73 0.00 3.14 0.00 0.00 58.73 60.75 2fff h TYR 768 Cb 1.25 0.13 -0.17 0.00 1.54 0.00 0.00 36.73 39.48 2fff h TYR 768 CO 0.66 -0.15 1.44 -0.98 -1.64 0.00 0.00 178.16 177.48 2fff s ARG 769 N -6.18 4.07 0.42 1.82 1.70 -1.26 -4.78 118.95 114.74 2fff s ARG 769 Ca -0.14 -2.50 0.23 0.00 -0.47 0.00 0.00 55.73 52.85 2fff s ARG 769 Cb 0.11 -5.11 0.55 0.00 -0.57 0.00 0.00 34.95 29.92 2fff s ARG 769 CO 0.68 -1.82 1.67 0.27 -1.08 0.00 0.00 175.30 175.02 2fff h PHE 770 N 7.24 0.00 -1.83 5.89 -0.00 -1.83 -3.47 116.94 122.95 2fff h PHE 770 Ca 0.33 0.00 -0.49 0.00 -0.00 0.00 0.00 57.97 57.81 2fff h PHE 770 Cb 0.88 0.00 -0.03 0.00 -0.00 0.00 0.00 35.95 36.79 2fff h PHE 770 CO 1.14 0.18 -0.43 0.00 -0.00 0.00 0.00 178.31 179.19 2fff s ALA 771 N -3.31 3.90 -0.38 12.09 0.00 -1.26 -4.68 121.76 128.12 2fff s ALA 771 Ca 0.04 -1.64 -0.27 0.00 0.00 0.00 0.00 51.96 50.09 2fff s ALA 771 Cb 0.07 -1.23 0.02 0.00 0.00 0.00 0.00 23.12 21.99 2fff s ALA 771 CO 0.66 -0.01 0.98 0.42 0.00 0.00 0.00 175.76 177.81 2fff s ILE 772 N -2.30 4.52 0.00 0.00 -1.09 0.06 -4.86 121.20 117.53 2fff s ILE 772 Ca 0.42 1.27 0.00 0.00 -2.23 0.00 0.00 60.65 60.10 2fff s ILE 772 Cb -0.06 -4.39 0.00 0.00 -1.58 0.00 0.00 42.46 36.43 2fff s ILE 772 CO 0.27 -0.60 0.00 0.61 -1.23 0.00 0.00 174.94 173.99 2fff n GLY 773 N 4.38 -0.94 0.00 6.18 0.00 -1.26 -0.66 105.19 112.89 2fff n GLY 773 Ca 0.08 -1.67 0.00 0.00 0.00 0.00 0.00 46.02 44.44 2fff n GLY 773 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2fff n GLY 774 N -1.00 3.61 3.94 -0.02 0.00 -1.26 -4.47 105.19 106.00 2fff n GLY 774 Ca 0.00 -1.42 -0.24 0.00 0.00 0.00 0.00 46.02 44.35 2fff n GLY 774 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2fff s SER 775 N 0.00 5.03 0.35 1.61 1.04 -1.26 -4.90 113.70 115.57 2fff s SER 775 Ca 0.00 0.33 0.03 0.00 0.48 0.00 0.00 55.95 56.79 2fff s SER 775 Cb 0.00 -1.08 0.65 0.00 0.10 0.00 0.00 66.02 65.69 2fff s SER 775 CO 0.00 -1.41 1.97 -2.24 0.98 0.00 0.00 173.24 172.54 2fff h ASP 776 N -0.35 0.62 -0.63 7.02 2.03 -1.99 -0.78 116.42 122.34 2fff h ASP 776 Ca -0.44 -0.05 -0.08 0.00 -0.73 0.00 0.00 57.03 55.74 2fff h ASP 776 Cb 1.30 -0.16 -0.03 0.00 -0.83 0.00 0.00 39.33 39.62 2fff h ASP 776 CO 0.58 0.52 0.10 0.00 -1.03 0.00 0.00 179.24 179.41 2fff h ALA 777 N 1.58 0.96 -0.12 4.15 0.00 -2.00 -1.58 119.26 122.26 2fff h ALA 777 Ca 0.18 -0.27 -0.00 0.00 0.00 0.00 0.00 54.91 54.82 2fff h ALA 777 Cb 0.05 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 2fff h ALA 777 CO -0.03 0.65 0.07 -0.44 0.00 0.00 0.00 179.25 179.51 2fff h ASP 778 N 0.99 0.14 0.21 0.00 3.32 -1.56 -2.64 116.42 116.88 2fff h ASP 778 Ca 0.20 -0.04 -0.06 0.00 0.02 0.00 0.00 57.03 57.14 2fff h ASP 778 Cb 0.43 -0.04 -0.01 0.00 0.22 0.00 0.00 39.33 39.94 2fff h ASP 778 CO 0.01 0.14 -0.26 1.88 -1.72 0.00 0.00 179.24 179.29 2fff h TYR 779 N 0.13 0.10 -0.55 4.55 0.05 -1.18 0.11 116.97 120.18 2fff h TYR 779 Ca 0.04 -0.02 -0.03 0.00 0.05 0.00 0.00 58.73 58.77 2fff h TYR 779 Cb 0.03 -0.03 -0.02 0.00 1.01 0.00 0.00 36.73 37.72 2fff h TYR 779 CO -0.06 0.36 0.22 1.96 -1.05 0.00 0.00 178.16 179.59 2fff h GLN 780 N 0.09 0.82 0.24 4.88 4.20 -1.14 -0.23 115.11 123.97 2fff h GLN 780 Ca 0.01 -0.15 -0.01 0.00 0.06 0.00 0.00 58.65 58.56 2fff h GLN 780 Cb 0.52 -0.13 0.00 0.00 0.30 0.00 0.00 27.48 28.17 2fff h GLN 780 CO 0.04 0.72 -0.12 -0.97 -0.67 0.00 0.00 178.83 177.83 2fff h ASN 781 N 0.75 -0.28 -0.30 1.46 -0.73 -1.06 -2.20 115.58 113.22 2fff h ASN 781 Ca 0.18 -0.06 0.00 0.00 1.87 0.00 0.00 56.30 58.29 2fff h ASN 781 Cb 0.20 0.07 -0.01 0.00 0.27 0.00 0.00 38.32 38.85 2fff h ASN 781 CO -0.01 -0.11 0.19 0.00 -0.37 0.00 0.00 177.43 177.12 2fff h ALA 782 N 0.31 0.39 -0.05 1.57 0.00 -0.69 -2.52 119.26 118.26 2fff h ALA 782 Ca -0.03 -0.04 -0.10 0.00 0.00 0.00 0.00 54.91 54.74 2fff h ALA 782 Cb 0.32 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 2fff h ALA 782 CO 0.06 -0.13 -0.42 -1.49 0.00 0.00 0.00 179.25 177.27 2fff h TRP 783 N 0.40 0.12 0.35 0.00 4.06 -1.11 -1.90 115.95 117.87 2fff h TRP 783 Ca 0.11 -0.03 -0.00 0.00 2.06 0.00 0.00 58.89 61.03 2fff h TRP 783 Cb -0.02 -0.03 -0.02 0.00 -1.00 0.00 0.00 29.16 28.10 2fff h TRP 783 CO -0.05 0.50 -0.30 1.03 -3.56 0.00 0.00 178.44 176.06 2fff h SER 784 N 0.08 -0.80 -0.48 -3.49 0.87 -0.99 0.21 113.55 108.96 2fff h SER 784 Ca 0.01 0.07 0.10 0.00 -1.23 0.00 0.00 61.79 60.73 2fff h SER 784 Cb 0.77 0.26 -0.10 0.00 -0.44 0.00 0.00 62.40 62.90 2fff h SER 784 CO 0.06 -0.44 -0.25 0.28 -0.53 0.00 0.00 176.83 175.94 2fff h SER 785 N -0.67 -0.85 0.09 6.23 0.02 -1.29 -1.63 113.55 115.45 2fff h SER 785 Ca -0.03 0.18 0.01 0.00 -0.84 0.00 0.00 61.79 61.12 2fff h SER 785 Cb 0.59 0.45 -0.02 0.00 0.14 0.00 0.00 62.40 63.55 2fff h SER 785 CO -0.03 -0.27 -0.17 0.40 -1.14 0.00 0.00 176.83 175.62 2fff h ILE 786 N -0.14 0.60 -0.20 3.27 2.04 -1.11 -2.76 117.51 119.20 2fff h ILE 786 Ca 0.22 0.00 0.06 0.00 1.00 0.00 0.00 64.86 66.14 2fff h ILE 786 Cb 0.49 0.60 -0.01 0.00 -0.74 0.00 0.00 36.82 37.16 2fff h ILE 786 CO -0.57 0.00 0.16 0.58 0.00 0.00 0.00 178.15 178.32 2fff h VAL 787 N -0.34 0.78 -0.20 1.67 2.07 -0.20 -2.57 116.25 117.47 2fff h VAL 787 Ca 0.03 0.00 -0.23 0.00 0.82 0.00 0.00 66.70 67.32 2fff h VAL 787 Cb 0.36 0.89 0.01 0.00 -1.52 0.00 0.00 31.29 31.02 2fff h VAL 787 CO -0.10 0.00 0.70 0.61 0.02 0.00 0.00 177.57 178.79 2fff n GLY 788 N -1.53 0.37 0.00 2.17 0.00 -0.65 -5.09 105.19 100.46 2fff n GLY 788 Ca 0.02 -0.39 0.07 0.00 0.00 0.00 0.00 46.02 45.72 2fff n GLY 788 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76