#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3mfb n LEU 333 N 0.00 8.15 -4.57 2.23 7.94 -0.60 -4.77 117.00 125.38 3mfb n LEU 333 Ca 0.00 -4.37 -0.28 0.00 -1.11 0.00 0.00 56.01 50.25 3mfb n LEU 333 Cb 0.00 -1.48 0.22 0.00 0.53 0.00 0.00 43.42 42.69 3mfb n LEU 333 CO 0.00 2.02 0.57 0.42 -1.11 0.00 0.00 177.39 179.30 3mfb s THR 334 N 1.05 1.98 0.47 1.96 -4.23 -1.26 -3.74 115.64 111.88 3mfb s THR 334 Ca 0.65 0.00 0.13 0.00 -1.18 0.00 0.00 61.69 61.29 3mfb s THR 334 Cb 0.20 -2.28 0.28 0.00 1.34 0.00 0.00 72.50 72.04 3mfb s THR 334 CO -0.07 0.00 2.10 -0.65 -0.54 0.00 0.00 174.62 175.46 3mfb h PRO 335 N -2.33 0.23 -0.32 3.99 0.11 -1.99 -0.75 132.00 130.95 3mfb h PRO 335 Ca -0.59 -0.01 -0.09 0.00 0.11 0.00 0.00 66.00 65.42 3mfb h PRO 335 Cb 1.34 -0.05 -0.01 0.00 0.11 0.00 0.00 31.00 32.39 3mfb h PRO 335 CO 0.54 0.15 -0.17 0.93 -0.21 0.00 0.00 178.00 179.24 3mfb h GLU 336 N 0.24 0.68 -0.44 1.05 4.39 -1.96 -1.56 114.58 116.98 3mfb h GLU 336 Ca 0.09 -0.30 -0.06 0.00 0.34 0.00 0.00 59.36 59.43 3mfb h GLU 336 Cb 0.06 -0.02 -0.02 0.00 -0.10 0.00 0.00 28.75 28.68 3mfb h GLU 336 CO -0.02 0.90 0.05 0.87 -1.16 0.00 0.00 179.01 179.65 3mfb h LYS 337 N 0.44 0.75 -0.29 2.33 1.79 -1.66 -0.90 116.57 119.03 3mfb h LYS 337 Ca 0.07 -0.21 -0.03 0.00 -2.18 0.00 0.00 60.65 58.30 3mfb h LYS 337 Cb 0.71 -0.08 -0.02 0.00 -1.58 0.00 0.00 32.23 31.26 3mfb h LYS 337 CO 0.05 0.79 0.07 -0.07 -1.08 0.00 0.00 179.45 179.21 3mfb h LEU 338 N 0.60 0.38 -0.61 2.94 3.38 -1.10 -0.90 115.31 120.00 3mfb h LEU 338 Ca 0.13 -0.04 -0.15 0.00 0.09 0.00 0.00 57.88 57.91 3mfb h LEU 338 Cb 0.42 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.06 3mfb h LEU 338 CO 0.01 0.39 -0.63 0.25 0.09 0.00 0.00 178.44 178.55 3mfb h LEU 339 N 0.42 0.29 -0.73 1.67 5.85 -0.95 -0.38 115.31 121.46 3mfb h LEU 339 Ca 0.10 -0.17 -0.08 0.00 0.84 0.00 0.00 57.88 58.57 3mfb h LEU 339 Cb 0.16 -0.08 -0.03 0.00 0.37 0.00 0.00 40.66 41.09 3mfb h LEU 339 CO -0.00 0.84 0.08 -0.08 -0.34 0.00 0.00 178.44 178.94 3mfb h GLU 340 N 0.18 1.05 -0.19 1.25 4.81 0.12 -0.24 114.58 121.56 3mfb h GLU 340 Ca -0.01 -0.28 -0.15 0.00 -0.13 0.00 0.00 59.36 58.79 3mfb h GLU 340 Cb 1.15 -0.12 0.00 0.00 0.63 0.00 0.00 28.75 30.41 3mfb h GLU 340 CO 0.10 0.97 -0.47 0.00 -0.73 0.00 0.00 179.01 178.88 3mfb h ALA 341 N 1.10 0.31 -0.34 2.92 0.00 -0.97 -3.27 119.26 119.00 3mfb h ALA 341 Ca 0.19 -0.48 -0.04 0.00 0.00 0.00 0.00 54.91 54.57 3mfb h ALA 341 Cb 0.45 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 3mfb h ALA 341 CO 0.02 0.46 0.04 0.00 0.00 0.00 0.00 179.25 179.77 3mfb h ALA 342 N 0.58 0.46 -0.27 0.00 0.00 -0.91 0.48 119.26 119.60 3mfb h ALA 342 Ca -0.01 -0.21 0.08 0.00 0.00 0.00 0.00 54.91 54.77 3mfb h ALA 342 Cb 1.08 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.73 3mfb h ALA 342 CO 0.10 0.17 0.27 -0.91 0.00 0.00 0.00 179.25 178.88 3mfb h ASN 343 N 0.41 0.00 -0.29 0.00 2.35 -1.11 -0.70 115.58 116.24 3mfb h ASN 343 Ca 0.10 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.85 3mfb h ASN 343 Cb 0.37 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.74 3mfb h ASN 343 CO 0.01 0.00 0.00 2.29 -1.65 0.00 0.00 177.43 178.08 3mfb n LYS 344 N -3.90 3.02 -3.78 0.81 2.85 -1.14 -4.95 118.16 111.06 3mfb n LYS 344 Ca 0.04 -2.72 -0.27 0.00 -1.05 0.00 0.00 58.31 54.30 3mfb n LYS 344 Cb 0.41 -1.77 0.05 0.00 -0.65 0.00 0.00 35.03 33.07 3mfb n LYS 344 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 177.40 178.39 3mfb n GLN 345 N -0.26 -6.42 0.00 -1.58 1.13 -0.27 -4.97 117.38 105.01 3mfb n GLN 345 Ca 0.20 0.69 0.00 0.00 -1.94 0.00 0.00 57.00 55.95 3mfb n GLN 345 Cb 0.83 -5.63 0.00 0.00 0.11 0.00 0.00 30.24 25.55 3mfb n GLN 345 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3mfb n GLY 346 N -1.79 0.99 3.38 1.08 0.00 0.17 -4.87 105.19 104.15 3mfb n GLY 346 Ca 0.01 -1.85 -0.13 0.00 0.00 0.00 0.00 46.02 44.05 3mfb n GLY 346 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3mfb s THR 347 N 1.33 0.00 -0.03 2.61 -4.23 -1.26 -1.42 115.64 112.64 3mfb s THR 347 Ca 0.00 -1.75 -0.07 0.00 -1.18 0.00 0.00 61.69 58.69 3mfb s THR 347 Cb 0.00 -2.48 0.01 0.00 1.34 0.00 0.00 72.50 71.37 3mfb s THR 347 CO 0.00 0.00 0.16 0.68 -0.54 0.00 0.00 174.62 174.92 3mfb s VAL 348 N -3.67 0.04 0.74 2.29 -7.23 -0.47 -4.89 120.40 107.21 3mfb s VAL 348 Ca 0.33 -0.35 -0.13 0.00 -1.81 0.00 0.00 61.98 60.03 3mfb s VAL 348 Cb 0.02 -0.35 0.05 0.00 0.56 0.00 0.00 36.38 36.66 3mfb s VAL 348 CO 0.17 -0.19 1.12 -2.16 -0.31 0.00 0.00 175.10 173.72 3mfb s PRO 349 N -0.67 2.27 -0.22 4.82 0.04 -1.26 -0.32 135.00 139.67 3mfb s PRO 349 Ca -0.08 1.38 -0.12 0.00 0.04 0.00 0.00 61.00 62.22 3mfb s PRO 349 Cb -0.04 -1.89 0.07 0.00 0.04 0.00 0.00 34.50 32.68 3mfb s PRO 349 CO 0.01 -1.66 0.53 0.45 0.04 0.00 0.00 177.00 176.37 3mfb s SER 350 N -2.82 -0.70 0.57 6.66 0.15 0.13 -3.45 113.70 114.24 3mfb s SER 350 Ca 0.66 1.17 0.37 0.00 0.70 0.00 0.00 55.95 58.84 3mfb s SER 350 Cb -0.21 1.08 1.67 0.00 -1.71 0.00 0.00 66.02 66.85 3mfb s SER 350 CO 0.50 -0.21 2.09 -0.09 1.20 0.00 0.00 173.24 176.72 3mfb h ARG 351 N 7.13 0.00 -4.00 5.44 2.43 -1.38 -3.42 114.38 120.58 3mfb h ARG 351 Ca -0.33 0.00 -0.24 0.00 -0.81 0.00 0.00 59.98 58.60 3mfb h ARG 351 Cb 1.20 0.00 -0.26 0.00 -0.42 0.00 0.00 29.97 30.49 3mfb h ARG 351 CO 0.23 0.00 -0.72 0.54 -1.51 0.00 0.00 179.97 178.51 3mfb s VAL 352 N -3.80 0.17 0.03 0.20 0.11 -1.26 -0.70 120.40 115.16 3mfb s VAL 352 Ca -0.01 -0.35 0.02 0.00 -2.93 0.00 0.00 61.98 58.71 3mfb s VAL 352 Cb 0.10 -0.20 -0.02 0.00 -1.53 0.00 0.00 36.38 34.73 3mfb s VAL 352 CO 0.49 -0.12 -0.07 -0.13 -3.33 0.00 0.00 175.10 171.95 3mfb s ARG 353 N -0.50 0.50 0.25 1.54 0.52 -0.78 -4.94 118.95 115.54 3mfb s ARG 353 Ca -0.04 -0.58 0.10 0.00 -0.52 0.00 0.00 55.73 54.69 3mfb s ARG 353 Cb -0.04 -0.33 -0.04 0.00 0.52 0.00 0.00 34.95 35.06 3mfb s ARG 353 CO -0.00 0.07 -0.07 0.71 0.02 0.00 0.00 175.30 176.03 3mfb s TYR 354 N -0.99 2.58 0.10 -0.53 1.51 -1.26 -0.71 117.35 118.05 3mfb s TYR 354 Ca -0.06 -0.25 -0.18 0.00 -1.01 0.00 0.00 57.07 55.57 3mfb s TYR 354 Cb -0.08 -1.16 0.04 0.00 -0.11 0.00 0.00 41.96 40.65 3mfb s TYR 354 CO 0.00 0.63 0.43 -1.14 -1.11 0.00 0.00 175.55 174.36 3mfb s GLN 355 N -3.49 1.04 0.52 -0.62 0.74 -0.04 -4.72 119.66 113.09 3mfb s GLN 355 Ca 0.30 -0.56 0.07 0.00 0.05 0.00 0.00 55.36 55.23 3mfb s GLN 355 Cb -0.06 0.46 0.04 0.00 1.10 0.00 0.00 33.01 34.55 3mfb s GLN 355 CO 0.18 -0.40 0.53 -1.58 -0.55 0.00 0.00 175.29 173.48 3mfb s TRP 356 N -3.33 1.88 -0.25 1.67 0.52 -1.26 -1.48 118.94 116.68 3mfb s TRP 356 Ca -0.00 -0.70 -0.26 0.00 0.02 0.00 0.00 56.10 55.17 3mfb s TRP 356 Cb 0.01 -2.10 0.09 0.00 -1.15 0.00 0.00 33.47 30.32 3mfb s TRP 356 CO -0.09 -0.61 0.82 -2.00 0.02 0.00 0.00 176.95 175.09 3mfb s GLU 358 N -4.38 0.75 -0.52 4.98 2.12 -1.26 -4.62 118.70 115.77 3mfb s GLU 358 Ca 0.48 0.79 -0.20 0.00 0.36 0.00 0.00 54.97 56.40 3mfb s GLU 358 Cb -0.04 0.36 0.06 0.00 0.26 0.00 0.00 34.13 34.77 3mfb s GLU 358 CO 0.29 -0.11 0.68 0.34 -0.54 0.00 0.00 175.26 175.93 3mfb s ASP 359 N 0.16 6.24 0.00 -1.70 2.15 -0.54 -4.92 116.67 118.05 3mfb s ASP 359 Ca -0.00 -0.85 0.00 0.00 0.43 0.00 0.00 52.55 52.13 3mfb s ASP 359 Cb -0.04 -2.32 0.00 0.00 -0.30 0.00 0.00 42.92 40.26 3mfb s ASP 359 CO -0.00 -0.96 0.77 1.21 -0.17 0.00 0.00 175.17 176.01 3mfb n GLU 360 N 6.41 0.00 -0.01 4.34 2.13 -1.26 -0.05 120.64 132.20 3mfb n GLU 360 Ca -0.05 0.29 0.10 0.00 0.66 0.00 0.00 57.16 58.15 3mfb n GLU 360 Cb 0.46 -1.54 -0.14 0.00 0.27 0.00 0.00 31.44 30.49 3mfb n GLU 360 CO 0.00 0.00 0.00 0.39 -0.41 0.00 0.00 177.13 177.11 3mfb n GLU 361 N -1.27 0.63 0.00 5.31 1.02 -1.26 -4.69 120.64 120.38 3mfb n GLU 361 Ca 0.00 -0.14 0.00 0.00 -0.02 0.00 0.00 57.16 57.00 3mfb n GLU 361 Cb 0.04 -1.44 0.00 0.00 -0.02 0.00 0.00 31.44 30.02 3mfb n GLU 361 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 3mfb n THR 362 N -2.02 0.00 -0.15 2.62 -2.24 -0.66 -5.01 114.28 106.82 3mfb n THR 362 Ca -0.02 -0.05 0.00 0.00 -2.27 0.00 0.00 64.05 61.71 3mfb n THR 362 Cb 0.46 0.40 0.00 0.00 -2.10 0.00 0.00 70.33 69.09 3mfb n THR 362 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3mfb n GLY 363 N 0.73 1.89 3.75 3.38 0.00 0.92 -5.01 105.19 110.86 3mfb n GLY 363 Ca 0.00 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.65 3mfb n GLY 363 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3mfb s ARG 364 N -0.28 3.10 0.23 1.61 0.52 -1.26 -4.68 118.95 118.19 3mfb s ARG 364 Ca 0.00 1.95 0.10 0.00 -0.52 0.00 0.00 55.73 57.26 3mfb s ARG 364 Cb 0.00 -2.08 -0.04 0.00 0.52 0.00 0.00 34.95 33.35 3mfb s ARG 364 CO 0.00 -1.14 -0.08 -0.51 0.02 0.00 0.00 175.30 173.60 3mfb s LEU 365 N -3.79 3.00 -0.07 2.53 1.43 -1.26 -1.47 118.68 119.05 3mfb s LEU 365 Ca 0.74 -0.67 -0.04 0.00 -1.03 0.00 0.00 54.13 53.13 3mfb s LEU 365 Cb -0.33 -1.60 0.04 0.00 0.03 0.00 0.00 46.19 44.33 3mfb s LEU 365 CO 0.38 0.05 0.17 -0.75 0.23 0.00 0.00 176.35 176.43 3mfb s LYS 366 N -3.26 0.13 0.07 1.70 2.20 -1.26 -5.01 119.74 114.31 3mfb s LYS 366 Ca 0.28 0.39 -0.30 0.00 -0.36 0.00 0.00 55.97 55.98 3mfb s LYS 366 Cb -0.07 -0.14 -0.05 0.00 -1.51 0.00 0.00 37.83 36.06 3mfb s LYS 366 CO 0.17 -0.15 1.02 0.00 -0.36 0.00 0.00 175.35 176.03 3mfb s ALA 367 N 1.09 3.25 -0.01 3.13 0.00 -1.26 -4.36 121.76 123.59 3mfb s ALA 367 Ca -0.08 0.63 -0.11 0.00 0.00 0.00 0.00 51.96 52.40 3mfb s ALA 367 Cb -0.10 -3.34 0.01 0.00 0.00 0.00 0.00 23.12 19.69 3mfb s ALA 367 CO -0.06 -0.19 0.22 0.14 0.00 0.00 0.00 175.76 175.88 3mfb s VAL 368 N 0.53 0.07 0.38 0.00 -7.23 -0.55 -4.46 120.40 109.14 3mfb s VAL 368 Ca 0.51 -0.54 0.06 0.00 -1.81 0.00 0.00 61.98 60.20 3mfb s VAL 368 Cb -0.24 -0.51 -0.08 0.00 0.56 0.00 0.00 36.38 36.12 3mfb s VAL 368 CO 0.30 -0.30 0.02 -0.83 -0.31 0.00 0.00 175.10 173.98 3mfb s GLY 369 N -1.25 2.38 0.00 2.32 0.00 -0.61 -0.86 107.32 109.29 3mfb s GLY 369 Ca -0.13 -2.23 -0.05 0.00 0.00 0.00 0.00 44.72 42.30 3mfb s GLY 369 CO 0.03 -2.02 0.09 -0.19 0.00 0.00 0.00 173.10 171.01 3mfb s TYR 370 N -2.87 0.08 -0.22 1.90 1.51 0.11 -1.83 117.35 116.03 3mfb s TYR 370 Ca 0.35 -0.18 -0.22 0.00 -1.01 0.00 0.00 57.07 56.01 3mfb s TYR 370 Cb 0.09 -0.07 -0.02 0.00 -0.11 0.00 0.00 41.96 41.85 3mfb s TYR 370 CO 0.17 -0.23 0.67 -1.01 -1.11 0.00 0.00 175.55 174.04 3mfb s HIS 371 N -1.23 3.34 0.45 2.71 3.76 -1.26 -1.86 115.29 121.20 3mfb s HIS 371 Ca -0.13 0.94 -0.06 0.00 -0.15 0.00 0.00 55.06 55.66 3mfb s HIS 371 Cb -0.07 -2.87 -0.04 0.00 1.11 0.00 0.00 32.58 30.70 3mfb s HIS 371 CO 0.01 -0.27 0.76 0.95 -0.85 0.00 0.00 174.74 175.34 3mfb s THR 372 N 2.27 4.89 0.00 1.30 -4.23 0.13 -4.99 115.64 115.01 3mfb s THR 372 Ca 0.29 0.29 0.00 0.00 -1.18 0.00 0.00 61.69 61.09 3mfb s THR 372 Cb -0.16 -3.82 0.00 0.00 1.34 0.00 0.00 72.50 69.86 3mfb s THR 372 CO 0.09 -0.72 0.00 -0.24 -0.54 0.00 0.00 174.62 173.21 3mfb n SER 373 N -1.91 1.94 0.00 3.99 2.88 -1.26 -4.87 113.62 114.38 3mfb n SER 373 Ca 0.01 -0.08 0.00 0.00 -1.33 0.00 0.00 58.87 57.47 3mfb n SER 373 Cb 0.55 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.01 3mfb n SER 373 CO 0.00 0.00 0.00 1.21 -1.23 0.00 0.00 175.04 175.02 3mfb n GLU 375 N -0.00 0.00 0.29 -1.46 4.07 -1.26 -1.98 120.64 120.31 3mfb n GLU 375 Ca 0.00 0.00 -0.17 0.00 -0.06 0.00 0.00 57.16 56.93 3mfb n GLU 375 Cb 0.00 0.00 -0.08 0.00 -0.06 0.00 0.00 31.44 31.30 3mfb n GLU 375 CO 0.00 0.00 0.00 1.03 -0.06 0.00 0.00 177.13 178.10 3mfb h SER 376 N 0.00 -0.95 0.00 4.31 0.87 -2.03 -3.47 113.55 112.28 3mfb h SER 376 Ca 0.00 0.07 0.00 0.00 -1.23 0.00 0.00 61.79 60.63 3mfb h SER 376 Cb 0.00 0.29 0.00 0.00 -0.44 0.00 0.00 62.40 62.25 3mfb h SER 376 CO 0.00 -0.55 0.00 0.61 -0.53 0.00 0.00 176.83 176.36 3mfb n GLY 377 N -1.49 0.64 1.80 5.77 0.00 -0.84 -4.96 105.19 106.12 3mfb n GLY 377 Ca -0.12 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.84 3mfb n GLY 377 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 3mfb n ARG 378 N -1.29 3.13 0.00 1.61 0.63 -1.26 -4.16 116.66 115.33 3mfb n ARG 378 Ca 0.00 -2.48 0.12 0.00 -0.92 0.00 0.00 57.85 54.57 3mfb n ARG 378 Cb 0.00 -2.04 0.23 0.00 0.45 0.00 0.00 32.46 31.10 3mfb n ARG 378 CO 0.00 0.00 0.00 -0.40 -2.51 0.00 0.00 177.63 174.72 3mfb n ASP 379 N -0.13 2.09 -4.76 6.15 5.75 -1.26 -4.83 116.55 119.56 3mfb n ASP 379 Ca 0.35 -1.59 -0.40 0.00 -0.01 0.00 0.00 54.79 53.14 3mfb n ASP 379 Cb 1.22 0.13 -0.05 0.00 -1.03 0.00 0.00 41.12 41.39 3mfb n ASP 379 CO 0.00 0.00 0.00 -1.10 -0.11 0.00 0.00 177.20 175.99 3mfb s GLN 380 N -2.19 4.53 -0.07 0.11 -1.52 -1.26 0.18 119.66 119.45 3mfb s GLN 380 Ca 0.28 1.12 0.05 0.00 -1.95 0.00 0.00 55.36 54.86 3mfb s GLN 380 Cb 0.20 -3.32 -0.01 0.00 -0.22 0.00 0.00 33.01 29.66 3mfb s GLN 380 CO 0.41 0.42 -0.25 0.08 -0.25 0.00 0.00 175.29 175.70 3mfb s VAL 381 N -0.56 2.05 0.22 1.09 1.01 0.57 -4.91 120.40 119.87 3mfb s VAL 381 Ca 0.37 -1.05 -0.30 0.00 0.00 0.00 0.00 61.98 61.00 3mfb s VAL 381 Cb -0.22 -1.75 -0.09 0.00 0.00 0.00 0.00 36.38 34.32 3mfb s VAL 381 CO 0.25 0.57 1.36 -0.13 0.00 0.00 0.00 175.10 177.14 3mfb s ARG 382 N -0.01 4.34 -0.15 2.72 0.52 -1.26 -1.37 118.95 123.74 3mfb s ARG 382 Ca -0.08 2.15 -0.03 0.00 -0.52 0.00 0.00 55.73 57.25 3mfb s ARG 382 Cb -0.15 -3.16 -0.02 0.00 0.52 0.00 0.00 34.95 32.14 3mfb s ARG 382 CO 0.05 -0.31 -0.06 0.08 0.02 0.00 0.00 175.30 175.08 3mfb s VAL 383 N 0.03 3.64 0.01 3.52 1.01 -0.50 -0.79 120.40 127.32 3mfb s VAL 383 Ca 0.57 -0.45 0.02 0.00 0.00 0.00 0.00 61.98 62.13 3mfb s VAL 383 Cb -0.39 -2.58 -0.01 0.00 0.00 0.00 0.00 36.38 33.40 3mfb s VAL 383 CO 0.40 0.50 -0.07 -0.13 0.00 0.00 0.00 175.10 175.80 3mfb s ARG 384 N 0.41 0.53 -0.08 2.72 1.81 -0.07 -4.13 118.95 120.14 3mfb s ARG 384 Ca -0.06 -0.36 -0.22 0.00 -1.72 0.00 0.00 55.73 53.37 3mfb s ARG 384 Cb -0.15 -0.47 -0.04 0.00 -0.45 0.00 0.00 34.95 33.84 3mfb s ARG 384 CO 0.04 0.12 0.65 -1.17 -0.68 0.00 0.00 175.30 174.26 3mfb s LEU 385 N -0.49 4.30 0.39 2.53 2.96 -1.26 -0.25 118.68 126.86 3mfb s LEU 385 Ca -0.00 1.10 -0.24 0.00 -0.22 0.00 0.00 54.13 54.78 3mfb s LEU 385 Cb -0.04 -3.00 -0.10 0.00 0.50 0.00 0.00 46.19 43.55 3mfb s LEU 385 CO -0.00 -0.09 0.99 -0.76 -1.32 0.00 0.00 176.35 175.16 3mfb s LEU 386 N 0.79 4.13 -0.08 -0.68 1.43 0.21 -4.88 118.68 119.59 3mfb s LEU 386 Ca 0.35 1.87 -0.03 0.00 -1.03 0.00 0.00 54.13 55.29 3mfb s LEU 386 Cb -0.17 -4.25 -0.04 0.00 0.03 0.00 0.00 46.19 41.76 3mfb s LEU 386 CO 0.16 -0.34 0.05 -0.54 0.23 0.00 0.00 176.35 175.91 3mfb s LYS 387 N -2.59 3.11 -0.18 1.70 1.02 -0.24 -4.25 119.74 118.31 3mfb s LYS 387 Ca 0.57 -0.35 -0.22 0.00 0.02 0.00 0.00 55.97 56.00 3mfb s LYS 387 Cb -0.17 -2.90 -0.02 0.00 -0.52 0.00 0.00 37.83 34.21 3mfb s LYS 387 CO 0.22 0.72 0.66 -1.58 -0.92 0.00 0.00 175.35 174.45 3mfb s HIS 388 N -0.97 3.40 -0.72 3.18 2.46 -1.26 0.05 115.29 121.43 3mfb s HIS 388 Ca 0.15 1.00 -0.06 0.00 0.47 0.00 0.00 55.06 56.62 3mfb s HIS 388 Cb -0.12 -2.83 0.19 0.00 -0.13 0.00 0.00 32.58 29.69 3mfb s HIS 388 CO 0.04 -0.16 0.58 0.34 -2.47 0.00 0.00 174.74 173.08 3mfb s ASP 389 N 1.14 5.78 0.19 9.88 -1.08 0.27 -4.95 116.67 127.91 3mfb s ASP 389 Ca 0.31 -2.93 -0.12 0.00 -0.52 0.00 0.00 52.55 49.29 3mfb s ASP 389 Cb -0.16 -1.97 0.10 0.00 -1.46 0.00 0.00 42.92 39.44 3mfb s ASP 389 CO 0.11 -0.40 1.84 -0.26 0.52 0.00 0.00 175.17 176.98 3mfb h PHE 390 N 7.11 0.81 -0.68 -5.34 -1.00 -1.95 0.93 116.94 116.82 3mfb h PHE 390 Ca 0.04 0.01 0.19 0.00 2.81 0.00 0.00 57.97 61.02 3mfb h PHE 390 Cb 0.96 -0.27 -0.03 0.00 3.61 0.00 0.00 35.95 40.22 3mfb h PHE 390 CO 0.81 0.53 0.48 -1.35 -1.61 0.00 0.00 178.31 177.18 3mfb h PRO 391 N 0.86 0.08 -0.16 1.51 0.11 -1.95 0.36 132.00 132.80 3mfb h PRO 391 Ca 0.23 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.33 3mfb h PRO 391 Cb -0.06 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 31.03 3mfb h PRO 391 CO -0.05 0.05 0.00 0.09 -0.21 0.00 0.00 178.00 177.89 3mfb n ASN 392 N -4.37 2.65 -3.76 -2.05 3.02 -0.79 -5.00 115.26 104.97 3mfb n ASN 392 Ca 0.13 -1.77 -0.26 0.00 -0.03 0.00 0.00 54.58 52.65 3mfb n ASN 392 Cb 0.70 -0.10 0.02 0.00 -0.61 0.00 0.00 39.78 39.79 3mfb n ASN 392 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 3mfb n ASN 393 N 0.94 -2.48 -3.84 6.41 3.02 0.25 -4.98 115.26 114.59 3mfb n ASN 393 Ca 0.12 -0.94 -0.09 0.00 -0.03 0.00 0.00 54.58 53.63 3mfb n ASN 393 Cb 0.44 -3.56 -0.05 0.00 -0.61 0.00 0.00 39.78 36.00 3mfb n ASN 393 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 3mfb s ARG 394 N -6.10 1.36 -0.07 3.52 0.52 -0.86 -4.52 118.95 112.80 3mfb s ARG 394 Ca 0.18 -1.01 0.01 0.00 -0.52 0.00 0.00 55.73 54.38 3mfb s ARG 394 Cb -0.06 0.48 -0.03 0.00 0.52 0.00 0.00 34.95 35.86 3mfb s ARG 394 CO 0.85 -0.56 -0.07 0.71 0.02 0.00 0.00 175.30 176.25 3mfb s TYR 395 N -3.92 2.94 0.04 -0.53 2.02 0.24 0.95 117.35 119.08 3mfb s TYR 395 Ca 0.13 -0.01 -0.02 0.00 -0.37 0.00 0.00 57.07 56.81 3mfb s TYR 395 Cb 0.00 -1.72 -0.03 0.00 -0.40 0.00 0.00 41.96 39.81 3mfb s TYR 395 CO 0.00 0.30 -0.00 -1.83 -1.57 0.00 0.00 175.55 172.45 3mfb s GLU 396 N -0.73 0.49 -0.06 -0.62 -1.05 0.11 -0.90 118.70 115.94 3mfb s GLU 396 Ca 0.11 -0.90 0.02 0.00 -0.15 0.00 0.00 54.97 54.05 3mfb s GLU 396 Cb -0.11 0.18 0.01 0.00 -0.44 0.00 0.00 34.13 33.77 3mfb s GLU 396 CO 0.02 -0.10 -0.10 0.12 0.95 0.00 0.00 175.26 176.15 3mfb s PHE 397 N -2.73 1.24 -0.22 4.83 5.36 -0.33 -1.08 117.98 125.04 3mfb s PHE 397 Ca -0.04 -0.43 -0.05 0.00 -0.96 0.00 0.00 56.93 55.45 3mfb s PHE 397 Cb -0.01 -0.94 -0.02 0.00 -0.34 0.00 0.00 43.02 41.72 3mfb s PHE 397 CO -0.06 -0.24 0.01 -1.58 -1.46 0.00 0.00 175.22 171.89 3mfb s TRP 398 N 0.67 3.02 0.95 10.12 0.52 -1.26 -0.81 118.94 132.15 3mfb s TRP 398 Ca -0.13 -0.63 -0.12 0.00 0.02 0.00 0.00 56.10 55.24 3mfb s TRP 398 Cb -0.15 -2.14 0.16 0.00 -1.15 0.00 0.00 33.47 30.19 3mfb s TRP 398 CO 0.03 -0.40 1.09 -1.21 0.02 0.00 0.00 176.95 176.48 3mfb s GLU 399 N 1.38 0.85 0.07 4.98 2.02 -1.26 -4.91 118.70 121.83 3mfb s GLU 399 Ca 0.05 0.71 -0.31 0.00 0.02 0.00 0.00 54.97 55.44 3mfb s GLU 399 Cb -0.15 -1.77 -0.09 0.00 0.10 0.00 0.00 34.13 32.23 3mfb s GLU 399 CO 0.00 -2.49 1.71 -1.21 0.02 0.00 0.00 175.26 173.29 3mfb s GLU 400 N -4.92 4.18 0.00 1.61 0.41 -1.26 -2.19 118.70 116.53 3mfb s GLU 400 Ca 0.64 2.40 0.00 0.00 -0.41 0.00 0.00 54.97 57.61 3mfb s GLU 400 Cb -0.18 -3.65 0.00 0.00 -1.78 0.00 0.00 34.13 28.52 3mfb s GLU 400 CO 0.57 -0.78 0.00 0.41 -0.49 0.00 0.00 175.26 174.98 3mfb n GLY 401 N 4.09 0.50 3.79 -1.39 0.00 -1.26 -5.02 105.19 105.89 3mfb n GLY 401 Ca 0.17 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.83 3mfb n GLY 401 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3mfb s ALA 402 N -2.03 3.07 -2.28 4.61 0.00 -0.93 -4.95 121.76 119.26 3mfb s ALA 402 Ca 0.00 0.59 0.22 0.00 0.00 0.00 0.00 51.96 52.77 3mfb s ALA 402 Cb 0.00 -3.23 0.44 0.00 0.00 0.00 0.00 23.12 20.33 3mfb s ALA 402 CO 0.00 -0.08 1.40 0.25 0.00 0.00 0.00 175.76 177.33 3mfb n THR 403 N -0.19 0.59 -3.55 0.00 -2.24 -1.26 -4.95 114.28 102.68 3mfb n THR 403 Ca 0.05 -0.79 -0.09 0.00 -2.27 0.00 0.00 64.05 60.95 3mfb n THR 403 Cb 0.51 0.90 -0.02 0.00 -2.10 0.00 0.00 70.33 69.62 3mfb n THR 403 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 3mfb s GLY 404 N -1.37 -0.45 0.33 3.38 0.00 -1.26 -5.14 107.32 102.81 3mfb s GLY 404 Ca 0.39 0.54 -0.29 0.00 0.00 0.00 0.00 44.72 45.36 3mfb s GLY 404 CO 0.31 0.17 1.35 -1.55 0.00 0.00 0.00 173.10 173.39 3mfb n PRO 405 N -0.35 2.23 -0.09 2.90 -0.04 -1.26 -4.74 135.00 133.65 3mfb n PRO 405 Ca -0.11 0.78 -0.22 0.00 -0.04 0.00 0.00 63.50 63.92 3mfb n PRO 405 Cb 0.63 -2.41 -0.12 0.00 -0.04 0.00 0.00 33.50 31.55 3mfb n PRO 405 CO 0.00 0.00 0.00 2.41 -0.04 0.00 0.00 175.50 177.87 3mfb n THR 406 N 0.70 1.59 -4.72 0.52 -1.04 0.01 -4.67 114.28 106.67 3mfb n THR 406 Ca 0.05 -0.48 -0.25 0.00 -2.04 0.00 0.00 64.05 61.34 3mfb n THR 406 Cb 0.36 -1.69 -0.16 0.00 -1.82 0.00 0.00 70.33 67.02 3mfb n THR 406 CO 0.00 0.00 0.00 -0.63 -0.64 0.00 0.00 175.07 173.80 3mfb s ILE 407 N -2.51 1.26 0.15 12.58 1.01 -1.00 -4.28 121.20 128.42 3mfb s ILE 407 Ca -0.31 -0.62 0.10 0.00 0.00 0.00 0.00 60.65 59.82 3mfb s ILE 407 Cb 0.09 -1.10 -0.04 0.00 0.01 0.00 0.00 42.46 41.42 3mfb s ILE 407 CO 0.63 0.37 -0.22 -0.76 0.00 0.00 0.00 174.94 174.96 3mfb s LEU 408 N 0.12 2.38 -0.21 2.97 1.43 0.15 -1.19 118.68 124.33 3mfb s LEU 408 Ca -0.04 -0.80 -0.04 0.00 -1.03 0.00 0.00 54.13 52.22 3mfb s LEU 408 Cb -0.11 -1.00 0.10 0.00 0.03 0.00 0.00 46.19 45.21 3mfb s LEU 408 CO 0.02 0.07 0.25 0.86 0.23 0.00 0.00 176.35 177.78 3mfb s TRP 409 N -1.57 -0.38 -0.23 0.29 -0.11 -0.08 -1.43 118.94 115.43 3mfb s TRP 409 Ca 0.15 0.31 -0.08 0.00 1.22 0.00 0.00 56.10 57.70 3mfb s TRP 409 Cb -0.08 -0.30 -0.03 0.00 -1.50 0.00 0.00 33.47 31.55 3mfb s TRP 409 CO 0.07 -0.64 0.08 0.99 -4.62 0.00 0.00 176.95 172.83 3mfb s THR 410 N 2.37 4.54 -2.00 5.86 2.01 -1.26 -0.59 115.64 126.56 3mfb s THR 410 Ca 0.08 -0.10 0.03 0.00 0.31 0.00 0.00 61.69 62.01 3mfb s THR 410 Cb -0.16 -3.11 0.09 0.00 0.01 0.00 0.00 72.50 69.33 3mfb s THR 410 CO -0.14 0.36 0.52 -0.81 -0.69 0.00 0.00 174.62 173.86 3mfb n PRO 411 N 4.58 0.17 -0.00 4.92 -0.04 -1.26 -2.17 135.00 141.21 3mfb n PRO 411 Ca -0.16 0.00 -0.07 0.00 -0.04 0.00 0.00 63.50 63.23 3mfb n PRO 411 Cb 0.52 -1.28 -0.13 0.00 -0.04 0.00 0.00 33.50 32.57 3mfb n PRO 411 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 3mfb h ASP 412 N 0.00 0.00 0.00 3.54 3.32 -1.93 -3.41 116.42 117.93 3mfb h ASP 412 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3mfb h ASP 412 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 3mfb h ASP 412 CO 0.00 0.95 0.00 0.59 -1.72 0.00 0.00 179.24 179.06 3mfb n ASN 413 N -3.07 0.00 0.00 6.45 4.13 -0.92 -5.09 115.26 116.75 3mfb n ASN 413 Ca -0.13 0.31 0.00 0.00 1.68 0.00 0.00 54.58 56.43 3mfb n ASN 413 Cb 1.01 -0.42 0.00 0.00 -1.54 0.00 0.00 39.78 38.83 3mfb n ASN 413 CO 0.00 0.00 0.00 -0.81 0.28 0.00 0.00 177.26 176.73 3mfb n PRO 414 N -1.92 3.27 0.00 3.52 -0.04 -1.25 -5.16 135.00 133.42 3mfb n PRO 414 Ca 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 3mfb n PRO 414 Cb 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.46 3mfb n PRO 414 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3mfb n GLY 415 N 5.00 2.62 3.70 0.55 0.00 -1.26 -4.94 105.19 110.86 3mfb n GLY 415 Ca 0.00 -2.13 -0.42 0.00 0.00 0.00 0.00 46.02 43.47 3mfb n GLY 415 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3mfb s ILE 416 N -2.10 4.70 0.02 -0.61 -1.09 -1.26 -4.25 121.20 116.61 3mfb s ILE 416 Ca 0.00 1.94 0.01 0.00 -2.23 0.00 0.00 60.65 60.37 3mfb s ILE 416 Cb 0.00 -4.25 -0.02 0.00 -1.58 0.00 0.00 42.46 36.62 3mfb s ILE 416 CO 0.00 0.11 -0.04 -1.61 -1.23 0.00 0.00 174.94 172.17 3mfb s GLU 417 N 1.29 0.32 0.01 2.79 2.02 -0.52 -5.00 118.70 119.60 3mfb s GLU 417 Ca 0.52 -0.49 0.06 0.00 0.02 0.00 0.00 54.97 55.08 3mfb s GLU 417 Cb -0.22 -0.06 -0.02 0.00 0.10 0.00 0.00 34.13 33.93 3mfb s GLU 417 CO 0.26 -0.00 -0.19 -0.51 0.02 0.00 0.00 175.26 174.84 3mfb s LEU 418 N -1.09 2.08 0.00 1.80 1.02 -1.26 0.31 118.68 121.54 3mfb s LEU 418 Ca -0.10 -0.40 0.16 0.00 0.02 0.00 0.00 54.13 53.81 3mfb s LEU 418 Cb -0.07 -0.93 0.68 0.00 0.02 0.00 0.00 46.19 45.88 3mfb s LEU 418 CO -0.00 0.19 1.50 -0.81 0.02 0.00 0.00 176.35 177.25 3mfb n PRO 419 N 2.35 0.00 -3.32 1.29 -0.04 -1.26 -4.72 135.00 129.29 3mfb n PRO 419 Ca -0.16 0.23 -0.21 0.00 -0.04 0.00 0.00 63.50 63.32 3mfb n PRO 419 Cb 0.54 -1.50 0.02 0.00 -0.04 0.00 0.00 33.50 32.52 3mfb n PRO 419 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 3mfb s THR 420 N -2.99 2.27 -0.68 0.52 -4.23 -1.26 -5.03 115.64 104.23 3mfb s THR 420 Ca 0.08 -1.18 -0.01 0.00 -1.18 0.00 0.00 61.69 59.40 3mfb s THR 420 Cb 0.10 -2.44 0.42 0.00 1.34 0.00 0.00 72.50 71.92 3mfb s THR 420 CO 0.29 0.00 1.92 -0.67 -0.54 0.00 0.00 174.62 175.62 3mfb n ASP 421 N -1.94 7.30 -4.91 3.99 2.03 -1.26 -4.98 116.55 116.77 3mfb n ASP 421 Ca 0.08 -3.80 -0.30 0.00 0.52 0.00 0.00 54.79 51.30 3mfb n ASP 421 Cb 0.62 -0.93 -0.04 0.00 -0.72 0.00 0.00 41.12 40.05 3mfb n ASP 421 CO 0.00 0.00 0.00 0.42 -1.92 0.00 0.00 177.20 175.70 3mfb s THR 422 N -4.91 5.24 0.61 5.18 -4.23 -1.26 -5.08 115.64 111.19 3mfb s THR 422 Ca 0.59 -0.22 -0.16 0.00 -1.18 0.00 0.00 61.69 60.72 3mfb s THR 422 Cb 0.48 -3.66 -0.02 0.00 1.34 0.00 0.00 72.50 70.63 3mfb s THR 422 CO -0.13 -0.01 1.10 0.00 -0.54 0.00 0.00 174.62 175.04 3mfb s ALA 423 N -1.70 2.59 -0.24 3.99 0.00 -1.26 -4.87 121.76 120.28 3mfb s ALA 423 Ca 0.39 0.57 -0.22 0.00 0.00 0.00 0.00 51.96 52.70 3mfb s ALA 423 Cb -0.12 -3.31 0.06 0.00 0.00 0.00 0.00 23.12 19.76 3mfb s ALA 423 CO 0.27 -1.03 0.64 -3.38 0.00 0.00 0.00 175.76 172.26 3mfb s HIS 424 N -2.23 -0.70 0.15 0.00 -3.43 -1.26 -1.64 115.29 106.18 3mfb s HIS 424 Ca 0.67 1.70 0.06 0.00 -0.80 0.00 0.00 55.06 56.70 3mfb s HIS 424 Cb -0.20 0.24 -0.04 0.00 -1.43 0.00 0.00 32.58 31.15 3mfb s HIS 424 CO 0.37 -0.34 -0.14 0.20 -2.00 0.00 0.00 174.74 172.83 3mfb s GLY 425 N 0.33 1.17 0.14 -1.38 0.00 -0.71 -4.99 107.32 101.89 3mfb s GLY 425 Ca -0.00 -1.42 -0.24 0.00 0.00 0.00 0.00 44.72 43.07 3mfb s GLY 425 CO 0.01 -1.49 0.64 -1.83 0.00 0.00 0.00 173.10 170.43 3mfb s GLU 426 N -3.05 1.24 -0.28 2.90 1.03 -1.26 -1.74 118.70 117.54 3mfb s GLU 426 Ca 0.13 -0.46 -0.20 0.00 0.03 0.00 0.00 54.97 54.47 3mfb s GLU 426 Cb -0.03 0.57 0.09 0.00 -0.80 0.00 0.00 34.13 33.96 3mfb s GLU 426 CO 0.04 -0.54 0.77 -1.14 -1.33 0.00 0.00 175.26 173.05 3mfb s GLN 427 N -3.68 0.69 0.54 -4.83 2.00 -0.69 -5.00 119.66 108.70 3mfb s GLN 427 Ca 0.02 1.03 -0.22 0.00 -2.00 0.00 0.00 55.36 54.19 3mfb s GLN 427 Cb -0.01 0.23 -0.05 0.00 0.80 0.00 0.00 33.01 33.98 3mfb s GLN 427 CO -0.12 -0.12 1.34 -2.30 -0.50 0.00 0.00 175.29 173.59 3mfb n PRO 428 N 3.51 1.67 -2.61 1.67 -0.02 -1.26 -1.77 135.00 136.20 3mfb n PRO 428 Ca -0.17 0.62 -0.33 0.00 -2.02 0.00 0.00 63.50 61.59 3mfb n PRO 428 Cb 0.57 -2.55 -0.05 0.00 -0.02 0.00 0.00 33.50 31.46 3mfb n PRO 428 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 3mfb s VAL 429 N -1.29 4.05 -0.11 -1.45 1.01 -0.19 -4.64 120.40 117.78 3mfb s VAL 429 Ca 0.71 1.25 -0.30 0.00 0.00 0.00 0.00 61.98 63.64 3mfb s VAL 429 Cb -0.42 -3.52 -0.03 0.00 0.00 0.00 0.00 36.38 32.41 3mfb s VAL 429 CO 0.50 -0.31 1.34 -0.63 0.00 0.00 0.00 175.10 176.00 3mfb s ILE 430 N -2.11 4.09 0.15 2.22 1.01 0.17 -4.85 121.20 121.88 3mfb s ILE 430 Ca 0.65 1.36 -0.34 0.00 0.00 0.00 0.00 60.65 62.31 3mfb s ILE 430 Cb -0.13 -3.87 -0.14 0.00 0.01 0.00 0.00 42.46 38.33 3mfb s ILE 430 CO 0.19 -0.09 1.58 -2.65 0.00 0.00 0.00 174.94 173.97 3mfb n PRO 431 N 6.36 2.11 -4.20 2.79 -0.02 -1.26 -3.38 135.00 137.41 3mfb n PRO 431 Ca 0.14 0.76 -0.36 0.00 -2.02 0.00 0.00 63.50 62.02 3mfb n PRO 431 Cb 0.45 -2.53 -0.05 0.00 -0.02 0.00 0.00 33.50 31.34 3mfb n PRO 431 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 3mfb n SER 432 N 3.54 -0.96 -4.97 2.55 7.64 -1.25 -4.95 113.62 115.23 3mfb n SER 432 Ca 0.17 -1.26 -0.21 0.00 1.01 0.00 0.00 58.87 58.58 3mfb n SER 432 Cb 0.28 -1.78 0.04 0.00 -1.01 0.00 0.00 64.21 61.74 3mfb n SER 432 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3mfb s ALA 433 N -4.05 3.88 0.17 -0.43 0.00 -1.22 -4.60 121.76 115.52 3mfb s ALA 433 Ca 0.17 -1.33 -0.31 0.00 0.00 0.00 0.00 51.96 50.49 3mfb s ALA 433 Cb -0.09 -2.08 -0.09 0.00 0.00 0.00 0.00 23.12 20.85 3mfb s ALA 433 CO 0.98 -0.78 1.47 0.42 0.00 0.00 0.00 175.76 177.85 3mfb s ILE 434 N -2.78 2.85 -0.28 0.00 -1.09 -1.26 -1.56 121.20 117.07 3mfb s ILE 434 Ca 0.58 0.64 -0.38 0.00 -2.23 0.00 0.00 60.65 59.25 3mfb s ILE 434 Cb -0.10 -3.41 -0.14 0.00 -1.58 0.00 0.00 42.46 37.23 3mfb s ILE 434 CO 0.39 0.07 1.93 -2.65 -1.23 0.00 0.00 174.94 173.44 3mfb n PRO 435 N 3.47 1.26 0.00 2.79 -0.02 -1.26 -0.37 135.00 140.87 3mfb n PRO 435 Ca 0.11 0.43 0.00 0.00 -2.02 0.00 0.00 63.50 62.02 3mfb n PRO 435 Cb 0.40 -2.29 0.00 0.00 -0.02 0.00 0.00 33.50 31.59 3mfb n PRO 435 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3mfb n GLY 436 N 5.12 1.77 0.03 -1.23 0.00 -1.22 -4.92 105.19 104.73 3mfb n GLY 436 Ca 0.32 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.37 3mfb n GLY 436 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3mfb n LEU 437 N 0.00 2.10 0.19 0.99 4.77 0.50 -1.06 117.00 124.49 3mfb n LEU 437 Ca 0.00 -2.38 0.14 0.00 -0.03 0.00 0.00 56.01 53.74 3mfb n LEU 437 Cb 0.00 -0.16 0.49 0.00 -2.33 0.00 0.00 43.42 41.42 3mfb n LEU 437 CO 0.00 0.57 0.90 1.05 -1.33 0.00 0.00 177.39 178.58 3mfb h GLU 438 N 0.00 0.00 -4.62 3.23 9.09 -1.87 -3.42 114.58 116.99 3mfb h GLU 438 Ca 0.00 0.00 -0.70 0.00 0.05 0.00 0.00 59.36 58.71 3mfb h GLU 438 Cb 0.70 0.00 -0.24 0.00 -1.65 0.00 0.00 28.75 27.56 3mfb h GLU 438 CO 0.00 0.00 -0.51 0.42 0.05 0.00 0.00 179.01 178.97 3mfb s ILE 439 N -3.38 4.67 0.50 -1.06 1.01 -1.26 0.46 121.20 122.13 3mfb s ILE 439 Ca 0.05 -0.74 -0.21 0.00 0.00 0.00 0.00 60.65 59.75 3mfb s ILE 439 Cb 0.09 -3.56 -0.07 0.00 0.01 0.00 0.00 42.46 38.93 3mfb s ILE 439 CO 0.52 -0.18 1.12 -2.16 0.00 0.00 0.00 174.94 174.25 3mfb s PRO 440 N 1.58 3.60 0.00 2.79 0.04 -1.26 -4.84 135.00 136.92 3mfb s PRO 440 Ca 0.03 1.62 0.00 0.00 0.04 0.00 0.00 61.00 62.69 3mfb s PRO 440 Cb -0.19 -2.18 0.00 0.00 0.04 0.00 0.00 34.50 32.17 3mfb s PRO 440 CO 0.07 -0.64 0.00 0.39 0.04 0.00 0.00 177.00 176.86 3mfb n GLU 441 N -0.91 2.90 -5.03 4.56 1.02 -1.26 -5.04 120.64 116.88 3mfb n GLU 441 Ca 0.09 0.00 -0.27 0.00 -0.02 0.00 0.00 57.16 56.96 3mfb n GLU 441 Cb 0.50 0.00 -0.16 0.00 -0.02 0.00 0.00 31.44 31.77 3mfb n GLU 441 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 3mfb s ASP 443 N -1.41 2.47 -1.51 1.62 2.15 -1.26 -5.01 116.67 113.72 3mfb s ASP 443 Ca 0.00 -0.38 -0.06 0.00 0.43 0.00 0.00 52.55 52.54 3mfb s ASP 443 Cb 0.00 -0.28 0.02 0.00 -0.30 0.00 0.00 42.92 42.36 3mfb s ASP 443 CO 0.00 0.26 0.61 -0.67 -0.17 0.00 0.00 175.17 175.20 3mfb n ASP 444 N 2.55 -5.76 -3.88 -0.34 2.03 -1.26 -4.96 116.55 104.92 3mfb n ASP 444 Ca -0.15 -0.31 -0.29 0.00 0.52 0.00 0.00 54.79 54.55 3mfb n ASP 444 Cb 0.53 -4.66 -0.16 0.00 -0.72 0.00 0.00 41.12 36.10 3mfb n ASP 444 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 3mfb s VAL 445 N -3.15 1.20 0.32 5.18 1.01 -1.26 -5.08 120.40 118.62 3mfb s VAL 445 Ca 0.33 -0.90 -0.29 0.00 0.00 0.00 0.00 61.98 61.13 3mfb s VAL 445 Cb -0.15 -1.48 -0.10 0.00 0.00 0.00 0.00 36.38 34.65 3mfb s VAL 445 CO 0.41 -0.04 1.34 -0.55 0.00 0.00 0.00 175.10 176.26 3mfb s SER 446 N 1.56 6.71 -0.33 3.32 0.15 -1.26 -4.75 113.70 119.11 3mfb s SER 446 Ca -0.03 2.72 -0.11 0.00 0.70 0.00 0.00 55.95 59.24 3mfb s SER 446 Cb -0.17 -2.65 -0.00 0.00 -1.71 0.00 0.00 66.02 61.48 3mfb s SER 446 CO -0.07 -0.59 0.19 -0.63 1.20 0.00 0.00 173.24 173.33 3mfb s ILE 447 N -0.98 4.79 0.25 6.45 1.01 -1.26 -1.58 121.20 129.88 3mfb s ILE 447 Ca 0.51 -0.43 -0.22 0.00 0.00 0.00 0.00 60.65 60.51 3mfb s ILE 447 Cb -0.41 -3.48 -0.09 0.00 0.01 0.00 0.00 42.46 38.49 3mfb s ILE 447 CO 0.53 0.00 0.80 -0.76 0.00 0.00 0.00 174.94 175.51 3mfb s LEU 448 N 1.64 4.37 -0.82 2.97 1.43 -0.76 -4.95 118.68 122.56 3mfb s LEU 448 Ca 0.05 1.58 -0.01 0.00 -1.03 0.00 0.00 54.13 54.72 3mfb s LEU 448 Cb -0.17 -3.68 0.36 0.00 0.03 0.00 0.00 46.19 42.72 3mfb s LEU 448 CO 0.07 0.02 1.90 0.00 0.23 0.00 0.00 176.35 178.58 3mfb n ALA 449 N 0.78 6.31 -2.39 4.21 0.00 -1.26 -4.53 120.51 123.63 3mfb n ALA 449 Ca -0.01 -4.19 -0.21 0.00 0.00 0.00 0.00 53.44 49.03 3mfb n ALA 449 Cb 0.50 -1.84 -0.03 0.00 0.00 0.00 0.00 19.45 18.08 3mfb n ALA 449 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 3mfb s THR 450 N -5.06 3.23 0.00 0.00 -1.32 -1.26 -5.17 115.64 106.06 3mfb s THR 450 Ca 0.50 -1.35 0.00 0.00 -1.21 0.00 0.00 61.69 59.64 3mfb s THR 450 Cb 0.41 -3.12 0.00 0.00 -1.51 0.00 0.00 72.50 68.28 3mfb s THR 450 CO -0.37 -0.11 0.00 -0.81 -2.21 0.00 0.00 174.62 171.12 3mfb n PRO 451 N -1.45 0.00 -4.44 7.08 -0.04 -1.26 -5.00 135.00 129.89 3mfb n PRO 451 Ca 0.00 0.00 -0.22 0.00 -0.04 0.00 0.00 63.50 63.24 3mfb n PRO 451 Cb 0.60 0.00 -0.10 0.00 -0.04 0.00 0.00 33.50 33.96 3mfb n PRO 451 CO 0.00 0.00 0.00 -2.14 -0.04 0.00 0.00 175.50 173.32 3mfb s PRO 453 N 0.00 1.59 0.40 0.54 0.02 -1.26 -5.17 135.00 131.12 3mfb s PRO 453 Ca 0.00 -1.76 -0.26 0.00 0.02 0.00 0.00 61.00 59.00 3mfb s PRO 453 Cb 0.00 -1.48 -0.09 0.00 0.02 0.00 0.00 34.50 32.96 3mfb s PRO 453 CO 0.00 0.20 1.26 -0.51 -0.33 0.00 0.00 177.00 177.62 3mfb s ASP 454 N -3.47 6.40 0.52 2.53 1.01 -1.26 -4.88 116.67 117.53 3mfb s ASP 454 Ca 0.28 2.56 0.33 0.00 0.71 0.00 0.00 52.55 56.44 3mfb s ASP 454 Cb -0.01 -2.63 1.49 0.00 1.01 0.00 0.00 42.92 42.77 3mfb s ASP 454 CO 0.13 -0.78 1.82 -0.08 0.21 0.00 0.00 175.17 176.46 3mfb h GLU 455 N 2.71 0.05 -0.11 8.23 4.57 -2.00 0.20 114.58 128.23 3mfb h GLU 455 Ca -0.49 -0.00 0.03 0.00 -1.18 0.00 0.00 59.36 57.72 3mfb h GLU 455 Cb 1.24 -0.01 -0.00 0.00 -0.16 0.00 0.00 28.75 29.82 3mfb h GLU 455 CO 0.63 0.03 0.12 0.87 -1.18 0.00 0.00 179.01 179.48 3mfb h LYS 456 N 0.05 0.00 -0.21 1.92 6.56 -2.07 -0.69 116.57 122.13 3mfb h LYS 456 Ca 0.54 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 60.13 3mfb h LYS 456 Cb 2.06 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 33.72 3mfb h LYS 456 CO -0.04 0.00 0.00 -0.25 -2.06 0.00 0.00 179.45 177.10 3mfb n ASP 457 N -3.83 2.14 -4.59 0.86 8.00 0.71 -4.84 116.55 114.99 3mfb n ASP 457 Ca -0.00 -1.79 -0.34 0.00 0.71 0.00 0.00 54.79 53.37 3mfb n ASP 457 Cb 0.23 -0.13 -0.11 0.00 -0.02 0.00 0.00 41.12 41.08 3mfb n ASP 457 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 3mfb s PHE 458 N -1.73 2.99 -0.42 1.24 0.40 -0.27 -4.75 117.98 115.44 3mfb s PHE 458 Ca 0.34 0.00 0.07 0.00 -0.60 0.00 0.00 56.93 56.74 3mfb s PHE 458 Cb 0.19 -1.76 0.24 0.00 0.51 0.00 0.00 43.02 42.20 3mfb s PHE 458 CO 0.28 0.30 0.61 -2.13 0.70 0.00 0.00 175.22 174.98 3mfb n ARG 459 N 2.40 0.69 -4.49 0.44 0.63 -1.26 -5.00 116.66 110.08 3mfb n ARG 459 Ca -0.18 -2.80 -0.24 0.00 -0.92 0.00 0.00 57.85 53.71 3mfb n ARG 459 Cb 0.53 -1.31 -0.10 0.00 0.45 0.00 0.00 32.46 32.03 3mfb n ARG 459 CO 0.00 0.00 0.00 0.16 -2.51 0.00 0.00 177.63 175.28 3mfb s ASP 460 N -1.20 3.54 0.17 6.15 -4.77 -1.26 -0.69 116.67 118.61 3mfb s ASP 460 Ca 0.34 -1.10 -0.16 0.00 -3.30 0.00 0.00 52.55 48.33 3mfb s ASP 460 Cb 0.17 -0.30 0.03 0.00 -1.09 0.00 0.00 42.92 41.73 3mfb s ASP 460 CO -0.15 -0.07 0.47 -0.31 0.70 0.00 0.00 175.17 175.80 3mfb s TYR 461 N -2.60 -0.08 -0.22 2.11 2.02 0.10 -4.46 117.35 114.21 3mfb s TYR 461 Ca 0.30 -0.25 0.02 0.00 -0.37 0.00 0.00 57.07 56.77 3mfb s TYR 461 Cb -0.02 0.31 0.04 0.00 -0.40 0.00 0.00 41.96 41.89 3mfb s TYR 461 CO 0.15 -0.84 -0.15 0.42 -1.57 0.00 0.00 175.55 173.56 3mfb s ILE 462 N -3.87 2.17 -0.21 2.71 1.01 0.03 -0.85 121.20 122.20 3mfb s ILE 462 Ca 0.09 -1.30 -0.12 0.00 0.00 0.00 0.00 60.65 59.31 3mfb s ILE 462 Cb 0.00 -2.11 -0.05 0.00 0.01 0.00 0.00 42.46 40.31 3mfb s ILE 462 CO -0.05 0.23 0.24 -0.76 0.00 0.00 0.00 174.94 174.61 3mfb s LEU 463 N 1.20 4.16 -0.12 2.97 1.43 0.26 -0.90 118.68 127.69 3mfb s LEU 463 Ca -0.02 0.31 -0.03 0.00 -1.03 0.00 0.00 54.13 53.36 3mfb s LEU 463 Cb -0.17 -2.26 -0.03 0.00 0.03 0.00 0.00 46.19 43.76 3mfb s LEU 463 CO -0.08 0.05 0.00 -0.69 0.23 0.00 0.00 176.35 175.86 3mfb s VAL 464 N 0.91 4.31 0.28 -1.59 1.01 0.65 -1.98 120.40 123.99 3mfb s VAL 464 Ca 0.12 -0.23 -0.14 0.00 0.00 0.00 0.00 61.98 61.74 3mfb s VAL 464 Cb -0.13 -2.85 -0.08 0.00 0.00 0.00 0.00 36.38 33.31 3mfb s VAL 464 CO 0.04 0.56 0.67 -0.36 0.00 0.00 0.00 175.10 176.01 3mfb s PHE 465 N -0.42 3.42 0.00 5.22 0.08 -1.26 0.64 117.98 125.66 3mfb s PHE 465 Ca 0.08 1.12 0.00 0.00 0.12 0.00 0.00 56.93 58.25 3mfb s PHE 465 Cb -0.12 -2.45 0.00 0.00 -0.57 0.00 0.00 43.02 39.88 3mfb s PHE 465 CO 0.02 0.18 0.84 -0.35 -0.10 0.00 0.00 175.22 175.81 3mfb n PRO 466 N -0.16 0.00 -1.11 0.24 -0.04 -1.26 -2.85 135.00 129.82 3mfb n PRO 466 Ca 0.02 0.67 -0.13 0.00 -0.04 0.00 0.00 63.50 64.02 3mfb n PRO 466 Cb 0.53 -1.34 0.26 0.00 -0.04 0.00 0.00 33.50 32.91 3mfb n PRO 466 CO 0.00 0.00 0.00 -0.85 -0.04 0.00 0.00 175.50 174.61 3mfb n GLU 467 N -2.06 3.24 -2.47 0.54 0.28 -1.26 -4.86 120.64 114.05 3mfb n GLU 467 Ca 0.00 -3.07 -0.18 0.00 -0.16 0.00 0.00 57.16 53.75 3mfb n GLU 467 Cb 0.00 -2.22 0.00 0.00 1.43 0.00 0.00 31.44 30.66 3mfb n GLU 467 CO 0.00 0.00 0.00 0.09 -0.16 0.00 0.00 177.13 177.06 3mfb n ASN 468 N -0.50 -5.25 0.30 -1.84 5.03 -1.13 -4.81 115.26 107.06 3mfb n ASN 468 Ca 0.48 -0.07 0.18 0.00 0.87 0.00 0.00 54.58 56.04 3mfb n ASN 468 Cb 1.51 -4.27 0.94 0.00 -1.02 0.00 0.00 39.78 36.93 3mfb n ASN 468 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 3mfb h ALA 469 N 0.85 1.37 -2.73 5.41 0.00 -1.89 -3.40 119.26 118.87 3mfb h ALA 469 Ca -0.43 -0.00 -0.14 0.00 0.00 0.00 0.00 54.91 54.34 3mfb h ALA 469 Cb 1.31 0.00 -0.20 0.00 0.00 0.00 0.00 17.79 18.91 3mfb h ALA 469 CO 0.49 -0.24 -0.52 -0.06 0.00 0.00 0.00 179.25 178.92 3mfb s PHE 470 N -4.24 0.12 0.53 0.00 0.08 -1.26 -5.15 117.98 108.04 3mfb s PHE 470 Ca -0.04 -0.29 -0.20 0.00 0.12 0.00 0.00 56.93 56.51 3mfb s PHE 470 Cb 0.12 -0.09 -0.06 0.00 -0.57 0.00 0.00 43.02 42.41 3mfb s PHE 470 CO 0.38 -0.30 1.13 -1.25 -0.10 0.00 0.00 175.22 175.08 3mfb s PRO 471 N -1.77 3.45 0.41 0.24 0.04 -1.26 -4.47 135.00 131.63 3mfb s PRO 471 Ca -0.12 1.63 -0.25 0.00 0.04 0.00 0.00 61.00 62.30 3mfb s PRO 471 Cb -0.06 -2.08 -0.10 0.00 0.04 0.00 0.00 34.50 32.30 3mfb s PRO 471 CO -0.01 -0.78 1.17 -0.35 0.04 0.00 0.00 177.00 177.08 3mfb n PRO 472 N -1.14 1.71 -4.38 0.56 -0.04 -1.26 -4.86 135.00 125.59 3mfb n PRO 472 Ca 0.11 0.61 -0.20 0.00 -0.04 0.00 0.00 63.50 63.97 3mfb n PRO 472 Cb 0.50 -2.24 -0.15 0.00 -0.04 0.00 0.00 33.50 31.57 3mfb n PRO 472 CO 0.00 0.00 0.00 -1.50 -0.04 0.00 0.00 175.50 173.96 3mfb s ILE 473 N -1.21 0.77 -0.06 0.52 2.07 -0.84 -1.03 121.20 121.43 3mfb s ILE 473 Ca 0.61 -0.36 -0.19 0.00 -1.41 0.00 0.00 60.65 59.31 3mfb s ILE 473 Cb -0.54 -0.69 -0.05 0.00 0.13 0.00 0.00 42.46 41.32 3mfb s ILE 473 CO 0.58 0.24 0.53 -0.47 -1.91 0.00 0.00 174.94 173.91 3mfb s TYR 474 N 0.19 3.60 -0.00 3.50 5.04 -0.73 -0.57 117.35 128.38 3mfb s TYR 474 Ca -0.03 1.04 0.01 0.00 -2.44 0.00 0.00 57.07 55.65 3mfb s TYR 474 Cb -0.08 -2.56 -0.00 0.00 0.35 0.00 0.00 41.96 39.66 3mfb s TYR 474 CO 0.00 0.28 -0.03 0.54 -1.34 0.00 0.00 175.55 175.01 3mfb s VAL 475 N 0.14 0.23 -0.10 3.14 0.11 -0.02 -1.70 120.40 122.20 3mfb s VAL 475 Ca 0.28 -0.12 0.01 0.00 -2.93 0.00 0.00 61.98 59.23 3mfb s VAL 475 Cb -0.17 -0.20 0.02 0.00 -1.53 0.00 0.00 36.38 34.50 3mfb s VAL 475 CO 0.14 0.07 -0.12 -0.72 -3.33 0.00 0.00 175.10 171.13 3mfb s TYR 476 N -0.03 1.71 0.24 1.54 -0.85 -0.71 -0.72 117.35 118.54 3mfb s TYR 476 Ca 0.01 -0.78 0.07 0.00 -0.52 0.00 0.00 57.07 55.85 3mfb s TYR 476 Cb -0.02 -1.28 -0.04 0.00 0.38 0.00 0.00 41.96 41.00 3mfb s TYR 476 CO -0.00 -0.43 0.13 -0.51 -1.52 0.00 0.00 175.55 173.21 3mfb s LEU 477 N 1.08 3.63 0.76 -3.49 1.43 0.13 -1.74 118.68 120.48 3mfb s LEU 477 Ca -0.06 -0.34 -0.11 0.00 -1.03 0.00 0.00 54.13 52.59 3mfb s LEU 477 Cb -0.15 -2.17 0.05 0.00 0.03 0.00 0.00 46.19 43.95 3mfb s LEU 477 CO -0.02 -0.01 1.08 -0.94 0.23 0.00 0.00 176.35 176.69 3mfb s SER 478 N -3.65 4.76 0.40 2.29 1.04 -0.65 -4.35 113.70 113.55 3mfb s SER 478 Ca 0.32 1.55 -0.25 0.00 0.48 0.00 0.00 55.95 58.06 3mfb s SER 478 Cb -0.08 -2.34 -0.11 0.00 0.10 0.00 0.00 66.02 63.60 3mfb s SER 478 CO 0.23 -1.83 0.98 1.17 0.98 0.00 0.00 173.24 174.77 3mfb n LYS 479 N -3.37 1.31 0.00 4.02 4.81 -1.26 -4.85 118.16 118.81 3mfb n LYS 479 Ca 0.08 0.47 0.12 0.00 -0.87 0.00 0.00 58.31 58.10 3mfb n LYS 479 Cb 0.54 -1.98 0.69 0.00 0.02 0.00 0.00 35.03 34.30 3mfb n LYS 479 CO 0.00 0.00 0.00 -0.11 1.17 0.00 0.00 177.40 178.46