#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 8.29 -4.57 2.23 7.94 -0.60 -4.77 117.00 125.52 3mfb n LEU 333 Ca 0.00 -4.33 -0.28 0.00 -1.11 0.00 0.00 56.01 50.28 3mfb n LEU 333 Cb 0.00 -1.51 0.22 0.00 0.53 0.00 0.00 43.42 42.66 3mfb n LEU 333 CO 0.00 2.03 0.57 0.42 -1.11 0.00 0.00 177.39 179.31 3mfb s THR 334 N 1.45 1.98 0.49 1.96 -4.23 -1.26 -3.73 115.64 112.29 3mfb s THR 334 Ca 0.67 0.00 0.13 0.00 -1.18 0.00 0.00 61.69 61.31 3mfb s THR 334 Cb 0.20 -2.29 0.27 0.00 1.34 0.00 0.00 72.50 72.02 3mfb s THR 334 CO -0.06 0.00 2.12 -0.65 -0.54 0.00 0.00 174.62 175.49 3mfb h PRO 335 N -2.33 0.16 -0.32 3.99 0.11 -1.99 -0.72 132.00 130.90 3mfb h PRO 335 Ca -0.58 -0.01 -0.11 0.00 0.11 0.00 0.00 66.00 65.41 3mfb h PRO 335 Cb 1.34 -0.04 -0.01 0.00 0.11 0.00 0.00 31.00 32.40 3mfb h PRO 335 CO 0.54 0.10 -0.22 0.93 -0.21 0.00 0.00 178.00 179.14 3mfb h GLU 336 N 0.16 0.71 -0.42 1.05 4.39 -1.96 -1.61 114.58 116.90 3mfb h GLU 336 Ca 0.04 -0.34 -0.06 0.00 0.34 0.00 0.00 59.36 59.34 3mfb h GLU 336 Cb -0.02 -0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 28.61 3mfb h GLU 336 CO -0.01 0.95 0.01 0.87 -1.16 0.00 0.00 179.01 179.67 3mfb h LYS 337 N 0.47 0.73 -0.27 2.33 1.79 -1.65 -0.78 116.57 119.19 3mfb h LYS 337 Ca 0.06 -0.23 -0.03 0.00 -2.18 0.00 0.00 60.65 58.28 3mfb h LYS 337 Cb 0.77 -0.07 -0.01 0.00 -1.58 0.00 0.00 32.23 31.33 3mfb h LYS 337 CO 0.06 0.80 0.04 -0.07 -1.08 0.00 0.00 179.45 179.20 3mfb h LEU 338 N 0.57 0.35 -0.56 2.94 3.38 -1.12 -1.01 115.31 119.87 3mfb h LEU 338 Ca 0.12 -0.05 -0.16 0.00 0.09 0.00 0.00 57.88 57.89 3mfb h LEU 338 Cb 0.46 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.11 3mfb h LEU 338 CO 0.02 0.39 -0.63 0.25 0.09 0.00 0.00 178.44 178.55 3mfb h LEU 339 N 0.38 0.37 -0.87 1.67 5.85 -0.97 -0.23 115.31 121.52 3mfb h LEU 339 Ca 0.09 -0.22 -0.05 0.00 0.84 0.00 0.00 57.88 58.54 3mfb h LEU 339 Cb 0.20 -0.11 -0.03 0.00 0.37 0.00 0.00 40.66 41.09 3mfb h LEU 339 CO 0.00 0.91 0.24 -0.08 -0.34 0.00 0.00 178.44 179.17 3mfb h GLU 340 N 0.24 1.07 -0.15 1.25 4.81 0.08 0.10 114.58 121.99 3mfb h GLU 340 Ca -0.01 -0.21 -0.22 0.00 -0.13 0.00 0.00 59.36 58.79 3mfb h GLU 340 Cb 1.17 -0.17 0.01 0.00 0.63 0.00 0.00 28.75 30.39 3mfb h GLU 340 CO 0.10 0.90 -0.75 0.00 -0.73 0.00 0.00 179.01 178.54 3mfb h ALA 341 N 1.22 0.29 -0.34 2.92 0.00 -1.00 -3.28 119.26 119.07 3mfb h ALA 341 Ca 0.23 -0.59 -0.08 0.00 0.00 0.00 0.00 54.91 54.47 3mfb h ALA 341 Cb 0.26 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 3mfb h ALA 341 CO -0.01 0.65 -0.12 0.00 0.00 0.00 0.00 179.25 179.77 3mfb h ALA 342 N 0.54 0.47 -0.26 0.00 0.00 -0.83 0.56 119.26 119.74 3mfb h ALA 342 Ca -0.05 -0.32 0.08 0.00 0.00 0.00 0.00 54.91 54.62 3mfb h ALA 342 Cb 1.38 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 19.04 3mfb h ALA 342 CO 0.15 0.34 0.24 -0.91 0.00 0.00 0.00 179.25 179.08 3mfb h ASN 343 N 0.45 0.00 -0.30 0.00 2.35 -1.06 -1.22 115.58 115.81 3mfb h ASN 343 Ca 0.08 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.83 3mfb h ASN 343 Cb 0.63 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.00 3mfb h ASN 343 CO 0.04 0.00 0.00 2.29 -1.65 0.00 0.00 177.43 178.11 3mfb n LYS 344 N -4.02 3.08 -3.78 0.81 2.85 -1.16 -4.95 118.16 110.99 3mfb n LYS 344 Ca 0.03 -2.78 -0.27 0.00 -1.05 0.00 0.00 58.31 54.24 3mfb n LYS 344 Cb 0.38 -1.82 0.05 0.00 -0.65 0.00 0.00 35.03 32.99 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 -0.28 -6.30 0.00 -1.58 1.13 -0.46 -4.97 117.38 104.91 3mfb n GLN 345 Ca 0.21 0.68 0.00 0.00 -1.94 0.00 0.00 57.00 55.95 3mfb n GLN 345 Cb 0.87 -5.60 0.00 0.00 0.11 0.00 0.00 30.24 25.61 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 -1.77 0.95 3.36 1.08 0.00 0.19 -4.87 105.19 104.13 3mfb n GLY 346 Ca -0.01 -1.86 -0.14 0.00 0.00 0.00 0.00 46.02 44.01 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 1.29 0.00 -0.06 2.61 -4.23 -1.26 -1.39 115.64 112.59 3mfb s THR 347 Ca 0.00 -1.81 -0.09 0.00 -1.18 0.00 0.00 61.69 58.62 3mfb s THR 347 Cb 0.00 -2.50 0.02 0.00 1.34 0.00 0.00 72.50 71.36 3mfb s THR 347 CO 0.00 0.00 0.22 0.68 -0.54 0.00 0.00 174.62 174.98 3mfb s VAL 348 N -3.65 0.02 0.76 2.29 -7.23 -0.45 -4.88 120.40 107.26 3mfb s VAL 348 Ca 0.35 -0.19 -0.13 0.00 -1.81 0.00 0.00 61.98 60.20 3mfb s VAL 348 Cb 0.03 -0.38 0.05 0.00 0.56 0.00 0.00 36.38 36.64 3mfb s VAL 348 CO 0.18 -0.10 1.14 -2.16 -0.31 0.00 0.00 175.10 173.85 3mfb s PRO 349 N -0.33 2.13 -0.22 4.82 0.04 -1.26 -0.57 135.00 139.61 3mfb s PRO 349 Ca -0.04 1.48 -0.12 0.00 0.04 0.00 0.00 61.00 62.36 3mfb s PRO 349 Cb -0.03 -1.86 0.07 0.00 0.04 0.00 0.00 34.50 32.72 3mfb s PRO 349 CO 0.01 -1.78 0.53 0.45 0.04 0.00 0.00 177.00 176.25 3mfb s SER 350 N -2.62 -0.70 0.58 6.66 0.15 0.93 -3.47 113.70 115.23 3mfb s SER 350 Ca 0.68 1.16 0.37 0.00 0.70 0.00 0.00 55.95 58.85 3mfb s SER 350 Cb -0.23 1.04 1.69 0.00 -1.71 0.00 0.00 66.02 66.81 3mfb s SER 350 CO 0.49 -0.21 2.09 -0.09 1.20 0.00 0.00 173.24 176.72 3mfb h ARG 351 N 7.09 0.00 -3.91 5.44 2.43 -1.39 -3.42 114.38 120.61 3mfb h ARG 351 Ca -0.34 0.00 -0.24 0.00 -0.81 0.00 0.00 59.98 58.59 3mfb h ARG 351 Cb 1.20 0.00 -0.27 0.00 -0.42 0.00 0.00 29.97 30.49 3mfb h ARG 351 CO 0.24 0.00 -0.72 0.54 -1.51 0.00 0.00 179.97 178.51 3mfb s VAL 352 N -3.80 0.12 0.05 0.20 0.11 -1.26 -0.79 120.40 115.03 3mfb s VAL 352 Ca -0.01 -0.23 0.03 0.00 -2.93 0.00 0.00 61.98 58.84 3mfb s VAL 352 Cb 0.10 -0.14 -0.03 0.00 -1.53 0.00 0.00 36.38 34.79 3mfb s VAL 352 CO 0.49 -0.08 -0.10 -0.13 -3.33 0.00 0.00 175.10 171.95 3mfb s ARG 353 N -0.33 0.64 0.23 1.54 0.52 -0.71 -4.94 118.95 115.91 3mfb s ARG 353 Ca -0.03 -0.84 0.11 0.00 -0.52 0.00 0.00 55.73 54.45 3mfb s ARG 353 Cb -0.02 -0.50 -0.05 0.00 0.52 0.00 0.00 34.95 34.90 3mfb s ARG 353 CO -0.00 0.10 -0.19 0.71 0.02 0.00 0.00 175.30 175.94 3mfb s TYR 354 N -1.37 2.36 0.11 -0.53 1.51 -1.26 -0.60 117.35 117.57 3mfb s TYR 354 Ca -0.07 -0.32 -0.15 0.00 -1.01 0.00 0.00 57.07 55.52 3mfb s TYR 354 Cb -0.10 -1.09 0.03 0.00 -0.11 0.00 0.00 41.96 40.69 3mfb s TYR 354 CO 0.01 0.61 0.38 -1.14 -1.11 0.00 0.00 175.55 174.29 3mfb s GLN 355 N -3.13 1.03 0.50 -0.62 0.74 0.16 -4.71 119.66 113.63 3mfb s GLN 355 Ca 0.26 -0.71 0.07 0.00 0.05 0.00 0.00 55.36 55.03 3mfb s GLN 355 Cb -0.07 0.45 0.02 0.00 1.10 0.00 0.00 33.01 34.52 3mfb s GLN 355 CO 0.13 -0.39 0.47 -1.58 -0.55 0.00 0.00 175.29 173.37 3mfb s TRP 356 N -3.69 2.04 -0.25 1.67 0.52 -1.26 -1.28 118.94 116.69 3mfb s TRP 356 Ca 0.02 -0.67 -0.26 0.00 0.02 0.00 0.00 56.10 55.21 3mfb s TRP 356 Cb 0.02 -2.08 0.09 0.00 -1.15 0.00 0.00 33.47 30.35 3mfb s TRP 356 CO -0.11 -0.45 0.81 -2.00 0.02 0.00 0.00 176.95 175.22 3mfb s GLU 358 N -4.29 0.76 -0.53 4.98 2.12 -1.26 -4.61 118.70 115.86 3mfb s GLU 358 Ca 0.45 0.79 -0.20 0.00 0.36 0.00 0.00 54.97 56.37 3mfb s GLU 358 Cb -0.03 0.37 0.06 0.00 0.26 0.00 0.00 34.13 34.78 3mfb s GLU 358 CO 0.27 -0.11 0.70 0.34 -0.54 0.00 0.00 175.26 175.92 3mfb s ASP 359 N 0.15 6.24 0.00 -1.70 2.15 -0.59 -4.92 116.67 118.00 3mfb s ASP 359 Ca -0.00 -0.87 0.00 0.00 0.43 0.00 0.00 52.55 52.11 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 -0.99 0.76 1.21 -0.17 0.00 0.00 175.17 175.98 3mfb n GLU 360 N 6.46 0.00 -0.01 4.34 2.13 -1.26 -0.02 120.64 132.28 3mfb n GLU 360 Ca -0.05 0.28 0.09 0.00 0.66 0.00 0.00 57.16 58.14 3mfb n GLU 360 Cb 0.45 -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 -1.26 0.64 0.00 5.31 1.02 -1.26 -4.70 120.64 120.40 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 -2.01 0.00 -0.20 2.62 -2.24 -0.66 -5.01 114.28 106.78 3mfb n THR 362 Ca -0.02 -0.04 0.00 0.00 -2.27 0.00 0.00 64.05 61.72 3mfb n THR 362 Cb 0.45 0.35 0.00 0.00 -2.10 0.00 0.00 70.33 69.03 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 0.76 1.83 3.76 3.38 0.00 0.98 -5.01 105.19 110.88 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 -0.27 3.14 0.22 1.61 0.52 -1.26 -4.69 118.95 118.23 3mfb s ARG 364 Ca 0.00 1.91 0.09 0.00 -0.52 0.00 0.00 55.73 57.21 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 -1.09 -0.07 -0.51 0.02 0.00 0.00 175.30 173.65 3mfb s LEU 365 N -3.77 3.02 -0.07 2.53 1.43 -1.26 -1.54 118.68 119.01 3mfb s LEU 365 Ca 0.74 -0.65 -0.03 0.00 -1.03 0.00 0.00 54.13 53.16 3mfb s LEU 365 Cb -0.32 -1.62 0.04 0.00 0.03 0.00 0.00 46.19 44.31 3mfb s LEU 365 CO 0.36 0.06 0.16 -0.75 0.23 0.00 0.00 176.35 176.41 3mfb s LYS 366 N -3.20 0.11 0.07 1.70 2.20 -1.26 -5.01 119.74 114.35 3mfb s LYS 366 Ca 0.28 0.37 -0.30 0.00 -0.36 0.00 0.00 55.97 55.96 3mfb s LYS 366 Cb -0.08 -0.15 -0.05 0.00 -1.51 0.00 0.00 37.83 36.05 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 1.06 3.25 0.00 3.13 0.00 -1.26 -4.35 121.76 123.60 3mfb s ALA 367 Ca -0.08 0.63 -0.09 0.00 0.00 0.00 0.00 51.96 52.42 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 0.19 0.14 0.00 0.00 0.00 175.76 175.84 3mfb s VAL 368 N 0.53 0.08 0.35 0.00 -7.23 -0.40 -4.45 120.40 109.28 3mfb s VAL 368 Ca 0.51 -0.65 0.06 0.00 -1.81 0.00 0.00 61.98 60.10 3mfb s VAL 368 Cb -0.24 -0.51 -0.07 0.00 0.56 0.00 0.00 36.38 36.12 3mfb s VAL 368 CO 0.30 -0.35 -0.01 -0.83 -0.31 0.00 0.00 175.10 173.89 3mfb s GLY 369 N -1.41 2.21 0.01 2.32 0.00 -0.64 -0.66 107.32 109.15 3mfb s GLY 369 Ca -0.14 -2.13 -0.03 0.00 0.00 0.00 0.00 44.72 42.42 3mfb s GLY 369 CO 0.02 -1.96 0.05 -0.19 0.00 0.00 0.00 173.10 171.01 3mfb s TYR 370 N -2.91 0.13 -0.22 1.90 1.51 0.23 -1.76 117.35 116.23 3mfb s TYR 370 Ca 0.34 -0.29 -0.22 0.00 -1.01 0.00 0.00 57.07 55.90 3mfb s TYR 370 Cb 0.07 -0.11 -0.02 0.00 -0.11 0.00 0.00 41.96 41.80 3mfb s TYR 370 CO 0.16 -0.21 0.68 -1.01 -1.11 0.00 0.00 175.55 174.06 3mfb s HIS 371 N -1.25 3.34 0.46 2.71 3.76 -1.26 -1.74 115.29 121.31 3mfb s HIS 371 Ca -0.14 0.95 -0.06 0.00 -0.15 0.00 0.00 55.06 55.66 3mfb s HIS 371 Cb -0.08 -2.87 -0.04 0.00 1.11 0.00 0.00 32.58 30.70 3mfb s HIS 371 CO 0.00 -0.26 0.78 0.95 -0.85 0.00 0.00 174.74 175.36 3mfb s THR 372 N 2.27 4.88 0.00 1.30 -4.23 0.03 -4.99 115.64 114.90 3mfb s THR 372 Ca 0.30 0.30 0.00 0.00 -1.18 0.00 0.00 61.69 61.11 3mfb s THR 372 Cb -0.16 -3.83 0.00 0.00 1.34 0.00 0.00 72.50 69.85 3mfb s THR 372 CO 0.09 -0.76 0.00 -0.24 -0.54 0.00 0.00 174.62 173.17 3mfb n SER 373 N -2.00 1.91 0.00 3.99 2.88 -1.26 -4.88 113.62 114.26 3mfb n SER 373 Ca 0.01 -0.06 0.00 0.00 -1.33 0.00 0.00 58.87 57.48 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 0.27 -1.46 4.07 -1.26 -1.98 120.64 120.28 3mfb n GLU 375 Ca 0.00 0.00 -0.16 0.00 -0.06 0.00 0.00 57.16 56.94 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 -0.92 0.00 4.31 0.87 -2.03 -3.47 113.55 112.31 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 -0.52 0.00 0.61 -0.53 0.00 0.00 176.83 176.39 3mfb n GLY 377 N -1.47 0.63 1.70 5.77 0.00 -0.84 -4.96 105.19 106.03 3mfb n GLY 377 Ca -0.11 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 45.88 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 -1.30 3.22 0.00 1.61 0.63 -1.26 -4.14 116.66 115.42 3mfb n ARG 378 Ca 0.00 -2.36 0.13 0.00 -0.92 0.00 0.00 57.85 54.70 3mfb n ARG 378 Cb 0.00 -2.02 0.29 0.00 0.45 0.00 0.00 32.46 31.18 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 0.02 2.06 -4.76 6.15 5.75 -1.26 -4.84 116.55 119.66 3mfb n ASP 379 Ca 0.30 -1.61 -0.40 0.00 -0.01 0.00 0.00 54.79 53.08 3mfb n ASP 379 Cb 1.13 0.08 -0.05 0.00 -1.03 0.00 0.00 41.12 41.24 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 -2.12 4.50 -0.07 0.11 -1.52 -1.26 -0.05 119.66 119.25 3mfb s GLN 380 Ca 0.30 1.07 0.05 0.00 -1.95 0.00 0.00 55.36 54.83 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 0.37 0.42 -0.23 0.08 -0.25 0.00 0.00 175.29 175.68 3mfb s VAL 381 N -0.54 2.24 0.19 1.09 1.01 0.26 -4.91 120.40 119.75 3mfb s VAL 381 Ca 0.37 -0.99 -0.30 0.00 0.00 0.00 0.00 61.98 61.05 3mfb s VAL 381 Cb -0.21 -1.83 -0.09 0.00 0.00 0.00 0.00 36.38 34.25 3mfb s VAL 381 CO 0.24 0.57 1.30 -0.13 0.00 0.00 0.00 175.10 177.07 3mfb s ARG 382 N -0.11 4.40 -0.15 2.72 0.52 -1.26 -1.34 118.95 123.73 3mfb s ARG 382 Ca -0.05 2.03 -0.03 0.00 -0.52 0.00 0.00 55.73 57.16 3mfb s ARG 382 Cb -0.14 -3.20 -0.03 0.00 0.52 0.00 0.00 34.95 32.10 3mfb s ARG 382 CO 0.04 -0.24 -0.05 0.08 0.02 0.00 0.00 175.30 175.15 3mfb s VAL 383 N 0.15 3.81 0.01 3.52 1.01 -0.49 -0.84 120.40 127.58 3mfb s VAL 383 Ca 0.57 -0.39 0.02 0.00 0.00 0.00 0.00 61.98 62.18 3mfb s VAL 383 Cb -0.36 -2.66 -0.01 0.00 0.00 0.00 0.00 36.38 33.34 3mfb s VAL 383 CO 0.38 0.50 -0.07 -0.13 0.00 0.00 0.00 175.10 175.78 3mfb s ARG 384 N 0.34 0.51 -0.10 2.72 1.81 -0.03 -4.11 118.95 120.09 3mfb s ARG 384 Ca -0.05 -0.42 -0.21 0.00 -1.72 0.00 0.00 55.73 53.33 3mfb s ARG 384 Cb -0.14 -0.42 -0.04 0.00 -0.45 0.00 0.00 34.95 33.90 3mfb s ARG 384 CO 0.03 0.10 0.60 -1.17 -0.68 0.00 0.00 175.30 174.18 3mfb s LEU 385 N -0.69 4.28 0.41 2.53 2.96 -1.26 -0.11 118.68 126.81 3mfb s LEU 385 Ca -0.02 0.99 -0.23 0.00 -0.22 0.00 0.00 54.13 54.65 3mfb s LEU 385 Cb -0.05 -2.90 -0.10 0.00 0.50 0.00 0.00 46.19 43.65 3mfb s LEU 385 CO 0.00 -0.08 1.00 -0.76 -1.32 0.00 0.00 176.35 175.19 3mfb s LEU 386 N 0.82 4.06 -0.08 -0.68 1.43 0.21 -4.88 118.68 119.55 3mfb s LEU 386 Ca 0.32 1.87 -0.02 0.00 -1.03 0.00 0.00 54.13 55.27 3mfb s LEU 386 Cb -0.16 -4.34 -0.03 0.00 0.03 0.00 0.00 46.19 41.68 3mfb s LEU 386 CO 0.14 -0.43 0.03 -0.54 0.23 0.00 0.00 176.35 175.78 3mfb s LYS 387 N -2.77 3.05 -0.20 1.70 1.02 -0.30 -4.26 119.74 117.98 3mfb s LYS 387 Ca 0.60 -0.38 -0.21 0.00 0.02 0.00 0.00 55.97 55.99 3mfb s LYS 387 Cb -0.16 -2.85 -0.02 0.00 -0.52 0.00 0.00 37.83 34.27 3mfb s LYS 387 CO 0.21 0.71 0.66 -1.58 -0.92 0.00 0.00 175.35 174.43 3mfb s HIS 388 N -0.94 3.38 -0.78 3.18 2.46 -1.26 -0.01 115.29 121.31 3mfb s HIS 388 Ca 0.15 0.98 -0.06 0.00 0.47 0.00 0.00 55.06 56.59 3mfb s HIS 388 Cb -0.11 -2.84 0.20 0.00 -0.13 0.00 0.00 32.58 29.70 3mfb s HIS 388 CO 0.04 -0.19 0.66 0.34 -2.47 0.00 0.00 174.74 173.12 3mfb s ASP 389 N 1.20 5.99 0.21 9.88 -1.08 0.25 -4.95 116.67 128.17 3mfb s ASP 389 Ca 0.30 -3.07 -0.10 0.00 -0.52 0.00 0.00 52.55 49.16 3mfb s ASP 389 Cb -0.16 -1.99 0.18 0.00 -1.46 0.00 0.00 42.92 39.49 3mfb s ASP 389 CO 0.11 -0.38 1.85 -0.26 0.52 0.00 0.00 175.17 177.01 3mfb h PHE 390 N 6.97 0.85 -0.59 -5.34 -1.00 -1.95 0.84 116.94 116.72 3mfb h PHE 390 Ca 0.07 0.02 0.16 0.00 2.81 0.00 0.00 57.97 61.04 3mfb h PHE 390 Cb 0.94 -0.28 -0.03 0.00 3.61 0.00 0.00 35.95 40.19 3mfb h PHE 390 CO 0.81 0.50 0.42 -1.35 -1.61 0.00 0.00 178.31 177.07 3mfb h PRO 391 N 0.89 0.05 -0.21 1.51 0.11 -1.95 -0.07 132.00 132.34 3mfb h PRO 391 Ca 0.28 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.39 3mfb h PRO 391 Cb -0.01 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 31.09 3mfb h PRO 391 CO -0.10 0.03 0.00 0.09 -0.21 0.00 0.00 178.00 177.82 3mfb n ASN 392 N -4.38 2.71 -3.79 -2.05 3.02 -0.68 -5.00 115.26 105.09 3mfb n ASN 392 Ca 0.11 -1.79 -0.27 0.00 -0.03 0.00 0.00 54.58 52.60 3mfb n ASN 392 Cb 0.62 -0.13 0.01 0.00 -0.61 0.00 0.00 39.78 39.68 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 0.91 -2.33 -3.84 6.41 3.02 0.20 -4.97 115.26 114.66 3mfb n ASN 393 Ca 0.12 -0.97 -0.09 0.00 -0.03 0.00 0.00 54.58 53.61 3mfb n ASN 393 Cb 0.44 -3.41 -0.05 0.00 -0.61 0.00 0.00 39.78 36.15 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 -6.20 1.36 -0.07 3.52 0.52 -0.91 -4.51 118.95 112.65 3mfb s ARG 394 Ca 0.18 -1.00 0.01 0.00 -0.52 0.00 0.00 55.73 54.39 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 0.86 -0.56 -0.07 0.71 0.02 0.00 0.00 175.30 176.26 3mfb s TYR 395 N -3.92 2.93 0.03 -0.53 2.02 0.28 0.87 117.35 119.03 3mfb s TYR 395 Ca 0.13 -0.02 -0.02 0.00 -0.37 0.00 0.00 57.07 56.79 3mfb s TYR 395 Cb 0.00 -1.73 -0.02 0.00 -0.40 0.00 0.00 41.96 39.81 3mfb s TYR 395 CO -0.00 0.29 0.01 -1.83 -1.57 0.00 0.00 175.55 172.45 3mfb s GLU 396 N -0.71 0.48 -0.06 -0.62 -1.05 0.98 -0.81 118.70 116.91 3mfb s GLU 396 Ca 0.11 -0.84 0.02 0.00 -0.15 0.00 0.00 54.97 54.11 3mfb s GLU 396 Cb -0.11 0.18 0.02 0.00 -0.44 0.00 0.00 34.13 33.77 3mfb s GLU 396 CO 0.02 -0.10 -0.09 0.12 0.95 0.00 0.00 175.26 176.15 3mfb s PHE 397 N -2.55 1.22 -0.22 4.83 5.36 -0.39 -1.15 117.98 125.08 3mfb s PHE 397 Ca -0.06 -0.43 -0.06 0.00 -0.96 0.00 0.00 56.93 55.42 3mfb s PHE 397 Cb -0.02 -0.94 -0.02 0.00 -0.34 0.00 0.00 43.02 41.70 3mfb s PHE 397 CO -0.05 -0.26 0.02 -1.58 -1.46 0.00 0.00 175.22 171.90 3mfb s TRP 398 N 0.79 3.05 0.90 10.12 0.52 -1.26 -0.79 118.94 132.26 3mfb s TRP 398 Ca -0.13 -0.52 -0.12 0.00 0.02 0.00 0.00 56.10 55.36 3mfb s TRP 398 Cb -0.15 -2.14 0.13 0.00 -1.15 0.00 0.00 33.47 30.16 3mfb s TRP 398 CO 0.02 -0.33 1.09 -1.21 0.02 0.00 0.00 176.95 176.55 3mfb s GLU 399 N 1.29 1.20 0.10 4.98 2.02 -1.26 -4.91 118.70 122.12 3mfb s GLU 399 Ca 0.04 0.75 -0.31 0.00 0.02 0.00 0.00 54.97 55.47 3mfb s GLU 399 Cb -0.15 -1.81 -0.10 0.00 0.10 0.00 0.00 34.13 32.18 3mfb s GLU 399 CO 0.02 -2.26 1.77 -1.21 0.02 0.00 0.00 175.26 173.59 3mfb s GLU 400 N -4.97 4.16 0.00 1.61 0.41 -1.26 -2.05 118.70 116.60 3mfb s GLU 400 Ca 0.63 2.50 0.00 0.00 -0.41 0.00 0.00 54.97 57.70 3mfb s GLU 400 Cb -0.18 -3.60 0.00 0.00 -1.78 0.00 0.00 34.13 28.58 3mfb s GLU 400 CO 0.57 -0.81 0.00 0.41 -0.49 0.00 0.00 175.26 174.94 3mfb n GLY 401 N 4.15 0.49 3.80 -1.39 0.00 -1.26 -5.02 105.19 105.96 3mfb n GLY 401 Ca 0.17 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.84 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 3.03 -2.07 4.61 0.00 -0.87 -4.95 121.76 119.48 3mfb s ALA 402 Ca 0.00 0.57 0.21 0.00 0.00 0.00 0.00 51.96 52.73 3mfb s ALA 402 Cb 0.00 -3.22 0.46 0.00 0.00 0.00 0.00 23.12 20.36 3mfb s ALA 402 CO 0.00 -0.09 1.39 0.25 0.00 0.00 0.00 175.76 177.31 3mfb n THR 403 N -0.40 0.69 -3.54 0.00 -2.24 -1.26 -4.95 114.28 102.57 3mfb n THR 403 Ca 0.06 -0.84 -0.08 0.00 -2.27 0.00 0.00 64.05 60.92 3mfb n THR 403 Cb 0.52 0.80 -0.02 0.00 -2.10 0.00 0.00 70.33 69.53 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 -1.25 -0.45 0.34 3.38 0.00 -1.26 -5.14 107.32 102.94 3mfb s GLY 404 Ca 0.38 0.66 -0.28 0.00 0.00 0.00 0.00 44.72 45.48 3mfb s GLY 404 CO 0.29 0.21 1.28 -1.55 0.00 0.00 0.00 173.10 173.33 3mfb n PRO 405 N -0.33 2.08 -0.10 2.90 -0.04 -1.26 -4.73 135.00 133.52 3mfb n PRO 405 Ca -0.10 0.73 -0.21 0.00 -0.04 0.00 0.00 63.50 63.88 3mfb n PRO 405 Cb 0.62 -2.30 -0.12 0.00 -0.04 0.00 0.00 33.50 31.66 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 0.36 1.57 -4.63 0.52 -1.04 0.03 -4.68 114.28 106.41 3mfb n THR 406 Ca 0.05 -0.52 -0.23 0.00 -2.04 0.00 0.00 64.05 61.31 3mfb n THR 406 Cb 0.36 -1.63 -0.16 0.00 -1.82 0.00 0.00 70.33 67.08 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 -2.52 1.13 0.14 12.58 1.01 -1.00 -4.29 121.20 128.26 3mfb s ILE 407 Ca -0.32 -0.55 0.09 0.00 0.00 0.00 0.00 60.65 59.87 3mfb s ILE 407 Cb 0.09 -0.99 -0.04 0.00 0.01 0.00 0.00 42.46 41.53 3mfb s ILE 407 CO 0.62 0.34 -0.22 -0.76 0.00 0.00 0.00 174.94 174.92 3mfb s LEU 408 N 0.14 2.37 -0.21 2.97 1.43 0.15 -1.26 118.68 124.26 3mfb s LEU 408 Ca -0.04 -0.78 -0.04 0.00 -1.03 0.00 0.00 54.13 52.25 3mfb s LEU 408 Cb -0.10 -0.97 0.10 0.00 0.03 0.00 0.00 46.19 45.24 3mfb s LEU 408 CO 0.01 0.06 0.22 0.86 0.23 0.00 0.00 176.35 177.74 3mfb s TRP 409 N -1.48 -0.27 -0.24 0.29 -0.11 0.01 -1.37 118.94 115.76 3mfb s TRP 409 Ca 0.13 0.16 -0.08 0.00 1.22 0.00 0.00 56.10 57.53 3mfb s TRP 409 Cb -0.08 -0.38 -0.04 0.00 -1.50 0.00 0.00 33.47 31.46 3mfb s TRP 409 CO 0.06 -0.63 0.10 0.99 -4.62 0.00 0.00 176.95 172.85 3mfb s THR 410 N 2.32 4.68 -2.00 5.86 2.01 -1.26 -0.56 115.64 126.70 3mfb s THR 410 Ca 0.07 -0.05 0.03 0.00 0.31 0.00 0.00 61.69 62.05 3mfb s THR 410 Cb -0.16 -3.18 0.09 0.00 0.01 0.00 0.00 72.50 69.26 3mfb s THR 410 CO -0.14 0.35 0.52 -0.81 -0.69 0.00 0.00 174.62 173.84 3mfb n PRO 411 N 4.63 0.18 0.01 4.92 -0.04 -1.26 -2.20 135.00 141.23 3mfb n PRO 411 Ca -0.16 0.00 -0.06 0.00 -0.04 0.00 0.00 63.50 63.24 3mfb n PRO 411 Cb 0.52 -1.26 -0.12 0.00 -0.04 0.00 0.00 33.50 32.60 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 0.89 0.00 0.59 -1.72 0.00 0.00 179.24 179.00 3mfb n ASN 413 N -3.05 0.00 0.00 6.45 4.13 -0.94 -5.10 115.26 116.76 3mfb n ASN 413 Ca -0.13 0.30 0.00 0.00 1.68 0.00 0.00 54.58 56.43 3mfb n ASN 413 Cb 0.98 -0.41 0.00 0.00 -1.54 0.00 0.00 39.78 38.81 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 -1.89 3.28 0.00 3.52 -0.04 -1.25 -5.16 135.00 133.46 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 2.63 3.71 0.55 0.00 -1.26 -4.94 105.19 110.88 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 -2.11 4.63 0.02 -0.61 -1.09 -1.26 -4.26 121.20 116.52 3mfb s ILE 416 Ca 0.00 1.89 0.00 0.00 -2.23 0.00 0.00 60.65 60.31 3mfb s ILE 416 Cb 0.00 -4.21 -0.02 0.00 -1.58 0.00 0.00 42.46 36.65 3mfb s ILE 416 CO 0.00 0.12 -0.03 -1.61 -1.23 0.00 0.00 174.94 172.19 3mfb s GLU 417 N 1.22 0.28 -0.01 2.79 2.02 -0.47 -5.00 118.70 119.53 3mfb s GLU 417 Ca 0.53 -0.48 0.06 0.00 0.02 0.00 0.00 54.97 55.10 3mfb s GLU 417 Cb -0.23 -0.00 -0.01 0.00 0.10 0.00 0.00 34.13 33.98 3mfb s GLU 417 CO 0.27 -0.02 -0.18 -0.51 0.02 0.00 0.00 175.26 174.84 3mfb s LEU 418 N -1.09 2.05 0.02 1.80 1.02 -1.26 0.34 118.68 121.56 3mfb s LEU 418 Ca -0.11 -0.34 0.14 0.00 0.02 0.00 0.00 54.13 53.84 3mfb s LEU 418 Cb -0.07 -0.91 0.62 0.00 0.02 0.00 0.00 46.19 45.84 3mfb s LEU 418 CO -0.01 0.21 1.46 -0.81 0.02 0.00 0.00 176.35 177.22 3mfb n PRO 419 N 2.54 0.02 -3.28 1.29 -0.04 -1.26 -4.71 135.00 129.56 3mfb n PRO 419 Ca -0.15 0.28 -0.21 0.00 -0.04 0.00 0.00 63.50 63.38 3mfb n PRO 419 Cb 0.54 -1.53 0.03 0.00 -0.04 0.00 0.00 33.50 32.49 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 -3.03 2.26 -0.67 0.52 -4.23 -1.26 -5.03 115.64 104.20 3mfb s THR 420 Ca 0.06 -1.15 -0.01 0.00 -1.18 0.00 0.00 61.69 59.41 3mfb s THR 420 Cb 0.09 -2.41 0.43 0.00 1.34 0.00 0.00 72.50 71.95 3mfb s THR 420 CO 0.26 0.00 1.95 -0.67 -0.54 0.00 0.00 174.62 175.62 3mfb n ASP 421 N -1.98 7.38 -4.91 3.99 2.03 -1.26 -4.98 116.55 116.81 3mfb n ASP 421 Ca 0.09 -3.80 -0.29 0.00 0.52 0.00 0.00 54.79 51.31 3mfb n ASP 421 Cb 0.62 -0.93 -0.04 0.00 -0.72 0.00 0.00 41.12 40.04 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 -4.88 5.20 0.56 5.18 -4.23 -1.26 -5.08 115.64 111.13 3mfb s THR 422 Ca 0.61 -0.19 -0.18 0.00 -1.18 0.00 0.00 61.69 60.75 3mfb s THR 422 Cb 0.49 -3.68 -0.05 0.00 1.34 0.00 0.00 72.50 70.60 3mfb s THR 422 CO -0.09 -0.06 1.09 0.00 -0.54 0.00 0.00 174.62 175.02 3mfb s ALA 423 N -1.75 2.71 -0.19 3.99 0.00 -1.26 -4.87 121.76 120.39 3mfb s ALA 423 Ca 0.39 0.64 -0.20 0.00 0.00 0.00 0.00 51.96 52.79 3mfb s ALA 423 Cb -0.12 -3.30 0.05 0.00 0.00 0.00 0.00 23.12 19.76 3mfb s ALA 423 CO 0.27 -0.74 0.56 -3.38 0.00 0.00 0.00 175.76 172.48 3mfb s HIS 424 N -2.04 -0.60 0.13 0.00 -3.43 -1.26 -1.49 115.29 106.59 3mfb s HIS 424 Ca 0.69 1.43 0.06 0.00 -0.80 0.00 0.00 55.06 56.43 3mfb s HIS 424 Cb -0.20 0.22 -0.04 0.00 -1.43 0.00 0.00 32.58 31.14 3mfb s HIS 424 CO 0.29 -0.33 -0.13 0.20 -2.00 0.00 0.00 174.74 172.77 3mfb s GLY 425 N 0.10 1.07 0.14 -1.38 0.00 -0.70 -4.99 107.32 101.56 3mfb s GLY 425 Ca -0.02 -1.32 -0.24 0.00 0.00 0.00 0.00 44.72 43.15 3mfb s GLY 425 CO 0.02 -1.38 0.63 -1.83 0.00 0.00 0.00 173.10 170.54 3mfb s GLU 426 N -2.80 1.23 -0.27 2.90 1.03 -1.26 -1.72 118.70 117.80 3mfb s GLU 426 Ca 0.10 -0.43 -0.21 0.00 0.03 0.00 0.00 54.97 54.46 3mfb s GLU 426 Cb -0.04 0.57 0.08 0.00 -0.80 0.00 0.00 34.13 33.93 3mfb s GLU 426 CO 0.03 -0.53 0.72 -1.14 -1.33 0.00 0.00 175.26 173.01 3mfb s GLN 427 N -3.59 0.77 0.52 -4.83 2.00 -0.68 -5.00 119.66 108.85 3mfb s GLN 427 Ca 0.01 1.08 -0.22 0.00 -2.00 0.00 0.00 55.36 54.23 3mfb s GLN 427 Cb -0.01 0.28 -0.06 0.00 0.80 0.00 0.00 33.01 34.03 3mfb s GLN 427 CO -0.12 -0.12 1.37 -2.14 -0.50 0.00 0.00 175.29 173.78 3mfb s PRO 428 N 0.94 3.26 0.51 1.67 0.02 -1.26 -1.67 135.00 138.47 3mfb s PRO 428 Ca -0.04 2.27 -0.19 0.00 0.02 0.00 0.00 61.00 63.05 3mfb s PRO 428 Cb -0.05 -2.34 -0.08 0.00 0.02 0.00 0.00 34.50 32.05 3mfb s PRO 428 CO -0.09 -1.10 1.04 0.08 -0.33 0.00 0.00 177.00 176.60 3mfb s VAL 429 N -1.28 3.82 -0.09 3.83 1.01 -0.29 -4.65 120.40 122.73 3mfb s VAL 429 Ca 0.69 1.07 -0.30 0.00 0.00 0.00 0.00 61.98 63.45 3mfb s VAL 429 Cb -0.41 -3.45 -0.03 0.00 0.00 0.00 0.00 36.38 32.49 3mfb s VAL 429 CO 0.49 -0.30 1.31 -0.63 0.00 0.00 0.00 175.10 175.97 3mfb s ILE 430 N -2.08 4.10 0.13 2.22 1.01 0.18 -4.86 121.20 121.90 3mfb s ILE 430 Ca 0.66 1.39 -0.33 0.00 0.00 0.00 0.00 60.65 62.37 3mfb s ILE 430 Cb -0.16 -3.90 -0.13 0.00 0.01 0.00 0.00 42.46 38.28 3mfb s ILE 430 CO 0.23 -0.07 1.66 -2.65 0.00 0.00 0.00 174.94 174.11 3mfb n PRO 431 N 6.04 2.30 -4.16 2.79 -0.02 -1.26 -3.44 135.00 137.25 3mfb n PRO 431 Ca 0.13 0.83 -0.34 0.00 -2.02 0.00 0.00 63.50 62.10 3mfb n PRO 431 Cb 0.45 -2.63 -0.05 0.00 -0.02 0.00 0.00 33.50 31.25 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 4.07 -0.87 -4.97 2.55 7.64 -1.24 -4.95 113.62 115.85 3mfb n SER 432 Ca 0.18 -1.22 -0.21 0.00 1.01 0.00 0.00 58.87 58.63 3mfb n SER 432 Cb 0.30 -1.97 0.03 0.00 -1.01 0.00 0.00 64.21 61.56 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 3.96 0.17 -0.43 0.00 -1.22 -4.61 121.76 115.58 3mfb s ALA 433 Ca 0.15 -1.33 -0.31 0.00 0.00 0.00 0.00 51.96 50.46 3mfb s ALA 433 Cb -0.08 -2.03 -0.10 0.00 0.00 0.00 0.00 23.12 20.92 3mfb s ALA 433 CO 0.97 -0.63 1.56 0.42 0.00 0.00 0.00 175.76 178.08 3mfb s ILE 434 N -2.68 2.62 -0.29 0.00 -1.09 -1.26 -1.55 121.20 116.95 3mfb s ILE 434 Ca 0.56 0.45 -0.38 0.00 -2.23 0.00 0.00 60.65 59.04 3mfb s ILE 434 Cb -0.10 -3.29 -0.14 0.00 -1.58 0.00 0.00 42.46 37.35 3mfb s ILE 434 CO 0.38 0.04 1.90 -2.65 -1.23 0.00 0.00 174.94 173.37 3mfb n PRO 435 N 3.89 1.21 0.00 2.79 -0.02 -1.26 -0.27 135.00 141.34 3mfb n PRO 435 Ca 0.14 0.42 0.00 0.00 -2.02 0.00 0.00 63.50 62.03 3mfb n PRO 435 Cb 0.39 -2.24 0.00 0.00 -0.02 0.00 0.00 33.50 31.63 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 5.02 1.74 0.03 -1.23 0.00 -1.23 -4.92 105.19 104.61 3mfb n GLY 436 Ca 0.31 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 0.17 0.99 4.77 0.63 -1.08 117.00 124.58 3mfb n LEU 437 Ca 0.00 -2.40 0.14 0.00 -0.03 0.00 0.00 56.01 53.71 3mfb n LEU 437 Cb 0.00 -0.17 0.48 0.00 -2.33 0.00 0.00 43.42 41.40 3mfb n LEU 437 CO 0.00 0.58 0.89 1.05 -1.33 0.00 0.00 177.39 178.58 3mfb h GLU 438 N 0.00 0.00 -4.67 3.23 9.09 -1.87 -3.42 114.58 116.94 3mfb h GLU 438 Ca 0.00 0.00 -0.69 0.00 0.05 0.00 0.00 59.36 58.72 3mfb h GLU 438 Cb 0.72 0.00 -0.24 0.00 -1.65 0.00 0.00 28.75 27.58 3mfb h GLU 438 CO 0.00 0.00 -0.54 0.42 0.05 0.00 0.00 179.01 178.94 3mfb s ILE 439 N -3.34 4.55 0.55 -1.06 1.01 -1.26 0.47 121.20 122.11 3mfb s ILE 439 Ca 0.05 -0.69 -0.19 0.00 0.00 0.00 0.00 60.65 59.82 3mfb s ILE 439 Cb 0.09 -3.45 -0.06 0.00 0.01 0.00 0.00 42.46 39.05 3mfb s ILE 439 CO 0.51 -0.11 1.10 -2.16 0.00 0.00 0.00 174.94 174.28 3mfb s PRO 440 N 1.57 3.40 0.00 2.79 0.04 -1.26 -4.84 135.00 136.70 3mfb s PRO 440 Ca 0.03 1.50 0.00 0.00 0.04 0.00 0.00 61.00 62.57 3mfb s PRO 440 Cb -0.18 -2.02 0.00 0.00 0.04 0.00 0.00 34.50 32.33 3mfb s PRO 440 CO 0.06 -0.79 0.00 0.39 0.04 0.00 0.00 177.00 176.71 3mfb n GLU 441 N -1.39 3.08 -5.06 4.56 1.02 -1.26 -5.04 120.64 116.56 3mfb n GLU 441 Ca 0.11 0.00 -0.28 0.00 -0.02 0.00 0.00 57.16 56.97 3mfb n GLU 441 Cb 0.52 0.00 -0.16 0.00 -0.02 0.00 0.00 31.44 31.78 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 -1.35 2.55 -1.50 1.62 2.15 -1.26 -5.02 116.67 113.87 3mfb s ASP 443 Ca 0.00 -0.40 -0.06 0.00 0.43 0.00 0.00 52.55 52.52 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 0.58 -0.67 -0.17 0.00 0.00 175.17 175.17 3mfb n ASP 444 N 2.51 -5.61 -3.89 -0.34 2.03 -1.26 -4.96 116.55 105.03 3mfb n ASP 444 Ca -0.15 -0.30 -0.29 0.00 0.52 0.00 0.00 54.79 54.56 3mfb n ASP 444 Cb 0.52 -4.55 -0.16 0.00 -0.72 0.00 0.00 41.12 36.22 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 -3.12 1.24 0.33 5.18 1.01 -1.26 -5.08 120.40 118.70 3mfb s VAL 445 Ca 0.32 -0.93 -0.29 0.00 0.00 0.00 0.00 61.98 61.08 3mfb s VAL 445 Cb -0.15 -1.52 -0.10 0.00 0.00 0.00 0.00 36.38 34.61 3mfb s VAL 445 CO 0.40 -0.05 1.36 -0.55 0.00 0.00 0.00 175.10 176.26 3mfb s SER 446 N 1.54 6.67 -0.34 3.32 0.15 -1.26 -4.75 113.70 119.03 3mfb s SER 446 Ca -0.03 2.76 -0.11 0.00 0.70 0.00 0.00 55.95 59.27 3mfb s SER 446 Cb -0.17 -2.65 0.00 0.00 -1.71 0.00 0.00 66.02 61.49 3mfb s SER 446 CO -0.07 -0.63 0.19 -0.63 1.20 0.00 0.00 173.24 173.31 3mfb s ILE 447 N -1.00 4.76 0.27 6.45 1.01 -1.26 -1.62 121.20 129.81 3mfb s ILE 447 Ca 0.51 -0.50 -0.23 0.00 0.00 0.00 0.00 60.65 60.42 3mfb s ILE 447 Cb -0.41 -3.50 -0.09 0.00 0.01 0.00 0.00 42.46 38.47 3mfb s ILE 447 CO 0.54 -0.04 0.84 -0.76 0.00 0.00 0.00 174.94 175.51 3mfb s LEU 448 N 1.62 4.35 -0.78 2.97 1.43 -0.72 -4.95 118.68 122.60 3mfb s LEU 448 Ca 0.04 1.64 -0.01 0.00 -1.03 0.00 0.00 54.13 54.77 3mfb s LEU 448 Cb -0.18 -3.79 0.37 0.00 0.03 0.00 0.00 46.19 42.62 3mfb s LEU 448 CO 0.07 -0.01 1.91 0.00 0.23 0.00 0.00 176.35 178.56 3mfb n ALA 449 N 0.68 6.32 -2.35 4.21 0.00 -1.26 -4.52 120.51 123.59 3mfb n ALA 449 Ca -0.00 -4.08 -0.20 0.00 0.00 0.00 0.00 53.44 49.16 3mfb n ALA 449 Cb 0.50 -1.78 -0.02 0.00 0.00 0.00 0.00 19.45 18.15 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 -5.10 3.35 0.00 0.00 -1.32 -1.26 -5.17 115.64 106.14 3mfb s THR 450 Ca 0.53 -1.23 0.00 0.00 -1.21 0.00 0.00 61.69 59.77 3mfb s THR 450 Cb 0.44 -3.16 0.00 0.00 -1.51 0.00 0.00 72.50 68.27 3mfb s THR 450 CO -0.35 -0.10 0.00 -0.81 -2.21 0.00 0.00 174.62 171.15 3mfb n PRO 451 N -1.54 0.00 -4.44 7.08 -0.04 -1.26 -5.00 135.00 129.79 3mfb n PRO 451 Ca 0.01 0.00 -0.23 0.00 -0.04 0.00 0.00 63.50 63.25 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 1.60 0.41 0.54 0.02 -1.26 -5.17 135.00 131.13 3mfb s PRO 453 Ca 0.00 -1.75 -0.26 0.00 0.02 0.00 0.00 61.00 59.01 3mfb s PRO 453 Cb 0.00 -1.52 -0.09 0.00 0.02 0.00 0.00 34.50 32.91 3mfb s PRO 453 CO 0.00 0.23 1.27 -0.51 -0.33 0.00 0.00 177.00 177.66 3mfb s ASP 454 N -3.47 6.34 0.54 2.53 1.01 -1.26 -4.87 116.67 117.48 3mfb s ASP 454 Ca 0.28 2.58 0.34 0.00 0.71 0.00 0.00 52.55 56.47 3mfb s ASP 454 Cb -0.02 -2.63 1.51 0.00 1.01 0.00 0.00 42.92 42.79 3mfb s ASP 454 CO 0.13 -0.82 1.85 -0.08 0.21 0.00 0.00 175.17 176.45 3mfb h GLU 455 N 2.64 0.01 -0.14 8.23 4.57 -2.00 0.22 114.58 128.11 3mfb h GLU 455 Ca -0.49 -0.00 0.04 0.00 -1.18 0.00 0.00 59.36 57.73 3mfb h GLU 455 Cb 1.24 -0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.83 3mfb h GLU 455 CO 0.62 0.00 0.13 0.87 -1.18 0.00 0.00 179.01 179.46 3mfb h LYS 456 N 0.01 0.00 -0.22 1.92 6.56 -2.07 -0.94 116.57 121.83 3mfb h LYS 456 Ca 0.50 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 60.09 3mfb h LYS 456 Cb 1.99 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 33.65 3mfb h LYS 456 CO -0.01 0.00 0.00 -0.25 -2.06 0.00 0.00 179.45 177.13 3mfb n ASP 457 N -4.03 1.99 -4.57 0.86 8.00 0.76 -4.84 116.55 114.71 3mfb n ASP 457 Ca 0.01 -1.79 -0.34 0.00 0.71 0.00 0.00 54.79 53.38 3mfb n ASP 457 Cb 0.25 -0.14 -0.11 0.00 -0.02 0.00 0.00 41.12 41.10 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 -1.71 2.95 -0.42 1.24 0.40 -0.36 -4.76 117.98 115.32 3mfb s PHE 458 Ca 0.32 -0.02 0.07 0.00 -0.60 0.00 0.00 56.93 56.71 3mfb s PHE 458 Cb 0.18 -1.74 0.24 0.00 0.51 0.00 0.00 43.02 42.21 3mfb s PHE 458 CO 0.26 0.29 0.61 -2.13 0.70 0.00 0.00 175.22 174.95 3mfb n ARG 459 N 2.37 0.69 -4.51 0.44 0.63 -1.26 -5.01 116.66 110.01 3mfb n ARG 459 Ca -0.18 -2.79 -0.25 0.00 -0.92 0.00 0.00 57.85 53.71 3mfb n ARG 459 Cb 0.53 -1.32 -0.10 0.00 0.45 0.00 0.00 32.46 32.02 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 -1.18 3.53 0.17 6.15 -4.77 -1.26 -0.63 116.67 118.68 3mfb s ASP 460 Ca 0.34 -1.16 -0.19 0.00 -3.30 0.00 0.00 52.55 48.24 3mfb s ASP 460 Cb 0.17 -0.31 0.04 0.00 -1.09 0.00 0.00 42.92 41.74 3mfb s ASP 460 CO -0.15 -0.17 0.52 -0.31 0.70 0.00 0.00 175.17 175.76 3mfb s TYR 461 N -2.66 -0.27 -0.22 2.11 2.02 0.13 -4.48 117.35 113.98 3mfb s TYR 461 Ca 0.31 -0.04 0.01 0.00 -0.37 0.00 0.00 57.07 56.98 3mfb s TYR 461 Cb 0.01 0.42 0.03 0.00 -0.40 0.00 0.00 41.96 42.02 3mfb s TYR 461 CO 0.15 -0.86 -0.13 0.42 -1.57 0.00 0.00 175.55 173.57 3mfb s ILE 462 N -3.82 2.35 -0.23 2.71 1.01 -0.02 -0.77 121.20 122.42 3mfb s ILE 462 Ca 0.05 -1.16 -0.12 0.00 0.00 0.00 0.00 60.65 59.42 3mfb s ILE 462 Cb -0.00 -2.17 -0.05 0.00 0.01 0.00 0.00 42.46 40.25 3mfb s ILE 462 CO -0.08 0.27 0.21 -0.76 0.00 0.00 0.00 174.94 174.58 3mfb s LEU 463 N 1.25 4.12 -0.13 2.97 1.43 0.43 -0.85 118.68 127.90 3mfb s LEU 463 Ca -0.01 0.19 -0.04 0.00 -1.03 0.00 0.00 54.13 53.24 3mfb s LEU 463 Cb -0.16 -2.19 -0.04 0.00 0.03 0.00 0.00 46.19 43.83 3mfb s LEU 463 CO -0.08 0.03 0.03 -0.69 0.23 0.00 0.00 176.35 175.88 3mfb s VAL 464 N 1.12 4.56 0.30 -1.59 1.01 0.84 -2.02 120.40 124.62 3mfb s VAL 464 Ca 0.10 -0.14 -0.14 0.00 0.00 0.00 0.00 61.98 61.81 3mfb s VAL 464 Cb -0.14 -2.98 -0.09 0.00 0.00 0.00 0.00 36.38 33.17 3mfb s VAL 464 CO 0.05 0.55 0.70 -0.36 0.00 0.00 0.00 175.10 176.04 3mfb s PHE 465 N -0.35 3.39 0.00 5.22 0.08 -1.26 0.64 117.98 125.69 3mfb s PHE 465 Ca 0.08 1.14 0.00 0.00 0.12 0.00 0.00 56.93 58.27 3mfb s PHE 465 Cb -0.12 -2.48 0.00 0.00 -0.57 0.00 0.00 43.02 39.85 3mfb s PHE 465 CO 0.02 0.13 0.84 -0.35 -0.10 0.00 0.00 175.22 175.76 3mfb n PRO 466 N -0.31 0.00 -1.10 0.24 -0.04 -1.26 -2.90 135.00 129.62 3mfb n PRO 466 Ca 0.03 0.66 -0.12 0.00 -0.04 0.00 0.00 63.50 64.03 3mfb n PRO 466 Cb 0.53 -1.34 0.27 0.00 -0.04 0.00 0.00 33.50 32.92 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 -2.05 3.31 -2.43 0.54 0.28 -1.26 -4.86 120.64 114.17 3mfb n GLU 467 Ca 0.00 -3.08 -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 30.65 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 -0.45 -5.16 0.29 -1.84 5.03 -1.14 -4.81 115.26 107.17 3mfb n ASN 468 Ca 0.47 -0.06 0.18 0.00 0.87 0.00 0.00 54.58 56.05 3mfb n ASN 468 Cb 1.49 -4.21 0.91 0.00 -1.02 0.00 0.00 39.78 36.96 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 0.83 1.43 -2.73 5.41 0.00 -1.89 -3.40 119.26 118.92 3mfb h ALA 469 Ca -0.42 -0.00 -0.14 0.00 0.00 0.00 0.00 54.91 54.35 3mfb h ALA 469 Cb 1.31 0.01 -0.20 0.00 0.00 0.00 0.00 17.79 18.91 3mfb h ALA 469 CO 0.49 -0.27 -0.53 -0.06 0.00 0.00 0.00 179.25 178.87 3mfb s PHE 470 N -4.28 0.13 0.54 0.00 0.08 -1.26 -5.15 117.98 108.03 3mfb s PHE 470 Ca -0.04 -0.32 -0.20 0.00 0.12 0.00 0.00 56.93 56.49 3mfb s PHE 470 Cb 0.12 -0.10 -0.06 0.00 -0.57 0.00 0.00 43.02 42.41 3mfb s PHE 470 CO 0.39 -0.30 1.13 -1.25 -0.10 0.00 0.00 175.22 175.09 3mfb s PRO 471 N -1.82 3.40 0.44 0.24 0.04 -1.26 -4.48 135.00 131.56 3mfb s PRO 471 Ca -0.12 1.61 -0.24 0.00 0.04 0.00 0.00 61.00 62.29 3mfb s PRO 471 Cb -0.06 -2.03 -0.10 0.00 0.04 0.00 0.00 34.50 32.36 3mfb s PRO 471 CO -0.01 -0.81 1.16 -0.35 0.04 0.00 0.00 177.00 177.03 3mfb n PRO 472 N -1.24 1.63 -4.34 0.56 -0.04 -1.26 -4.85 135.00 125.46 3mfb n PRO 472 Ca 0.11 0.58 -0.19 0.00 -0.04 0.00 0.00 63.50 63.96 3mfb n PRO 472 Cb 0.51 -2.25 -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 -1.25 0.70 -0.05 0.52 2.07 -0.86 -1.14 121.20 121.19 3mfb s ILE 473 Ca 0.63 -0.33 -0.18 0.00 -1.41 0.00 0.00 60.65 59.36 3mfb s ILE 473 Cb -0.52 -0.62 -0.05 0.00 0.13 0.00 0.00 42.46 41.40 3mfb s ILE 473 CO 0.56 0.22 0.51 -0.47 -1.91 0.00 0.00 174.94 173.85 3mfb s TYR 474 N 0.12 3.62 -0.00 3.50 5.04 -0.67 -0.43 117.35 128.52 3mfb s TYR 474 Ca -0.02 1.02 0.01 0.00 -2.44 0.00 0.00 57.07 55.65 3mfb s TYR 474 Cb -0.07 -2.52 -0.00 0.00 0.35 0.00 0.00 41.96 39.71 3mfb s TYR 474 CO 0.00 0.32 -0.03 0.54 -1.34 0.00 0.00 175.55 175.04 3mfb s VAL 475 N 0.01 0.27 -0.09 3.14 0.11 0.05 -1.68 120.40 122.20 3mfb s VAL 475 Ca 0.27 -0.14 0.01 0.00 -2.93 0.00 0.00 61.98 59.19 3mfb s VAL 475 Cb -0.17 -0.23 0.02 0.00 -1.53 0.00 0.00 36.38 34.47 3mfb s VAL 475 CO 0.13 0.08 -0.12 -0.72 -3.33 0.00 0.00 175.10 171.14 3mfb s TYR 476 N -0.07 1.63 0.24 1.54 -0.85 -0.70 -0.69 117.35 118.45 3mfb s TYR 476 Ca 0.01 -0.72 0.07 0.00 -0.52 0.00 0.00 57.07 55.91 3mfb s TYR 476 Cb -0.01 -1.23 -0.04 0.00 0.38 0.00 0.00 41.96 41.06 3mfb s TYR 476 CO -0.00 -0.41 0.13 -0.51 -1.52 0.00 0.00 175.55 173.24 3mfb s LEU 477 N 1.07 3.64 0.76 -3.49 1.43 0.20 -1.72 118.68 120.56 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 -2.18 0.05 0.00 0.03 0.00 0.00 46.19 43.94 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 -3.68 4.80 0.37 2.29 1.04 -0.56 -4.34 113.70 113.63 3mfb s SER 478 Ca 0.32 1.54 -0.26 0.00 0.48 0.00 0.00 55.95 58.03 3mfb s SER 478 Cb -0.08 -2.33 -0.12 0.00 0.10 0.00 0.00 66.02 63.60 3mfb s SER 478 CO 0.23 -1.80 1.00 1.17 0.98 0.00 0.00 173.24 174.82 3mfb n LYS 479 N -3.35 1.36 0.00 4.02 4.81 -1.26 -4.85 118.16 118.90 3mfb n LYS 479 Ca 0.08 0.48 0.11 0.00 -0.87 0.00 0.00 58.31 58.11 3mfb n LYS 479 Cb 0.54 -1.97 0.68 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