#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3cfl n THR 343 N 0.00 2.07 -4.77 -0.72 5.66 -1.26 -4.89 114.28 110.37 3cfl n THR 343 Ca 0.00 -0.93 -0.33 0.00 -3.05 0.00 0.00 64.05 59.74 3cfl n THR 343 Cb 0.00 -0.96 -0.15 0.00 -1.55 0.00 0.00 70.33 67.67 3cfl n THR 343 CO 0.00 0.00 0.00 -0.60 -3.05 0.00 0.00 175.07 171.42 3cfl s ARG 344 N -1.32 3.33 -0.15 1.09 3.52 -1.26 -4.90 118.95 119.26 3cfl s ARG 344 Ca 0.23 -0.71 -0.06 0.00 -0.13 0.00 0.00 55.73 55.06 3cfl s ARG 344 Cb 0.19 -2.60 -0.04 0.00 -1.56 0.00 0.00 34.95 30.94 3cfl s ARG 344 CO 0.03 0.17 0.05 0.08 -0.81 0.00 0.00 175.30 174.82 3cfl s VAL 345 N 0.44 4.69 -0.41 7.11 1.01 -0.61 -5.00 120.40 127.63 3cfl s VAL 345 Ca -0.11 -0.08 -0.18 0.00 0.00 0.00 0.00 61.98 61.61 3cfl s VAL 345 Cb -0.16 -3.06 0.01 0.00 0.00 0.00 0.00 36.38 33.17 3cfl s VAL 345 CO 0.05 0.52 0.51 -0.69 0.00 0.00 0.00 175.10 175.50 3cfl s VAL 346 N -0.15 5.00 0.33 2.92 1.01 -1.26 -0.43 120.40 127.81 3cfl s VAL 346 Ca 0.07 -0.04 -0.22 0.00 0.00 0.00 0.00 61.98 61.79 3cfl s VAL 346 Cb -0.12 -4.06 -0.10 0.00 0.00 0.00 0.00 36.38 32.10 3cfl s VAL 346 CO 0.01 -0.41 0.87 0.86 0.00 0.00 0.00 175.10 176.43 3cfl s TRP 347 N 2.39 3.55 -0.27 5.22 -0.11 0.14 -0.47 118.94 129.39 3cfl s TRP 347 Ca 0.17 1.58 -0.07 0.00 1.22 0.00 0.00 56.10 59.00 3cfl s TRP 347 Cb -0.16 -2.79 -0.01 0.00 -1.50 0.00 0.00 33.47 29.02 3cfl s TRP 347 CO 0.15 0.15 0.06 0.00 -4.62 0.00 0.00 176.95 172.69 3cfl s ALA 349 N 1.55 3.69 -0.48 0.00 0.00 0.15 -4.77 121.76 121.90 3cfl s ALA 349 Ca 0.05 -0.24 -0.15 0.00 0.00 0.00 0.00 51.96 51.61 3cfl s ALA 349 Cb -0.16 -2.38 0.08 0.00 0.00 0.00 0.00 23.12 20.66 3cfl s ALA 349 CO 0.02 0.45 0.41 0.08 0.00 0.00 0.00 175.76 176.72 3cfl s VAL 350 N -0.95 5.23 0.00 0.00 1.01 -1.26 -0.93 120.40 123.49 3cfl s VAL 350 Ca 0.23 -1.11 0.00 0.00 0.00 0.00 0.00 61.98 61.10 3cfl s VAL 350 Cb -0.16 -4.14 0.00 0.00 0.00 0.00 0.00 36.38 32.07 3cfl s VAL 350 CO 0.13 -0.61 0.00 0.61 0.00 0.00 0.00 175.10 175.23 3cfl n GLY 351 N 5.21 -1.31 0.29 4.51 0.00 -0.06 -4.32 105.19 109.50 3cfl n GLY 351 Ca -0.13 -1.60 0.02 0.00 0.00 0.00 0.00 46.02 44.32 3cfl n GLY 351 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3cfl h PRO 352 N 0.00 0.71 0.06 1.61 0.11 -1.93 -2.08 132.00 130.47 3cfl h PRO 352 Ca 0.00 -0.04 -0.28 0.00 0.11 0.00 0.00 66.00 65.79 3cfl h PRO 352 Cb 0.00 -0.16 0.02 0.00 0.11 0.00 0.00 31.00 30.97 3cfl h PRO 352 CO 0.00 0.47 -1.13 0.93 -0.21 0.00 0.00 178.00 178.06 3cfl h GLU 353 N 0.73 0.62 -0.33 1.05 5.08 -1.97 -1.82 114.58 117.94 3cfl h GLU 353 Ca 0.38 -0.75 -0.10 0.00 -1.00 0.00 0.00 59.36 57.90 3cfl h GLU 353 Cb 0.36 0.23 -0.02 0.00 0.50 0.00 0.00 28.75 29.83 3cfl h GLU 353 CO -0.25 1.32 -0.20 0.93 -1.00 0.00 0.00 179.01 179.81 3cfl h GLU 354 N 0.32 0.61 -0.34 2.33 5.08 -1.73 -2.11 114.58 118.74 3cfl h GLU 354 Ca -0.15 -0.22 0.05 0.00 -1.00 0.00 0.00 59.36 58.04 3cfl h GLU 354 Cb 1.79 -0.04 -0.05 0.00 0.50 0.00 0.00 28.75 30.95 3cfl h GLU 354 CO 0.22 0.77 0.05 0.37 -1.00 0.00 0.00 179.01 179.42 3cfl h GLN 355 N 0.55 0.15 -0.07 2.33 4.15 -1.22 -0.38 115.11 120.61 3cfl h GLN 355 Ca 0.09 -0.01 -0.00 0.00 0.77 0.00 0.00 58.65 59.49 3cfl h GLN 355 Cb 0.64 -0.03 -0.00 0.00 0.21 0.00 0.00 27.48 28.29 3cfl h GLN 355 CO 0.05 0.10 0.04 -0.22 -1.93 0.00 0.00 178.83 176.86 3cfl h LYS 356 N 0.16 0.10 -0.67 1.69 1.63 -1.02 -0.98 116.57 117.48 3cfl h LYS 356 Ca 0.16 -0.01 0.05 0.00 -0.85 0.00 0.00 60.65 60.00 3cfl h LYS 356 Cb 0.20 -0.02 -0.05 0.00 -0.60 0.00 0.00 32.23 31.76 3cfl h LYS 356 CO -0.23 0.17 0.39 -0.22 -3.45 0.00 0.00 179.45 176.11 3cfl h LYS 357 N 0.02 0.72 -0.50 1.90 3.64 -1.33 -2.65 116.57 118.37 3cfl h LYS 357 Ca 0.03 -0.04 0.01 0.00 -1.27 0.00 0.00 60.65 59.38 3cfl h LYS 357 Cb 0.09 -0.16 -0.03 0.00 -0.41 0.00 0.00 32.23 31.72 3cfl h LYS 357 CO -0.00 0.48 0.31 0.00 -2.27 0.00 0.00 179.45 177.97 3cfl h GLN 359 N 0.63 1.12 -0.33 0.00 4.20 -0.92 0.40 115.11 120.21 3cfl h GLN 359 Ca 0.19 -0.07 -0.01 0.00 0.06 0.00 0.00 58.65 58.83 3cfl h GLN 359 Cb -0.03 -0.25 -0.02 0.00 0.30 0.00 0.00 27.48 27.48 3cfl h GLN 359 CO -0.07 0.74 0.17 1.96 -0.67 0.00 0.00 178.83 180.97 3cfl h GLN 360 N 1.15 0.46 -0.68 1.46 4.20 -1.20 -0.65 115.11 119.86 3cfl h GLN 360 Ca 0.36 -0.06 -0.03 0.00 0.06 0.00 0.00 58.65 58.98 3cfl h GLN 360 Cb -0.00 -0.09 -0.03 0.00 0.30 0.00 0.00 27.48 27.66 3cfl h GLN 360 CO -0.10 0.40 0.29 2.35 -0.67 0.00 0.00 178.83 181.10 3cfl h TRP 361 N 0.41 1.01 -0.23 2.96 7.01 -0.55 -0.88 115.95 125.68 3cfl h TRP 361 Ca 0.12 -0.07 0.00 0.00 2.11 0.00 0.00 58.89 61.05 3cfl h TRP 361 Cb 0.08 -0.31 -0.01 0.00 -2.10 0.00 0.00 29.16 26.82 3cfl h TRP 361 CO -0.03 0.78 0.15 1.03 -2.79 0.00 0.00 178.44 177.58 3cfl h SER 362 N 0.95 0.27 0.25 2.65 0.87 -0.06 -1.28 113.55 117.21 3cfl h SER 362 Ca 0.23 -0.02 0.01 0.00 -1.23 0.00 0.00 61.79 60.78 3cfl h SER 362 Cb 0.17 -0.07 -0.03 0.00 -0.44 0.00 0.00 62.40 62.03 3cfl h SER 362 CO -0.02 0.21 -0.40 -0.61 -0.53 0.00 0.00 176.83 175.48 3cfl h GLN 363 N 0.31 -0.69 -0.04 2.24 4.15 -0.95 -2.01 115.11 118.13 3cfl h GLN 363 Ca 0.09 0.05 0.01 0.00 0.77 0.00 0.00 58.65 59.56 3cfl h GLN 363 Cb -0.02 0.16 -0.00 0.00 0.21 0.00 0.00 27.48 27.82 3cfl h GLN 363 CO -0.02 -0.46 0.04 1.96 -1.93 0.00 0.00 178.83 178.42 3cfl h GLN 364 N -0.71 0.00 -0.01 1.69 1.08 -1.08 -2.53 115.11 113.55 3cfl h GLN 364 Ca -0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 3cfl h GLN 364 Cb 0.69 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.12 3cfl h GLN 364 CO -0.15 0.00 -0.08 -1.13 -0.95 0.00 0.00 178.83 176.51 3cfl n SER 365 N -4.20 0.66 -2.63 1.46 3.41 -0.49 -4.92 113.62 106.92 3cfl n SER 365 Ca -0.02 -0.87 -0.18 0.00 -0.26 0.00 0.00 58.87 57.54 3cfl n SER 365 Cb 0.13 -0.03 0.04 0.00 -0.26 0.00 0.00 64.21 64.10 3cfl n SER 365 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3cfl n GLY 366 N 1.22 -0.26 2.54 5.00 0.00 -0.95 -2.44 105.19 110.29 3cfl n GLY 366 Ca 0.17 -0.01 -0.06 0.00 0.00 0.00 0.00 46.02 46.12 3cfl n GLY 366 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3cfl n GLN 367 N -3.62 -1.14 0.25 1.61 3.00 -0.77 -4.86 117.38 111.85 3cfl n GLN 367 Ca -0.06 0.60 0.08 0.00 -0.01 0.00 0.00 57.00 57.61 3cfl n GLN 367 Cb 0.58 -4.61 0.62 0.00 0.00 0.00 0.00 30.24 26.83 3cfl n GLN 367 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.06 176.15 3cfl h ASN 368 N 0.00 0.00 -3.69 1.08 2.35 -1.73 -3.40 115.58 110.19 3cfl h ASN 368 Ca -0.12 0.00 -0.65 0.00 -0.55 0.00 0.00 56.30 54.98 3cfl h ASN 368 Cb 0.74 0.00 -0.32 0.00 0.05 0.00 0.00 38.32 38.79 3cfl h ASN 368 CO 0.17 0.06 -0.87 -0.69 -1.65 0.00 0.00 177.43 174.45 3cfl s VAL 369 N -4.88 1.88 0.44 2.81 1.01 -1.26 -1.57 120.40 118.83 3cfl s VAL 369 Ca -0.05 -0.95 0.04 0.00 0.00 0.00 0.00 61.98 61.03 3cfl s VAL 369 Cb 0.16 -1.62 -0.04 0.00 0.00 0.00 0.00 36.38 34.89 3cfl s VAL 369 CO 0.67 0.52 0.03 0.42 0.00 0.00 0.00 175.10 176.74 3cfl s THR 370 N 0.13 1.36 -0.06 3.92 -4.23 0.43 -4.25 115.64 112.93 3cfl s THR 370 Ca -0.10 -2.00 0.04 0.00 -1.18 0.00 0.00 61.69 58.45 3cfl s THR 370 Cb -0.15 -2.53 -0.00 0.00 1.34 0.00 0.00 72.50 71.15 3cfl s THR 370 CO 0.05 0.00 -0.20 0.00 -0.54 0.00 0.00 174.62 173.94 3cfl s ALA 372 N 0.15 2.66 0.00 0.00 0.00 0.12 -4.91 121.76 119.78 3cfl s ALA 372 Ca -0.08 -1.29 0.06 0.00 0.00 0.00 0.00 51.96 50.65 3cfl s ALA 372 Cb -0.14 -0.69 -0.02 0.00 0.00 0.00 0.00 23.12 22.27 3cfl s ALA 372 CO 0.04 0.59 -0.19 0.99 0.00 0.00 0.00 175.76 177.19 3cfl s THR 373 N -1.06 1.49 0.11 0.00 2.01 -1.26 0.31 115.64 117.24 3cfl s THR 373 Ca 0.17 -0.90 0.01 0.00 0.31 0.00 0.00 61.69 61.27 3cfl s THR 373 Cb -0.11 -1.26 -0.04 0.00 0.01 0.00 0.00 72.50 71.10 3cfl s THR 373 CO 0.08 0.34 -0.03 0.00 -0.69 0.00 0.00 174.62 174.32 3cfl s ALA 374 N -0.55 1.00 -0.20 7.40 0.00 -0.11 -4.93 121.76 124.37 3cfl s ALA 374 Ca 0.07 -1.41 0.18 0.00 0.00 0.00 0.00 51.96 50.80 3cfl s ALA 374 Cb -0.08 0.35 0.20 0.00 0.00 0.00 0.00 23.12 23.59 3cfl s ALA 374 CO 0.00 -0.30 1.51 0.77 0.00 0.00 0.00 175.76 177.74 3cfl h SER 375 N 2.91 0.00 -4.96 0.00 0.02 -1.95 -0.13 113.55 109.44 3cfl h SER 375 Ca -0.35 0.00 -0.18 0.00 -0.84 0.00 0.00 61.79 60.42 3cfl h SER 375 Cb 1.18 0.00 -0.15 0.00 0.14 0.00 0.00 62.40 63.57 3cfl h SER 375 CO 0.64 0.37 -0.68 0.42 -1.14 0.00 0.00 176.83 176.43 3cfl s THR 376 N -3.07 0.43 0.15 -2.27 -4.23 -1.26 -4.52 115.64 100.87 3cfl s THR 376 Ca 0.04 -1.88 -0.13 0.00 -1.18 0.00 0.00 61.69 58.54 3cfl s THR 376 Cb 0.07 -1.69 0.04 0.00 1.34 0.00 0.00 72.50 72.26 3cfl s THR 376 CO 0.72 -0.85 1.67 0.74 -0.54 0.00 0.00 174.62 176.36 3cfl h THR 377 N 3.01 1.23 -0.95 3.99 2.02 -1.91 -1.86 112.91 118.44 3cfl h THR 377 Ca -0.35 -0.79 0.11 0.00 0.77 0.00 0.00 66.41 66.15 3cfl h THR 377 Cb 1.16 0.78 -0.08 0.00 -1.74 0.00 0.00 68.15 68.28 3cfl h THR 377 CO 0.64 0.29 0.61 0.44 0.37 0.00 0.00 175.52 177.87 3cfl h ASP 378 N 0.70 0.85 0.16 4.18 3.32 -1.96 -0.61 116.42 123.06 3cfl h ASP 378 Ca 0.16 0.04 -0.13 0.00 0.02 0.00 0.00 57.03 57.12 3cfl h ASP 378 Cb 0.29 -0.14 -0.01 0.00 0.22 0.00 0.00 39.33 39.69 3cfl h ASP 378 CO -0.00 0.47 -0.47 0.44 -1.72 0.00 0.00 179.24 177.96 3cfl h ASP 379 N 0.92 0.40 -0.64 6.45 3.32 -1.90 -2.37 116.42 122.59 3cfl h ASP 379 Ca 0.46 -0.19 -0.07 0.00 0.02 0.00 0.00 57.03 57.25 3cfl h ASP 379 Cb 0.49 -0.11 -0.03 0.00 0.22 0.00 0.00 39.33 39.90 3cfl h ASP 379 CO -0.22 0.81 0.11 0.00 -1.72 0.00 0.00 179.24 178.22 3cfl h ILE 381 N 0.98 1.07 -0.51 0.00 2.04 -0.92 -1.70 117.51 118.46 3cfl h ILE 381 Ca 0.20 -0.37 -0.11 0.00 1.00 0.00 0.00 64.86 65.57 3cfl h ILE 381 Cb 0.42 -0.12 -0.02 0.00 -0.74 0.00 0.00 36.82 36.37 3cfl h ILE 381 CO 0.01 0.20 -0.13 0.58 0.00 0.00 0.00 178.15 178.81 3cfl h VAL 382 N 1.09 1.27 -0.96 1.67 2.07 -1.16 -1.87 116.25 118.36 3cfl h VAL 382 Ca 0.42 -1.28 -0.00 0.00 0.82 0.00 0.00 66.70 66.65 3cfl h VAL 382 Cb 0.21 1.04 -0.05 0.00 -1.52 0.00 0.00 31.29 30.97 3cfl h VAL 382 CO -0.16 0.45 0.58 -0.07 0.02 0.00 0.00 177.57 178.38 3cfl h LEU 383 N 0.85 1.15 -0.35 2.57 3.38 -0.88 -1.01 115.31 121.01 3cfl h LEU 383 Ca 0.13 -0.07 -0.01 0.00 0.09 0.00 0.00 57.88 58.02 3cfl h LEU 383 Cb 0.70 -0.29 -0.02 0.00 0.09 0.00 0.00 40.66 41.14 3cfl h LEU 383 CO 0.05 0.88 0.17 0.58 0.09 0.00 0.00 178.44 180.21 3cfl h VAL 384 N 1.32 1.16 -0.63 1.22 2.07 -1.13 0.14 116.25 120.41 3cfl h VAL 384 Ca 0.34 -0.47 -0.03 0.00 0.82 0.00 0.00 66.70 67.36 3cfl h VAL 384 Cb -0.06 0.83 -0.03 0.00 -1.52 0.00 0.00 31.29 30.50 3cfl h VAL 384 CO -0.06 0.17 0.27 -0.07 0.02 0.00 0.00 177.57 177.90 3cfl h LEU 385 N 0.43 0.82 -1.02 2.57 3.38 -0.97 -1.87 115.31 118.65 3cfl h LEU 385 Ca 0.12 -0.10 0.00 0.00 0.09 0.00 0.00 57.88 57.99 3cfl h LEU 385 Cb 0.12 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 40.66 3cfl h LEU 385 CO -0.02 0.72 0.00 0.11 0.09 0.00 0.00 178.44 179.35 3cfl h LYS 386 N 0.89 0.00 0.00 1.13 1.57 -1.02 -3.47 116.57 115.68 3cfl h LYS 386 Ca 0.21 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.99 3cfl h LYS 386 Cb 0.14 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.45 3cfl h LYS 386 CO -0.02 0.00 0.00 0.41 -0.57 0.00 0.00 179.45 179.27 3cfl n GLY 387 N 0.33 0.59 0.07 3.86 0.00 -0.70 -4.97 105.19 104.37 3cfl n GLY 387 Ca 0.02 -0.65 0.11 0.00 0.00 0.00 0.00 46.02 45.50 3cfl n GLY 387 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3cfl n GLU 388 N -2.67 0.50 -4.40 1.61 1.02 0.42 -4.88 120.64 112.25 3cfl n GLU 388 Ca 0.00 0.02 -0.20 0.00 -0.02 0.00 0.00 57.16 56.96 3cfl n GLU 388 Cb 0.00 -1.69 -0.10 0.00 -0.02 0.00 0.00 31.44 29.63 3cfl n GLU 388 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3cfl s ALA 389 N -3.34 2.17 -0.20 0.62 0.00 -0.91 -4.93 121.76 115.18 3cfl s ALA 389 Ca -0.00 -1.88 0.06 0.00 0.00 0.00 0.00 51.96 50.13 3cfl s ALA 389 Cb 0.12 0.36 -0.16 0.00 0.00 0.00 0.00 23.12 23.44 3cfl s ALA 389 CO 0.81 -0.17 -0.11 -0.25 0.00 0.00 0.00 175.76 176.04 3cfl n ASP 390 N -0.54 1.83 -3.51 0.00 8.00 0.38 -4.15 116.55 118.57 3cfl n ASP 390 Ca -0.05 -0.08 -0.13 0.00 0.71 0.00 0.00 54.79 55.24 3cfl n ASP 390 Cb 0.64 0.07 -0.04 0.00 -0.02 0.00 0.00 41.12 41.77 3cfl n ASP 390 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3cfl s ALA 391 N -2.42 -1.77 0.20 2.24 0.00 -1.14 -4.07 121.76 114.80 3cfl s ALA 391 Ca -0.22 1.13 -0.22 0.00 0.00 0.00 0.00 51.96 52.64 3cfl s ALA 391 Cb 0.07 0.14 0.05 0.00 0.00 0.00 0.00 23.12 23.37 3cfl s ALA 391 CO 0.56 -0.51 0.63 -0.48 0.00 0.00 0.00 175.76 175.97 3cfl s LEU 392 N -1.77 -0.41 -0.15 0.00 2.34 -1.18 -1.56 118.68 115.96 3cfl s LEU 392 Ca -0.03 -0.24 -0.13 0.00 0.06 0.00 0.00 54.13 53.78 3cfl s LEU 392 Cb -0.01 2.60 -0.05 0.00 -0.56 0.00 0.00 46.19 48.18 3cfl s LEU 392 CO -0.01 -1.10 0.29 0.21 -1.06 0.00 0.00 176.35 174.68 3cfl s ASN 393 N -2.82 6.46 0.04 1.48 2.47 -1.26 -1.17 114.94 120.14 3cfl s ASN 393 Ca 0.05 0.54 0.04 0.00 0.42 0.00 0.00 52.86 53.91 3cfl s ASN 393 Cb -0.03 -2.18 -0.02 0.00 -1.45 0.00 0.00 41.25 37.57 3cfl s ASN 393 CO -0.06 0.13 -0.12 -0.76 -3.72 0.00 0.00 177.10 172.57 3cfl s LEU 394 N 0.26 2.17 0.59 3.21 1.43 0.90 -4.91 118.68 122.32 3cfl s LEU 394 Ca 0.17 -0.44 -0.18 0.00 -1.03 0.00 0.00 54.13 52.65 3cfl s LEU 394 Cb -0.13 -0.52 -0.04 0.00 0.03 0.00 0.00 46.19 45.54 3cfl s LEU 394 CO 0.05 0.00 1.17 -0.62 0.23 0.00 0.00 176.35 177.18 3cfl s ASP 395 N -1.11 5.33 0.31 2.29 2.15 -1.26 -1.27 116.67 123.10 3cfl s ASP 395 Ca 0.00 2.28 0.08 0.00 0.43 0.00 0.00 52.55 55.34 3cfl s ASP 395 Cb -0.08 -2.59 0.85 0.00 -0.30 0.00 0.00 42.92 40.81 3cfl s ASP 395 CO 0.01 -1.49 1.71 1.23 -0.17 0.00 0.00 175.17 176.45 3cfl h GLY 396 N 0.87 1.79 1.13 2.66 0.00 -1.81 -0.81 103.07 106.88 3cfl h GLY 396 Ca -0.50 -0.24 0.04 0.00 0.00 0.00 0.00 47.33 46.63 3cfl h GLY 396 CO 0.55 -0.29 0.49 -1.33 0.00 0.00 0.00 176.54 175.97 3cfl h GLY 397 N 0.47 1.03 1.85 4.60 0.00 -1.89 -2.36 103.07 106.77 3cfl h GLY 397 Ca 0.63 -0.35 -0.20 0.00 0.00 0.00 0.00 47.33 47.40 3cfl h GLY 397 CO -0.52 0.30 -0.91 -0.97 0.00 0.00 0.00 176.54 174.44 3cfl h TYR 398 N 0.89 0.20 -0.59 5.60 0.05 -1.29 -3.05 116.97 118.78 3cfl h TYR 398 Ca 0.30 -0.12 0.02 0.00 0.05 0.00 0.00 58.73 58.99 3cfl h TYR 398 Cb 0.09 -0.02 -0.03 0.00 1.01 0.00 0.00 36.73 37.78 3cfl h TYR 398 CO -0.00 0.97 0.39 0.82 -1.05 0.00 0.00 178.16 179.29 3cfl h ILE 399 N 0.07 1.10 -0.28 -2.88 2.04 -0.85 0.16 117.51 116.85 3cfl h ILE 399 Ca -0.04 -0.25 -0.06 0.00 1.00 0.00 0.00 64.86 65.51 3cfl h ILE 399 Cb 1.57 0.31 -0.01 0.00 -0.74 0.00 0.00 36.82 37.96 3cfl h ILE 399 CO 0.13 0.13 -0.06 0.22 0.00 0.00 0.00 178.15 178.57 3cfl h TYR 400 N 0.72 0.61 0.24 1.37 3.20 -1.41 0.81 116.97 122.51 3cfl h TYR 400 Ca 0.23 -0.13 0.00 0.00 3.14 0.00 0.00 58.73 61.97 3cfl h TYR 400 Cb 0.03 -0.15 -0.02 0.00 1.54 0.00 0.00 36.73 38.13 3cfl h TYR 400 CO -0.00 0.74 -0.25 1.15 -1.64 0.00 0.00 178.16 178.16 3cfl h THR 401 N 0.31 0.46 -0.21 1.81 2.02 -1.30 -2.89 112.91 113.11 3cfl h THR 401 Ca 0.07 0.00 -0.03 0.00 0.77 0.00 0.00 66.41 67.23 3cfl h THR 401 Cb 0.54 0.46 -0.01 0.00 -1.74 0.00 0.00 68.15 67.40 3cfl h THR 401 CO 0.03 0.00 0.01 0.00 0.37 0.00 0.00 175.52 175.93 3cfl h ALA 402 N 0.13 1.64 -0.25 6.16 0.00 -0.67 -3.13 119.26 123.14 3cfl h ALA 402 Ca -0.00 -0.12 -0.18 0.00 0.00 0.00 0.00 54.91 54.60 3cfl h ALA 402 Cb 0.50 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.19 3cfl h ALA 402 CO -0.06 0.27 -0.56 0.78 0.00 0.00 0.00 179.25 179.68 3cfl h GLY 403 N 0.56 0.91 1.69 0.00 0.00 -0.75 -0.73 103.07 104.75 3cfl h GLY 403 Ca 0.07 -1.10 0.03 0.00 0.00 0.00 0.00 47.33 46.32 3cfl h GLY 403 CO 0.00 0.99 0.13 0.50 0.00 0.00 0.00 176.54 178.16 3cfl h LYS 404 N 0.59 0.00 -0.34 4.80 1.57 -1.46 -1.74 116.57 119.99 3cfl h LYS 404 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3cfl h LYS 404 Cb 1.18 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.49 3cfl h LYS 404 CO 0.12 0.00 0.00 0.00 -0.57 0.00 0.00 179.45 179.00 3cfl n GLY 406 N 1.39 0.69 3.81 0.00 0.00 -0.65 -5.06 105.19 105.37 3cfl n GLY 406 Ca 0.18 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.87 3cfl n GLY 406 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3cfl s LEU 407 N 0.00 3.79 0.01 0.99 1.43 -0.35 -3.96 118.68 120.59 3cfl s LEU 407 Ca 0.00 1.80 0.06 0.00 -1.03 0.00 0.00 54.13 54.96 3cfl s LEU 407 Cb 0.00 -4.54 -0.02 0.00 0.03 0.00 0.00 46.19 41.66 3cfl s LEU 407 CO 0.00 -0.70 -0.17 0.68 0.23 0.00 0.00 176.35 176.39 3cfl s VAL 408 N -2.19 1.34 0.33 -1.59 -7.23 0.20 -4.09 120.40 107.17 3cfl s VAL 408 Ca 0.64 -0.89 -0.29 0.00 -1.81 0.00 0.00 61.98 59.63 3cfl s VAL 408 Cb -0.14 -1.15 -0.11 0.00 0.56 0.00 0.00 36.38 35.55 3cfl s VAL 408 CO 0.22 0.24 1.42 -2.16 -0.31 0.00 0.00 175.10 174.52 3cfl s PRO 409 N -0.75 4.23 -0.05 4.82 0.04 -1.26 -1.97 135.00 140.05 3cfl s PRO 409 Ca 0.05 2.39 -0.04 0.00 0.04 0.00 0.00 61.00 63.45 3cfl s PRO 409 Cb -0.07 -3.04 -0.03 0.00 0.04 0.00 0.00 34.50 31.40 3cfl s PRO 409 CO 0.00 -0.40 -0.10 0.28 0.04 0.00 0.00 177.00 176.83 3cfl n VAL 410 N 1.12 0.64 -3.79 -0.36 0.31 0.12 -4.94 118.33 111.42 3cfl n VAL 410 Ca 0.02 0.00 -0.13 0.00 -0.01 0.00 0.00 64.34 64.23 3cfl n VAL 410 Cb 0.40 -1.65 -0.11 0.00 -0.91 0.00 0.00 33.84 31.57 3cfl n VAL 410 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 3cfl s LEU 411 N -6.62 1.05 0.07 7.52 1.43 -1.24 -4.52 118.68 116.37 3cfl s LEU 411 Ca -0.10 0.33 0.04 0.00 -1.03 0.00 0.00 54.13 53.36 3cfl s LEU 411 Cb 0.03 0.94 -0.04 0.00 0.03 0.00 0.00 46.19 47.16 3cfl s LEU 411 CO 0.13 -0.21 0.03 0.00 0.23 0.00 0.00 176.35 176.53 3cfl s ALA 412 N -0.39 3.39 0.25 4.21 0.00 -0.38 -0.40 121.76 128.43 3cfl s ALA 412 Ca -0.05 -1.05 -0.30 0.00 0.00 0.00 0.00 51.96 50.55 3cfl s ALA 412 Cb -0.03 -1.30 -0.11 0.00 0.00 0.00 0.00 23.12 21.67 3cfl s ALA 412 CO 0.01 0.71 1.57 -1.21 0.00 0.00 0.00 175.76 176.84 3cfl s GLU 413 N -2.22 4.17 -0.11 0.00 2.02 0.30 0.05 118.70 122.91 3cfl s GLU 413 Ca 0.26 2.49 0.00 0.00 0.02 0.00 0.00 54.97 57.74 3cfl s GLU 413 Cb -0.12 -3.07 0.02 0.00 0.10 0.00 0.00 34.13 31.06 3cfl s GLU 413 CO 0.18 -0.59 -0.10 1.21 0.02 0.00 0.00 175.26 175.98 3cfl s ASN 414 N 0.64 2.21 0.51 -0.19 3.04 0.14 -4.77 114.94 116.52 3cfl s ASN 414 Ca 0.65 -0.34 0.09 0.00 0.04 0.00 0.00 52.86 53.30 3cfl s ASN 414 Cb -0.46 -0.91 0.06 0.00 -1.54 0.00 0.00 41.25 38.40 3cfl s ASN 414 CO 0.42 -0.07 0.69 0.00 -3.04 0.00 0.00 177.10 175.10 3cfl s ARG 415 N 1.45 2.50 0.47 0.43 1.70 -1.26 -0.77 118.95 123.47 3cfl s ARG 415 Ca 0.01 -1.50 -0.24 0.00 -0.47 0.00 0.00 55.73 53.53 3cfl s ARG 415 Cb -0.13 -2.67 -0.07 0.00 -0.57 0.00 0.00 34.95 31.51 3cfl s ARG 415 CO -0.06 -0.63 1.30 -1.59 -1.08 0.00 0.00 175.30 173.24 3cfl s LYS 416 N -4.53 3.61 -0.09 3.89 -2.85 -1.26 -4.78 119.74 113.72 3cfl s LYS 416 Ca 0.58 2.11 -0.09 0.00 -1.00 0.00 0.00 55.97 57.57 3cfl s LYS 416 Cb -0.07 -2.49 0.02 0.00 -2.06 0.00 0.00 37.83 33.23 3cfl s LYS 416 CO 0.36 -0.78 0.26 -1.54 0.10 0.00 0.00 175.35 173.75 3cfl s SER 417 N -0.94 -0.25 0.57 0.03 1.04 -1.26 -5.02 113.70 107.86 3cfl s SER 417 Ca 0.64 0.47 0.35 0.00 0.48 0.00 0.00 55.95 57.89 3cfl s SER 417 Cb -0.37 0.51 1.58 0.00 0.10 0.00 0.00 66.02 67.83 3cfl s SER 417 CO 0.46 -0.12 2.06 0.77 0.98 0.00 0.00 173.24 177.39 3cfl h SER 418 N 5.58 0.00 -2.74 7.02 4.64 -2.01 -3.40 113.55 122.65 3cfl h SER 418 Ca -0.26 0.00 -0.49 0.00 -0.47 0.00 0.00 61.79 60.57 3cfl h SER 418 Cb 1.19 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.28 3cfl h SER 418 CO 0.35 0.02 -0.27 -0.75 -0.87 0.00 0.00 176.83 175.31 3cfl s LYS 419 N -3.79 3.50 -0.65 4.77 2.36 -1.26 -4.22 119.74 120.45 3cfl s LYS 419 Ca -0.00 -0.38 0.00 0.00 -2.55 0.00 0.00 55.97 53.03 3cfl s LYS 419 Cb 0.10 -2.75 0.00 0.00 -1.05 0.00 0.00 37.83 34.13 3cfl s LYS 419 CO 0.52 0.27 0.00 0.72 1.55 0.00 0.00 175.35 178.41 3cfl n HIS 420 N -1.35 -0.20 0.18 4.03 8.25 -1.26 -4.82 115.22 120.05 3cfl n HIS 420 Ca -0.05 0.00 0.16 0.00 -0.26 0.00 0.00 57.72 57.57 3cfl n HIS 420 Cb 0.55 -1.92 0.61 0.00 1.12 0.00 0.00 29.99 30.36 3cfl n HIS 420 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 3cfl h SER 421 N 0.00 0.00 -0.01 0.41 4.64 -1.77 0.22 113.55 117.04 3cfl h SER 421 Ca -0.12 0.00 -0.13 0.00 -0.47 0.00 0.00 61.79 61.06 3cfl h SER 421 Cb 0.70 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.79 3cfl h SER 421 CO 0.18 0.00 -0.50 0.77 -0.87 0.00 0.00 176.83 176.41 3cfl h SER 422 N 0.00 0.47 -3.96 4.97 4.64 -1.93 -3.46 113.55 114.28 3cfl h SER 422 Ca 0.13 -0.75 -0.54 0.00 -0.47 0.00 0.00 61.79 60.17 3cfl h SER 422 Cb 1.34 -0.14 0.11 0.00 -0.31 0.00 0.00 62.40 63.40 3cfl h SER 422 CO -0.00 1.15 0.77 0.18 -0.87 0.00 0.00 176.83 178.05 3cfl n LEU 423 N -4.29 4.95 -4.75 5.97 4.77 0.79 -4.96 117.00 119.47 3cfl n LEU 423 Ca -0.10 1.20 -0.37 0.00 -0.03 0.00 0.00 56.01 56.71 3cfl n LEU 423 Cb 0.62 -1.62 0.03 0.00 -2.33 0.00 0.00 43.42 40.12 3cfl n LEU 423 CO 0.45 0.10 0.90 -0.62 -1.33 0.00 0.00 177.39 176.88 3cfl s ASP 424 N -0.23 5.29 0.20 -1.43 2.15 -1.26 -4.77 116.67 116.62 3cfl s ASP 424 Ca 0.56 2.54 -0.12 0.00 0.43 0.00 0.00 52.55 55.96 3cfl s ASP 424 Cb -0.46 -2.62 0.23 0.00 -0.30 0.00 0.00 42.92 39.77 3cfl s ASP 424 CO 0.62 -1.54 1.72 0.00 -0.17 0.00 0.00 175.17 175.80 3cfl h VAL 426 N 0.26 0.79 0.00 0.00 2.07 -1.92 -2.17 116.25 115.29 3cfl h VAL 426 Ca 0.28 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.80 3cfl h VAL 426 Cb 0.38 0.98 0.00 0.00 -1.52 0.00 0.00 31.29 31.13 3cfl h VAL 426 CO -0.35 0.00 -1.30 0.18 0.02 0.00 0.00 177.57 176.13 3cfl n LEU 427 N -4.25 0.58 -4.75 2.57 4.77 -0.78 -0.85 117.00 114.29 3cfl n LEU 427 Ca -0.02 -0.31 -0.41 0.00 -0.03 0.00 0.00 56.01 55.24 3cfl n LEU 427 Cb 0.13 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.19 3cfl n LEU 427 CO 0.31 0.14 0.93 -0.60 -1.33 0.00 0.00 177.39 176.85 3cfl s ARG 428 N -3.05 4.44 0.71 3.23 3.52 -0.36 -4.96 118.95 122.48 3cfl s ARG 428 Ca 0.02 2.02 -0.16 0.00 -0.13 0.00 0.00 55.73 57.48 3cfl s ARG 428 Cb 0.14 -3.18 0.03 0.00 -1.56 0.00 0.00 34.95 30.38 3cfl s ARG 428 CO 0.82 -0.14 1.23 -2.14 -0.81 0.00 0.00 175.30 174.26 3cfl s PRO 429 N -0.69 2.25 0.40 5.12 0.02 -1.26 -4.89 135.00 135.95 3cfl s PRO 429 Ca 0.52 1.84 -0.19 0.00 0.02 0.00 0.00 61.00 63.19 3cfl s PRO 429 Cb -0.36 -1.84 -0.10 0.00 0.02 0.00 0.00 34.50 32.22 3cfl s PRO 429 CO 0.41 -1.77 0.88 0.95 -0.33 0.00 0.00 177.00 177.15 3cfl s THR 430 N -1.83 4.49 -0.08 0.99 -4.23 -1.26 -5.01 115.64 108.71 3cfl s THR 430 Ca 0.76 1.30 0.20 0.00 -1.18 0.00 0.00 61.69 62.77 3cfl s THR 430 Cb -0.31 -3.61 -0.29 0.00 1.34 0.00 0.00 72.50 69.63 3cfl s THR 430 CO 0.43 -0.28 0.32 -0.62 -0.54 0.00 0.00 174.62 173.93 3cfl n GLU 431 N -0.57 0.71 0.00 3.99 1.02 -1.26 -5.07 120.64 119.46 3cfl n GLU 431 Ca 0.06 -0.13 0.00 0.00 -0.02 0.00 0.00 57.16 57.07 3cfl n GLU 431 Cb 0.54 -1.49 0.00 0.00 -0.02 0.00 0.00 31.44 30.46 3cfl n GLU 431 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3cfl n GLY 432 N 1.49 -0.07 3.69 0.62 0.00 -1.26 -4.96 105.19 104.70 3cfl n GLY 432 Ca -0.13 -1.62 -0.23 0.00 0.00 0.00 0.00 46.02 44.04 3cfl n GLY 432 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3cfl s TYR 433 N -2.97 2.71 -0.28 1.61 -0.85 0.57 -4.83 117.35 113.31 3cfl s TYR 433 Ca 0.00 -0.29 -0.16 0.00 -0.52 0.00 0.00 57.07 56.11 3cfl s TYR 433 Cb 0.00 -1.39 -0.03 0.00 0.38 0.00 0.00 41.96 40.92 3cfl s TYR 433 CO 0.00 0.50 0.40 -0.51 -1.52 0.00 0.00 175.55 174.42 3cfl s LEU 434 N -3.75 4.11 -0.11 -3.49 1.43 -1.26 0.15 118.68 115.76 3cfl s LEU 434 Ca 0.34 0.23 -0.30 0.00 -1.03 0.00 0.00 54.13 53.37 3cfl s LEU 434 Cb -0.05 -2.46 -0.02 0.00 0.03 0.00 0.00 46.19 43.70 3cfl s LEU 434 CO 0.21 -0.24 1.18 0.00 0.23 0.00 0.00 176.35 177.73 3cfl s ALA 435 N 2.12 3.55 0.21 4.21 0.00 -0.26 -0.80 121.76 130.79 3cfl s ALA 435 Ca 0.16 0.50 0.08 0.00 0.00 0.00 0.00 51.96 52.70 3cfl s ALA 435 Cb -0.16 -3.54 -0.05 0.00 0.00 0.00 0.00 23.12 19.38 3cfl s ALA 435 CO 0.10 -0.89 -0.15 0.14 0.00 0.00 0.00 175.76 174.97 3cfl s VAL 436 N 2.64 1.83 -0.16 0.00 -7.23 -0.41 -0.26 120.40 116.80 3cfl s VAL 436 Ca 0.54 -2.24 -0.04 0.00 -1.81 0.00 0.00 61.98 58.43 3cfl s VAL 436 Cb -0.22 -2.08 -0.03 0.00 0.56 0.00 0.00 36.38 34.61 3cfl s VAL 436 CO 0.18 -0.57 -0.04 0.00 -0.31 0.00 0.00 175.10 174.36 3cfl s ALA 437 N -2.92 2.97 -0.05 1.32 0.00 -1.26 -2.64 121.76 119.17 3cfl s ALA 437 Ca 0.23 -0.87 0.06 0.00 0.00 0.00 0.00 51.96 51.39 3cfl s ALA 437 Cb -0.01 -1.57 -0.01 0.00 0.00 0.00 0.00 23.12 21.53 3cfl s ALA 437 CO 0.08 0.13 -0.24 0.08 0.00 0.00 0.00 175.76 175.81 3cfl s VAL 438 N 0.51 1.95 0.29 0.00 1.01 -0.19 -0.93 120.40 123.03 3cfl s VAL 438 Ca -0.03 -1.01 0.02 0.00 0.00 0.00 0.00 61.98 60.96 3cfl s VAL 438 Cb -0.14 -1.65 -0.06 0.00 0.00 0.00 0.00 36.38 34.53 3cfl s VAL 438 CO 0.03 0.54 0.08 0.68 0.00 0.00 0.00 175.10 176.43 3cfl s VAL 439 N -0.14 0.84 0.19 2.92 -7.23 -0.09 -1.25 120.40 115.63 3cfl s VAL 439 Ca -0.03 -2.00 -0.30 0.00 -1.81 0.00 0.00 61.98 57.84 3cfl s VAL 439 Cb -0.13 -2.71 -0.08 0.00 0.56 0.00 0.00 36.38 34.02 3cfl s VAL 439 CO 0.03 -0.00 0.96 -0.54 -0.31 0.00 0.00 175.10 175.24 3cfl s LYS 440 N -3.97 4.78 0.24 4.82 3.01 -1.26 -1.19 119.74 126.17 3cfl s LYS 440 Ca 0.37 1.50 -0.05 0.00 -1.01 0.00 0.00 55.97 56.78 3cfl s LYS 440 Cb 0.08 -3.31 0.40 0.00 -1.01 0.00 0.00 37.83 33.99 3cfl s LYS 440 CO 0.14 0.38 1.79 -0.22 0.51 0.00 0.00 175.35 177.95 3cfl h LYS 441 N 4.68 0.66 0.00 1.68 3.64 -1.18 -2.17 116.57 123.89 3cfl h LYS 441 Ca -0.44 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 58.90 3cfl h LYS 441 Cb 1.20 -0.15 0.00 0.00 -0.41 0.00 0.00 32.23 32.88 3cfl h LYS 441 CO 0.69 0.44 0.00 0.00 -2.27 0.00 0.00 179.45 178.31 3cfl h ALA 442 N 1.46 1.00 -1.05 5.00 0.00 -1.93 -3.28 119.26 120.46 3cfl h ALA 442 Ca 0.39 0.00 -0.73 0.00 0.00 0.00 0.00 54.91 54.57 3cfl h ALA 442 Cb 0.42 0.00 -0.13 0.00 0.00 0.00 0.00 17.79 18.08 3cfl h ALA 442 CO -0.28 0.00 1.98 -1.71 0.00 0.00 0.00 179.25 179.24 3cfl n ASN 443 N -2.70 4.93 -4.78 0.00 2.85 -0.81 -4.98 115.26 109.77 3cfl n ASN 443 Ca -0.02 -2.98 -0.35 0.00 -0.11 0.00 0.00 54.58 51.12 3cfl n ASN 443 Cb 0.09 -1.60 -0.01 0.00 1.24 0.00 0.00 39.78 39.50 3cfl n ASN 443 CO 0.00 0.00 0.00 -1.61 -2.11 0.00 0.00 177.26 173.54 3cfl s GLU 444 N 2.08 3.47 -1.82 1.20 2.02 -1.24 -3.06 118.70 121.35 3cfl s GLU 444 Ca 0.45 1.55 0.00 0.00 0.02 0.00 0.00 54.97 56.99 3cfl s GLU 444 Cb 0.04 -2.03 0.00 0.00 0.10 0.00 0.00 34.13 32.24 3cfl s GLU 444 CO 0.01 -0.74 0.00 0.41 0.02 0.00 0.00 175.26 174.95 3cfl n GLY 445 N 0.06 1.63 3.62 -1.39 0.00 -1.26 -4.96 105.19 102.90 3cfl n GLY 445 Ca 0.11 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.73 3cfl n GLY 445 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3cfl s LEU 446 N -3.91 4.06 0.31 0.99 2.96 -1.17 -4.94 118.68 116.98 3cfl s LEU 446 Ca 0.00 0.61 0.03 0.00 -0.22 0.00 0.00 54.13 54.54 3cfl s LEU 446 Cb 0.00 -2.75 -0.05 0.00 0.50 0.00 0.00 46.19 43.89 3cfl s LEU 446 CO 0.00 -0.32 0.11 0.42 -1.32 0.00 0.00 176.35 175.23 3cfl s THR 447 N 2.39 0.67 0.36 3.68 -4.23 -1.26 -4.97 115.64 112.28 3cfl s THR 447 Ca 0.23 -2.00 0.15 0.00 -1.18 0.00 0.00 61.69 58.89 3cfl s THR 447 Cb -0.16 -2.61 0.35 0.00 1.34 0.00 0.00 72.50 71.43 3cfl s THR 447 CO 0.09 0.00 1.71 -0.25 -0.54 0.00 0.00 174.62 175.63 3cfl h TRP 448 N 2.19 0.86 0.00 3.99 2.91 -1.84 -1.06 115.95 123.00 3cfl h TRP 448 Ca -0.37 0.03 0.00 0.00 1.13 0.00 0.00 58.89 59.68 3cfl h TRP 448 Cb 1.25 -0.24 0.00 0.00 -0.51 0.00 0.00 29.16 29.66 3cfl h TRP 448 CO 0.77 -0.02 0.00 0.09 -1.03 0.00 0.00 178.44 178.25 3cfl n ASN 449 N -4.85 0.00 -0.65 2.65 3.02 -1.26 -3.32 115.26 110.85 3cfl n ASN 449 Ca 0.29 0.06 0.06 0.00 -0.03 0.00 0.00 54.58 54.96 3cfl n ASN 449 Cb 0.90 -0.35 0.18 0.00 -0.61 0.00 0.00 39.78 39.91 3cfl n ASN 449 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 3cfl n SER 450 N -1.35 1.67 0.22 6.41 3.41 -0.40 -4.77 113.62 118.81 3cfl n SER 450 Ca 0.11 -3.61 0.10 0.00 -0.26 0.00 0.00 58.87 55.22 3cfl n SER 450 Cb 0.25 -0.49 0.33 0.00 -0.26 0.00 0.00 64.21 64.04 3cfl n SER 450 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 3cfl h LEU 451 N 0.90 0.00 -9.62 1.04 3.38 -1.54 -3.45 115.31 106.02 3cfl h LEU 451 Ca -0.02 0.00 -0.56 0.00 0.09 0.00 0.00 57.88 57.38 3cfl h LEU 451 Cb 1.10 0.00 0.07 0.00 0.09 0.00 0.00 40.66 41.92 3cfl h LEU 451 CO 0.01 0.18 0.80 1.17 0.09 0.00 0.00 178.44 180.69 3cfl n LYS 452 N -3.22 2.35 -1.04 1.13 4.81 -1.26 -1.69 118.16 119.25 3cfl n LYS 452 Ca 0.02 0.84 -0.01 0.00 -0.87 0.00 0.00 58.31 58.29 3cfl n LYS 452 Cb 0.50 -2.60 -0.01 0.00 0.02 0.00 0.00 35.03 32.94 3cfl n LYS 452 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 3cfl n ASP 453 N 2.91 -4.54 -3.32 3.14 10.43 -0.10 -4.96 116.55 120.11 3cfl n ASP 453 Ca 0.14 0.03 -0.14 0.00 2.57 0.00 0.00 54.79 57.39 3cfl n ASP 453 Cb 0.32 -2.16 0.08 0.00 1.84 0.00 0.00 41.12 41.21 3cfl n ASP 453 CO 0.00 0.00 0.00 0.29 -1.07 0.00 0.00 177.20 176.42 3cfl n LYS 454 N -1.11 -0.10 -4.53 -1.24 4.76 -0.68 -4.04 118.16 111.22 3cfl n LYS 454 Ca -0.01 -1.42 -0.34 0.00 -2.87 0.00 0.00 58.31 53.67 3cfl n LYS 454 Cb 0.27 -0.50 -0.12 0.00 -1.84 0.00 0.00 35.03 32.84 3cfl n LYS 454 CO 0.00 0.00 0.00 0.15 -1.37 0.00 0.00 177.40 176.18 3cfl s LYS 455 N -4.16 3.17 0.10 1.97 1.02 -1.26 -0.94 119.74 119.64 3cfl s LYS 455 Ca 0.39 -0.54 0.07 0.00 0.02 0.00 0.00 55.97 55.92 3cfl s LYS 455 Cb -0.02 -2.73 -0.03 0.00 -0.52 0.00 0.00 37.83 34.52 3cfl s LYS 455 CO 0.26 0.47 -0.18 -1.54 -0.92 0.00 0.00 175.35 173.45 3cfl s SER 456 N -0.28 2.21 -0.16 2.83 1.04 -0.68 0.28 113.70 118.94 3cfl s SER 456 Ca 0.04 -0.69 0.00 0.00 0.48 0.00 0.00 55.95 55.79 3cfl s SER 456 Cb -0.13 -0.10 0.02 0.00 0.10 0.00 0.00 66.02 65.92 3cfl s SER 456 CO 0.02 -0.02 -0.14 0.00 0.98 0.00 0.00 173.24 174.09 3cfl s HIS 458 N 1.46 1.92 0.13 0.00 3.76 -0.41 -1.29 115.29 120.86 3cfl s HIS 458 Ca 0.04 -0.39 -0.20 0.00 -0.15 0.00 0.00 55.06 54.36 3cfl s HIS 458 Cb -0.13 -1.12 -0.03 0.00 1.11 0.00 0.00 32.58 32.41 3cfl s HIS 458 CO -0.11 0.14 1.70 1.79 -0.85 0.00 0.00 174.74 177.42 3cfl h THR 459 N 4.25 0.80 0.00 1.30 1.35 -1.74 -3.40 112.91 115.47 3cfl h THR 459 Ca -0.44 -0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.42 3cfl h THR 459 Cb 1.16 0.80 0.00 0.00 -1.73 0.00 0.00 68.15 68.38 3cfl h THR 459 CO 0.43 0.00 0.00 0.00 -0.25 0.00 0.00 175.52 175.70 3cfl n ALA 460 N -2.40 0.00 -1.60 6.62 0.00 -1.26 -0.83 120.51 121.04 3cfl n ALA 460 Ca -0.02 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 53.00 3cfl n ALA 460 Cb 0.12 0.00 0.01 0.00 0.00 0.00 0.00 19.45 19.58 3cfl n ALA 460 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 3cfl n VAL 461 N -0.08 2.36 -0.91 0.00 0.31 -0.23 -2.96 118.33 116.81 3cfl n VAL 461 Ca 0.00 -0.50 0.00 0.00 -0.01 0.00 0.00 64.34 63.83 3cfl n VAL 461 Cb 0.00 -1.13 0.00 0.00 -0.91 0.00 0.00 33.84 31.80 3cfl n VAL 461 CO 0.00 0.00 0.00 0.47 -1.32 0.00 0.00 176.83 175.98 3cfl n ASP 462 N 0.62 0.00 -4.91 4.52 8.00 -1.26 -4.97 116.55 118.55 3cfl n ASP 462 Ca 0.09 0.00 -0.28 0.00 0.71 0.00 0.00 54.79 55.32 3cfl n ASP 462 Cb 0.38 -0.18 -0.02 0.00 -0.02 0.00 0.00 41.12 41.28 3cfl n ASP 462 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 3cfl s ARG 463 N -0.07 3.60 0.00 -1.24 0.52 -1.16 -3.89 118.95 116.72 3cfl s ARG 463 Ca 0.00 0.02 -0.00 0.00 -0.52 0.00 0.00 55.73 55.23 3cfl s ARG 463 Cb 0.00 -2.58 -0.00 0.00 0.52 0.00 0.00 34.95 32.89 3cfl s ARG 463 CO 0.00 0.11 0.85 1.15 0.02 0.00 0.00 175.30 177.43 3cfl h THR 464 N 1.02 0.00 -0.21 0.02 2.02 -1.93 0.24 112.91 114.08 3cfl h THR 464 Ca -0.48 -0.00 -0.14 0.00 0.77 0.00 0.00 66.41 66.56 3cfl h THR 464 Cb 1.20 0.00 -0.01 0.00 -1.74 0.00 0.00 68.15 67.60 3cfl h THR 464 CO 0.64 0.00 -0.45 0.00 0.37 0.00 0.00 175.52 176.08 3cfl h ALA 465 N -2.00 0.84 0.00 6.16 0.00 -1.91 -1.08 119.26 121.27 3cfl h ALA 465 Ca -0.00 -0.46 -0.07 0.00 0.00 0.00 0.00 54.91 54.38 3cfl h ALA 465 Cb 0.00 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 3cfl h ALA 465 CO 0.00 0.65 -0.41 0.78 0.00 0.00 0.00 179.25 180.28 3cfl h GLY 466 N 1.09 0.00 0.00 0.00 0.00 -1.68 -3.39 103.07 99.10 3cfl h GLY 466 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.36 3cfl h GLY 466 CO 0.08 0.00 0.00 1.87 0.00 0.00 0.00 176.54 178.49 3cfl n TRP 467 N -3.15 -2.20 -0.20 5.60 -0.00 -0.57 -4.23 117.44 112.69 3cfl n TRP 467 Ca 0.02 0.39 -0.07 0.00 -0.00 0.00 0.00 57.50 57.84 3cfl n TRP 467 Cb 0.67 0.55 0.03 0.00 -0.00 0.00 0.00 31.31 32.55 3cfl n TRP 467 CO 0.00 0.00 0.00 -0.91 -0.00 0.00 0.00 177.69 176.78 3cfl h ASN 468 N 0.00 0.74 0.42 5.87 2.35 -0.44 -1.59 115.58 122.93 3cfl h ASN 468 Ca 0.00 -0.12 -0.02 0.00 -0.55 0.00 0.00 56.30 55.61 3cfl h ASN 468 Cb 0.00 -0.19 0.00 0.00 0.05 0.00 0.00 38.32 38.19 3cfl h ASN 468 CO 0.00 0.65 -0.20 0.40 -1.65 0.00 0.00 177.43 176.63 3cfl h ILE 469 N 0.77 0.25 -0.60 2.81 1.08 -1.43 -2.39 117.51 118.00 3cfl h ILE 469 Ca 0.20 -0.62 -0.04 0.00 -0.39 0.00 0.00 64.86 64.01 3cfl h ILE 469 Cb 0.10 0.40 -0.03 0.00 -3.07 0.00 0.00 36.82 34.22 3cfl h ILE 469 CO -0.03 0.05 0.20 1.55 -0.69 0.00 0.00 178.15 179.24 3cfl h PRO 470 N -1.06 0.92 -0.03 2.37 0.13 -1.77 -1.49 132.00 131.07 3cfl h PRO 470 Ca -0.06 -0.19 -0.14 0.00 -0.87 0.00 0.00 66.00 64.74 3cfl h PRO 470 Cb 0.52 -0.14 -0.01 0.00 0.13 0.00 0.00 31.00 31.50 3cfl h PRO 470 CO 0.10 0.81 -0.62 0.52 -0.23 0.00 0.00 178.00 178.57 3cfl h MET 471 N 0.85 0.13 -0.38 0.86 2.86 -1.43 -0.67 114.93 117.15 3cfl h MET 471 Ca 0.20 -0.09 -0.05 0.00 -2.06 0.00 0.00 59.70 57.70 3cfl h MET 471 Cb 0.26 0.02 -0.01 0.00 0.06 0.00 0.00 31.60 31.92 3cfl h MET 471 CO -0.01 0.71 0.06 0.78 1.06 0.00 0.00 176.91 179.51 3cfl h GLY 472 N 1.66 0.69 1.00 8.32 0.00 -1.24 0.69 103.07 114.19 3cfl h GLY 472 Ca -0.01 -0.46 -0.02 0.00 0.00 0.00 0.00 47.33 46.84 3cfl h GLY 472 CO 0.09 0.42 0.33 1.41 0.00 0.00 0.00 176.54 178.79 3cfl h LEU 473 N 0.48 0.83 -0.47 3.11 3.38 -1.07 -2.17 115.31 119.40 3cfl h LEU 473 Ca 0.12 -0.12 -0.13 0.00 0.09 0.00 0.00 57.88 57.83 3cfl h LEU 473 Cb 0.37 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.89 3cfl h LEU 473 CO 0.01 0.72 -0.23 0.40 0.09 0.00 0.00 178.44 179.43 3cfl h ILE 474 N 0.89 1.27 0.08 1.22 2.04 -0.90 -1.34 117.51 120.77 3cfl h ILE 474 Ca 0.22 -1.39 0.01 0.00 1.00 0.00 0.00 64.86 64.70 3cfl h ILE 474 Cb 0.09 1.15 -0.01 0.00 -0.74 0.00 0.00 36.82 37.31 3cfl h ILE 474 CO -0.03 0.48 -0.11 0.58 0.00 0.00 0.00 178.15 179.07 3cfl h VAL 475 N 0.84 0.75 -0.59 1.67 2.07 -0.82 -1.63 116.25 118.54 3cfl h VAL 475 Ca 0.11 0.00 0.09 0.00 0.82 0.00 0.00 66.70 67.71 3cfl h VAL 475 Cb 0.81 0.75 -0.07 0.00 -1.52 0.00 0.00 31.29 31.26 3cfl h VAL 475 CO 0.07 0.00 0.23 0.78 0.02 0.00 0.00 177.57 178.67 3cfl h ASN 476 N -0.22 0.25 -0.31 0.57 4.21 -1.26 0.01 115.58 118.84 3cfl h ASN 476 Ca 0.01 0.07 -0.15 0.00 1.21 0.00 0.00 56.30 57.44 3cfl h ASN 476 Cb 0.23 0.04 -0.01 0.00 -1.12 0.00 0.00 38.32 37.46 3cfl h ASN 476 CO -0.05 0.16 -0.37 1.56 -1.29 0.00 0.00 177.43 177.44 3cfl h GLN 477 N 0.43 0.86 -0.01 0.81 4.20 -1.13 -3.16 115.11 117.10 3cfl h GLN 477 Ca 0.29 -0.44 0.00 0.00 0.06 0.00 0.00 58.65 58.57 3cfl h GLN 477 Cb 0.34 0.01 0.00 0.00 0.30 0.00 0.00 27.48 28.12 3cfl h GLN 477 CO -0.28 1.08 -0.17 0.25 -0.67 0.00 0.00 178.83 179.04 3cfl n THR 478 N -4.06 0.00 -4.06 -0.54 -2.24 -0.62 -4.96 114.28 97.81 3cfl n THR 478 Ca -0.02 -0.18 -0.29 0.00 -2.27 0.00 0.00 64.05 61.29 3cfl n THR 478 Cb 0.53 0.47 -0.03 0.00 -2.10 0.00 0.00 70.33 69.21 3cfl n THR 478 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3cfl n GLY 479 N 1.29 -0.29 3.31 3.38 0.00 -0.03 -4.97 105.19 107.88 3cfl n GLY 479 Ca 0.14 0.15 -0.14 0.00 0.00 0.00 0.00 46.02 46.17 3cfl n GLY 479 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3cfl s SER 480 N -4.02 -0.36 0.00 1.61 0.15 -1.15 -5.04 113.70 104.89 3cfl s SER 480 Ca 0.24 0.51 0.23 0.00 0.70 0.00 0.00 55.95 57.63 3cfl s SER 480 Cb -0.13 0.59 0.60 0.00 -1.71 0.00 0.00 66.02 65.36 3cfl s SER 480 CO 0.91 -0.34 1.48 0.00 1.20 0.00 0.00 173.24 176.49 3cfl n ALA 482 N 0.84 5.89 0.15 0.00 0.00 -1.26 -4.54 120.51 121.59 3cfl n ALA 482 Ca 0.17 -1.63 0.08 0.00 0.00 0.00 0.00 53.44 52.07 3cfl n ALA 482 Cb 0.47 -2.01 0.43 0.00 0.00 0.00 0.00 19.45 18.33 3cfl n ALA 482 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 177.50 179.47 3cfl n PHE 483 N 2.02 0.54 1.83 0.00 -1.74 -1.26 -0.47 117.46 118.39 3cfl n PHE 483 Ca 0.35 0.27 0.15 0.00 -0.56 0.00 0.00 57.45 57.66 3cfl n PHE 483 Cb 0.78 -0.94 0.78 0.00 1.52 0.00 0.00 39.48 41.62 3cfl n PHE 483 CO 0.00 0.00 0.00 -0.40 -0.56 0.00 0.00 176.76 175.80 3cfl n ASP 484 N -2.05 0.48 -0.05 5.98 5.75 -1.26 -3.52 116.55 121.88 3cfl n ASP 484 Ca -0.01 -1.20 0.02 0.00 -0.01 0.00 0.00 54.79 53.59 3cfl n ASP 484 Cb 0.04 -0.00 -0.01 0.00 -1.03 0.00 0.00 41.12 40.12 3cfl n ASP 484 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 3cfl n GLU 485 N -0.61 3.93 0.01 0.11 1.02 0.38 -4.79 120.64 120.70 3cfl n GLU 485 Ca 0.21 -0.22 -0.13 0.00 -0.02 0.00 0.00 57.16 57.00 3cfl n GLU 485 Cb 0.18 -0.78 -0.09 0.00 -0.02 0.00 0.00 31.44 30.73 3cfl n GLU 485 CO 0.00 0.00 0.00 0.35 1.18 0.00 0.00 177.13 178.66 3cfl h PHE 486 N 0.23 -0.05 -3.28 -0.32 3.57 -1.59 -3.44 116.94 112.05 3cfl h PHE 486 Ca 0.00 -0.00 -0.54 0.00 3.53 0.00 0.00 57.97 60.96 3cfl h PHE 486 Cb 0.10 0.02 -0.03 0.00 2.79 0.00 0.00 35.95 38.83 3cfl h PHE 486 CO 0.00 0.36 -0.18 -0.06 -2.23 0.00 0.00 178.31 176.20 3cfl s PHE 487 N -4.47 3.45 0.04 0.41 0.08 -1.26 -0.92 117.98 115.32 3cfl s PHE 487 Ca -0.15 0.70 -0.21 0.00 0.12 0.00 0.00 56.93 57.39 3cfl s PHE 487 Cb 0.02 -2.13 -0.14 0.00 -0.57 0.00 0.00 43.02 40.20 3cfl s PHE 487 CO 0.65 0.29 1.40 0.66 -0.10 0.00 0.00 175.22 178.12 3cfl h SER 488 N 2.35 0.30 -5.07 1.36 4.64 -1.18 -3.45 113.55 112.50 3cfl h SER 488 Ca -0.47 -0.40 -0.12 0.00 -0.47 0.00 0.00 61.79 60.33 3cfl h SER 488 Cb 1.17 -0.08 -0.18 0.00 -0.31 0.00 0.00 62.40 63.00 3cfl h SER 488 CO 0.69 0.64 -0.46 -1.10 -0.87 0.00 0.00 176.83 175.73 3cfl s GLN 489 N -4.60 0.63 0.12 4.77 -0.21 -1.25 -4.87 119.66 114.25 3cfl s GLN 489 Ca -0.14 -0.65 -0.10 0.00 0.02 0.00 0.00 55.36 54.49 3cfl s GLN 489 Cb 0.05 0.25 0.00 0.00 1.00 0.00 0.00 33.01 34.32 3cfl s GLN 489 CO 0.73 -0.17 0.26 -1.12 -2.12 0.00 0.00 175.29 172.87 3cfl s SER 490 N -2.02 0.04 -0.30 5.90 0.01 -0.43 -1.69 113.70 115.20 3cfl s SER 490 Ca -0.06 -0.68 -0.03 0.00 1.31 0.00 0.00 55.95 56.49 3cfl s SER 490 Cb -0.02 0.40 0.04 0.00 0.21 0.00 0.00 66.02 66.65 3cfl s SER 490 CO -0.03 -0.81 0.01 0.00 0.41 0.00 0.00 173.24 172.82 3cfl s ALA 492 N 1.29 2.27 0.19 0.00 0.00 0.15 -1.29 121.76 124.37 3cfl s ALA 492 Ca -0.04 -2.74 -0.33 0.00 0.00 0.00 0.00 51.96 48.85 3cfl s ALA 492 Cb -0.19 -1.88 -0.14 0.00 0.00 0.00 0.00 23.12 20.90 3cfl s ALA 492 CO -0.01 -2.06 1.41 -2.30 0.00 0.00 0.00 175.76 172.81 3cfl n PRO 493 N 3.22 1.84 0.00 0.00 -0.02 -1.26 -2.00 135.00 136.78 3cfl n PRO 493 Ca 0.13 0.66 0.00 0.00 -2.02 0.00 0.00 63.50 62.27 3cfl n PRO 493 Cb 0.37 -2.32 0.00 0.00 -0.02 0.00 0.00 33.50 31.52 3cfl n PRO 493 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3cfl n GLY 494 N 2.53 1.36 3.93 -1.23 0.00 0.04 -1.07 105.19 110.75 3cfl n GLY 494 Ca 0.14 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.89 3cfl n GLY 494 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3cfl s ALA 495 N -2.27 2.85 -0.01 4.61 0.00 -0.85 -4.94 121.76 121.15 3cfl s ALA 495 Ca 0.00 -0.99 -0.30 0.00 0.00 0.00 0.00 51.96 50.67 3cfl s ALA 495 Cb 0.00 -2.69 -0.07 0.00 0.00 0.00 0.00 23.12 20.36 3cfl s ALA 495 CO 0.00 -1.69 1.79 0.34 0.00 0.00 0.00 175.76 176.20 3cfl s ASP 496 N -4.65 6.57 0.63 0.00 2.15 -1.26 -4.88 116.67 115.23 3cfl s ASP 496 Ca 0.65 2.44 0.31 0.00 0.43 0.00 0.00 52.55 56.37 3cfl s ASP 496 Cb -0.09 -2.53 1.68 0.00 -0.30 0.00 0.00 42.92 41.68 3cfl s ASP 496 CO 0.48 -0.98 2.00 -0.65 -0.17 0.00 0.00 175.17 175.85 3cfl h PRO 497 N 9.95 0.00 0.00 4.34 0.11 -1.93 -0.29 132.00 144.18 3cfl h PRO 497 Ca -0.44 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.67 3cfl h PRO 497 Cb 1.20 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.31 3cfl h PRO 497 CO 0.95 0.00 -0.46 0.87 -0.21 0.00 0.00 178.00 179.14 3cfl h LYS 498 N 0.00 0.00 -7.41 1.05 1.57 -1.95 -3.44 116.57 106.39 3cfl h LYS 498 Ca 0.07 0.00 -0.50 0.00 -1.87 0.00 0.00 60.65 58.36 3cfl h LYS 498 Cb 0.68 0.00 0.09 0.00 0.08 0.00 0.00 32.23 33.08 3cfl h LYS 498 CO -0.00 0.00 0.38 -1.54 -0.57 0.00 0.00 179.45 177.72 3cfl s SER 499 N -4.38 5.29 0.56 0.86 1.04 -0.12 -4.97 113.70 111.98 3cfl s SER 499 Ca 0.07 1.33 0.25 0.00 0.48 0.00 0.00 55.95 58.08 3cfl s SER 499 Cb 0.13 -2.16 1.50 0.00 0.10 0.00 0.00 66.02 65.59 3cfl s SER 499 CO 0.69 -1.46 2.09 0.08 0.98 0.00 0.00 173.24 175.62 3cfl h ARG 500 N -0.74 0.00 0.00 4.02 0.11 -1.89 -1.84 114.38 114.04 3cfl h ARG 500 Ca -0.45 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.63 3cfl h ARG 500 Cb 1.24 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.32 3cfl h ARG 500 CO 0.61 0.00 0.00 -0.07 0.10 0.00 0.00 179.97 180.61 3cfl h LEU 501 N 0.00 0.00 -1.62 0.08 3.38 -1.87 -1.01 115.31 114.27 3cfl h LEU 501 Ca 0.11 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.08 3cfl h LEU 501 Cb 0.50 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.25 3cfl h LEU 501 CO -0.00 0.00 0.00 0.00 0.09 0.00 0.00 178.44 178.53 3cfl h ALA 503 N 2.64 1.96 -0.00 0.00 0.00 -0.98 -2.10 119.26 120.78 3cfl h ALA 503 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3cfl h ALA 503 Cb 0.58 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.37 3cfl h ALA 503 CO 0.00 -0.09 -0.78 1.28 0.00 0.00 0.00 179.25 179.66 3cfl n LEU 504 N -4.36 0.93 -4.79 0.00 4.32 0.35 -4.93 117.00 108.53 3cfl n LEU 504 Ca -0.01 -0.36 -0.34 0.00 -0.02 0.00 0.00 56.01 55.28 3cfl n LEU 504 Cb 0.16 -0.08 -0.00 0.00 -1.62 0.00 0.00 43.42 41.88 3cfl n LEU 504 CO 0.33 0.22 0.74 0.00 -1.22 0.00 0.00 177.39 177.46 3cfl n ALA 506 N -1.53 2.60 -0.58 0.00 0.00 -1.26 -4.82 120.51 114.91 3cfl n ALA 506 Ca 0.10 -0.19 0.00 0.00 0.00 0.00 0.00 53.44 53.35 3cfl n ALA 506 Cb 0.52 -0.26 0.00 0.00 0.00 0.00 0.00 19.45 19.71 3cfl n ALA 506 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3cfl n GLY 507 N 1.64 0.19 0.00 0.00 0.00 -1.26 -4.53 105.19 101.23 3cfl n GLY 507 Ca -0.00 -0.92 0.00 0.00 0.00 0.00 0.00 46.02 45.10 3cfl n GLY 507 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3cfl n ASP 508 N -1.52 0.00 -0.34 1.61 5.68 -0.13 -1.60 116.55 120.26 3cfl n ASP 508 Ca 0.00 -0.79 0.29 0.00 -0.50 0.00 0.00 54.79 53.80 3cfl n ASP 508 Cb 0.00 0.00 0.55 0.00 -1.14 0.00 0.00 41.12 40.53 3cfl n ASP 508 CO 0.00 0.00 0.00 0.44 -1.33 0.00 0.00 177.20 176.31 3cfl h ASP 509 N 0.00 0.39 -0.02 -1.12 3.32 -1.88 -1.00 116.42 116.11 3cfl h ASP 509 Ca 0.00 0.22 0.00 0.00 0.02 0.00 0.00 57.03 57.27 3cfl h ASP 509 Cb 0.00 0.21 0.00 0.00 0.22 0.00 0.00 39.33 39.76 3cfl h ASP 509 CO 0.00 -0.31 -0.12 0.00 -1.72 0.00 0.00 179.24 177.09 3cfl n GLN 510 N -5.14 1.56 -0.65 3.56 6.02 -1.26 -4.96 117.38 116.52 3cfl n GLN 510 Ca 0.36 -1.33 0.00 0.00 -0.01 0.00 0.00 57.00 56.01 3cfl n GLN 510 Cb 1.19 -1.34 0.00 0.00 1.02 0.00 0.00 30.24 31.11 3cfl n GLN 510 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3cfl n GLY 511 N 1.09 0.73 3.90 1.08 0.00 -0.38 -5.05 105.19 106.55 3cfl n GLY 511 Ca 0.09 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.83 3cfl n GLY 511 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3cfl s LEU 512 N 0.00 3.50 -1.10 0.99 1.43 -1.26 -4.34 118.68 117.90 3cfl s LEU 512 Ca 0.00 1.03 -0.01 0.00 -1.03 0.00 0.00 54.13 54.12 3cfl s LEU 512 Cb 0.00 -4.00 0.00 0.00 0.03 0.00 0.00 46.19 42.22 3cfl s LEU 512 CO 0.00 -0.68 0.11 0.47 0.23 0.00 0.00 176.35 176.47 3cfl n ASP 513 N -2.40 -4.23 -4.68 2.29 8.00 -1.26 -0.95 116.55 113.31 3cfl n ASP 513 Ca 0.02 -0.06 -0.48 0.00 0.71 0.00 0.00 54.79 54.98 3cfl n ASP 513 Cb 0.55 -3.33 -0.05 0.00 -0.02 0.00 0.00 41.12 38.27 3cfl n ASP 513 CO 0.00 0.00 0.00 1.17 -0.39 0.00 0.00 177.20 177.98 3cfl n LYS 514 N -2.43 2.19 -1.03 -1.24 4.81 -1.26 -2.28 118.16 116.92 3cfl n LYS 514 Ca -0.13 0.80 -0.01 0.00 -0.87 0.00 0.00 58.31 58.10 3cfl n LYS 514 Cb 0.61 -2.63 -0.00 0.00 0.02 0.00 0.00 35.03 33.02 3cfl n LYS 514 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 3cfl s VAL 516 N -1.91 3.22 -1.46 0.00 -7.23 -0.97 -0.78 120.40 111.28 3cfl s VAL 516 Ca 0.00 1.15 -0.09 0.00 -1.81 0.00 0.00 61.98 61.23 3cfl s VAL 516 Cb 0.00 -3.70 0.03 0.00 0.56 0.00 0.00 36.38 33.27 3cfl s VAL 516 CO 0.00 0.22 2.50 -0.81 -0.31 0.00 0.00 175.10 176.70 3cfl n PRO 517 N 0.70 3.78 -3.96 4.82 -0.04 -1.26 -4.46 135.00 134.58 3cfl n PRO 517 Ca 0.01 -2.82 -0.09 0.00 -0.04 0.00 0.00 63.50 60.56 3cfl n PRO 517 Cb 0.45 -2.86 -0.04 0.00 -0.04 0.00 0.00 33.50 31.00 3cfl n PRO 517 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 3cfl s ASN 518 N 1.67 -0.11 0.00 3.54 2.20 -1.26 -4.48 114.94 116.50 3cfl s ASN 518 Ca 0.57 -0.87 0.18 0.00 -0.94 0.00 0.00 52.86 51.80 3cfl s ASN 518 Cb 0.16 0.63 0.98 0.00 -2.00 0.00 0.00 41.25 41.02 3cfl s ASN 518 CO -0.07 -1.21 1.49 -1.54 -2.94 0.00 0.00 177.10 172.83 3cfl n SER 519 N -0.46 0.00 0.15 3.54 3.41 -1.26 -1.53 113.62 117.47 3cfl n SER 519 Ca -0.02 -0.28 0.03 0.00 -0.26 0.00 0.00 58.87 58.34 3cfl n SER 519 Cb 0.61 -0.13 0.43 0.00 -0.26 0.00 0.00 64.21 64.86 3cfl n SER 519 CO 0.00 0.00 0.00 0.11 -0.16 0.00 0.00 175.04 174.99 3cfl h LYS 520 N 0.00 0.16 -6.35 4.33 1.57 -1.94 -3.41 116.57 110.93 3cfl h LYS 520 Ca 0.00 -0.03 -0.55 0.00 -1.87 0.00 0.00 60.65 58.20 3cfl h LYS 520 Cb 0.07 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.35 3cfl h LYS 520 CO 0.00 0.31 0.83 -2.00 -0.57 0.00 0.00 179.45 178.01 3cfl s GLU 521 N -4.71 4.29 0.24 3.15 2.56 -0.58 -3.23 118.70 120.42 3cfl s GLU 521 Ca -0.05 1.92 -0.05 0.00 0.00 0.00 0.00 54.97 56.79 3cfl s GLU 521 Cb 0.16 -3.59 0.44 0.00 2.00 0.00 0.00 34.13 33.13 3cfl s GLU 521 CO 0.72 -0.57 1.72 -0.22 -0.56 0.00 0.00 175.26 176.35 3cfl h LYS 522 N 7.85 0.39 -0.83 4.30 3.64 -1.54 -2.61 116.57 127.77 3cfl h LYS 522 Ca -0.37 -0.02 -0.36 0.00 -1.27 0.00 0.00 60.65 58.63 3cfl h LYS 522 Cb 1.17 -0.09 -0.21 0.00 -0.41 0.00 0.00 32.23 32.69 3cfl h LYS 522 CO 0.90 0.26 0.43 0.66 -2.27 0.00 0.00 179.45 179.43 3cfl n TYR 523 N -5.03 2.65 -2.79 1.91 4.01 -1.26 -4.46 117.16 112.19 3cfl n TYR 523 Ca 0.14 -1.53 -0.38 0.00 -0.16 0.00 0.00 57.90 55.97 3cfl n TYR 523 Cb 0.41 -0.80 -0.06 0.00 -0.31 0.00 0.00 39.34 38.58 3cfl n TYR 523 CO 0.00 0.00 0.00 -0.47 -0.46 0.00 0.00 176.86 175.93 3cfl s TYR 524 N -3.16 3.75 0.00 -0.72 5.04 -0.99 -2.76 117.35 118.52 3cfl s TYR 524 Ca 0.55 1.79 0.00 0.00 -2.44 0.00 0.00 57.07 56.97 3cfl s TYR 524 Cb 0.46 -2.92 0.00 0.00 0.35 0.00 0.00 41.96 39.85 3cfl s TYR 524 CO 0.11 0.27 0.00 0.41 -1.34 0.00 0.00 175.55 175.00 3cfl n GLY 525 N 0.76 -2.42 0.12 8.97 0.00 -0.01 -1.80 105.19 110.81 3cfl n GLY 525 Ca 0.01 -1.58 -0.09 0.00 0.00 0.00 0.00 46.02 44.36 3cfl n GLY 525 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 3cfl h TYR 526 N 0.00 -0.15 -0.33 1.61 0.05 -1.93 -0.44 116.97 115.78 3cfl h TYR 526 Ca 0.00 0.02 -0.06 0.00 0.05 0.00 0.00 58.73 58.74 3cfl h TYR 526 Cb 0.00 0.09 -0.01 0.00 1.01 0.00 0.00 36.73 37.82 3cfl h TYR 526 CO 0.00 -0.11 -0.02 1.15 -1.05 0.00 0.00 178.16 178.14 3cfl h THR 527 N -0.05 1.26 -0.18 -2.88 2.02 -1.88 -2.27 112.91 108.94 3cfl h THR 527 Ca 0.08 -1.00 -0.01 0.00 0.77 0.00 0.00 66.41 66.25 3cfl h THR 527 Cb 0.17 1.26 -0.01 0.00 -1.74 0.00 0.00 68.15 67.83 3cfl h THR 527 CO -0.18 0.33 0.08 1.23 0.37 0.00 0.00 175.52 177.35 3cfl h GLY 528 N 0.39 0.28 1.01 2.16 0.00 -1.27 -0.48 103.07 105.15 3cfl h GLY 528 Ca 0.09 -0.14 0.01 0.00 0.00 0.00 0.00 47.33 47.29 3cfl h GLY 528 CO 0.02 0.14 0.53 0.00 0.00 0.00 0.00 176.54 177.22 3cfl h ALA 529 N 0.93 1.01 -0.26 3.60 0.00 -0.88 -1.06 119.26 122.60 3cfl h ALA 529 Ca 0.06 -0.06 -0.11 0.00 0.00 0.00 0.00 54.91 54.81 3cfl h ALA 529 Cb 0.14 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 3cfl h ALA 529 CO -0.01 0.42 -0.29 0.35 0.00 0.00 0.00 179.25 179.73 3cfl h PHE 530 N 1.08 0.60 -0.23 0.00 3.57 -1.21 -2.62 116.94 118.13 3cfl h PHE 530 Ca 0.29 -0.14 -0.04 0.00 3.53 0.00 0.00 57.97 61.62 3cfl h PHE 530 Cb -0.13 -0.14 -0.01 0.00 2.79 0.00 0.00 35.95 38.46 3cfl h PHE 530 CO -0.02 0.76 -0.02 -0.09 -2.23 0.00 0.00 178.31 176.72 3cfl h ARG 531 N 0.45 0.34 -0.68 1.11 2.43 -0.65 0.01 114.38 117.39 3cfl h ARG 531 Ca 0.06 -0.06 -0.05 0.00 -0.81 0.00 0.00 59.98 59.12 3cfl h ARG 531 Cb 0.74 -0.06 -0.03 0.00 -0.42 0.00 0.00 29.97 30.20 3cfl h ARG 531 CO 0.06 0.38 0.22 0.00 -1.51 0.00 0.00 179.97 179.11 3cfl h LEU 533 N 0.99 0.57 -1.81 0.00 5.85 -1.17 -1.49 115.31 118.25 3cfl h LEU 533 Ca 0.22 -0.69 -0.03 0.00 0.84 0.00 0.00 57.88 58.22 3cfl h LEU 533 Cb 0.29 -0.17 -0.00 0.00 0.37 0.00 0.00 40.66 41.15 3cfl h LEU 533 CO -0.01 1.18 -0.12 0.00 -0.34 0.00 0.00 178.44 179.15 3cfl h ALA 534 N 0.40 1.72 -0.02 1.25 0.00 -0.83 -0.66 119.26 121.12 3cfl h ALA 534 Ca -0.05 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.75 3cfl h ALA 534 Cb 1.22 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.99 3cfl h ALA 534 CO 0.11 0.15 -0.05 0.39 0.00 0.00 0.00 179.25 179.86 3cfl n GLU 535 N -4.27 1.61 -1.87 0.00 1.02 -0.36 -4.94 120.64 111.82 3cfl n GLU 535 Ca -0.03 -1.00 -0.10 0.00 -0.02 0.00 0.00 57.16 56.02 3cfl n GLU 535 Cb 0.20 -1.48 -0.02 0.00 -0.02 0.00 0.00 31.44 30.12 3cfl n GLU 535 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 3cfl n ASP 536 N 0.18 -3.65 -0.02 1.62 8.00 -0.26 -4.91 116.55 117.51 3cfl n ASP 536 Ca 0.17 0.08 -0.17 0.00 0.71 0.00 0.00 54.79 55.59 3cfl n ASP 536 Cb 0.38 -2.60 -0.09 0.00 -0.02 0.00 0.00 41.12 38.80 3cfl n ASP 536 CO 0.00 0.00 0.00 0.58 -0.39 0.00 0.00 177.20 177.39 3cfl h VAL 537 N 0.00 1.35 -2.01 2.53 2.07 -1.50 -3.46 116.25 115.23 3cfl h VAL 537 Ca -0.22 -1.91 -0.61 0.00 0.82 0.00 0.00 66.70 64.78 3cfl h VAL 537 Cb 0.99 2.22 -0.13 0.00 -1.52 0.00 0.00 31.29 32.85 3cfl h VAL 537 CO 0.29 0.58 -0.69 -0.83 0.02 0.00 0.00 177.57 176.93 3cfl s GLY 538 N -3.99 2.09 0.20 2.17 0.00 -0.96 -4.90 107.32 101.92 3cfl s GLY 538 Ca -0.12 -2.01 0.17 0.00 0.00 0.00 0.00 44.72 42.76 3cfl s GLY 538 CO 0.85 -1.99 1.18 -0.55 0.00 0.00 0.00 173.10 172.58 3cfl h ASP 539 N 2.05 0.00 -4.02 1.64 3.32 -0.50 -3.41 116.42 115.49 3cfl h ASP 539 Ca -0.42 0.00 -0.18 0.00 0.02 0.00 0.00 57.03 56.45 3cfl h ASP 539 Cb 1.25 0.00 -0.25 0.00 0.22 0.00 0.00 39.33 40.55 3cfl h ASP 539 CO 0.67 0.45 -0.54 0.54 -1.72 0.00 0.00 179.24 178.64 3cfl s VAL 540 N -3.00 0.02 -0.07 -1.35 0.11 -0.82 -4.44 120.40 110.85 3cfl s VAL 540 Ca 0.01 -0.14 0.05 0.00 -2.93 0.00 0.00 61.98 58.97 3cfl s VAL 540 Cb 0.08 -0.25 -0.01 0.00 -1.53 0.00 0.00 36.38 34.67 3cfl s VAL 540 CO 0.77 -0.08 -0.24 0.00 -3.33 0.00 0.00 175.10 172.22 3cfl s ALA 541 N -0.21 2.19 -0.46 1.54 0.00 -0.38 -0.17 121.76 124.28 3cfl s ALA 541 Ca -0.03 -1.02 -0.11 0.00 0.00 0.00 0.00 51.96 50.80 3cfl s ALA 541 Cb -0.02 -0.74 0.09 0.00 0.00 0.00 0.00 23.12 22.45 3cfl s ALA 541 CO 0.00 0.38 0.34 -0.06 0.00 0.00 0.00 175.76 176.42 3cfl s PHE 542 N -0.01 3.34 0.00 0.00 0.08 -0.41 -1.03 117.98 119.95 3cfl s PHE 542 Ca -0.08 -1.49 0.00 0.00 0.12 0.00 0.00 56.93 55.48 3cfl s PHE 542 Cb -0.15 -3.24 0.00 0.00 -0.57 0.00 0.00 43.02 39.06 3cfl s PHE 542 CO 0.05 -0.90 0.00 1.33 -0.10 0.00 0.00 175.22 175.60 3cfl n VAL 543 N 5.01 0.00 -4.22 -0.44 0.24 -1.08 -3.77 118.33 114.07 3cfl n VAL 543 Ca -0.10 0.00 -0.24 0.00 -2.04 0.00 0.00 64.34 61.96 3cfl n VAL 543 Cb 0.42 0.00 -0.07 0.00 -1.47 0.00 0.00 33.84 32.72 3cfl n VAL 543 CO 0.00 0.00 0.00 -1.59 -2.14 0.00 0.00 176.83 173.10 3cfl s LYS 544 N 0.14 2.24 0.21 7.34 -2.85 -1.26 -1.29 119.74 124.27 3cfl s LYS 544 Ca 0.00 -1.62 -0.10 0.00 -1.00 0.00 0.00 55.97 53.24 3cfl s LYS 544 Cb 0.00 -2.07 0.29 0.00 -2.06 0.00 0.00 37.83 33.99 3cfl s LYS 544 CO 0.00 0.14 1.68 -0.97 0.10 0.00 0.00 175.35 176.31 3cfl h ASN 545 N 1.69 -0.14 -0.25 0.03 -1.24 -1.32 -2.83 115.58 111.51 3cfl h ASN 545 Ca -0.43 0.13 -0.01 0.00 0.71 0.00 0.00 56.30 56.70 3cfl h ASN 545 Cb 1.25 0.21 -0.01 0.00 0.73 0.00 0.00 38.32 40.50 3cfl h ASN 545 CO 0.64 -0.06 0.15 0.44 -1.29 0.00 0.00 177.43 177.32 3cfl h ASP 546 N 0.18 0.33 -0.50 1.15 5.19 -1.97 -2.96 116.42 117.84 3cfl h ASP 546 Ca 0.32 -0.02 0.05 0.00 -0.62 0.00 0.00 57.03 56.76 3cfl h ASP 546 Cb 0.49 -0.08 -0.05 0.00 0.18 0.00 0.00 39.33 39.88 3cfl h ASP 546 CO -0.46 0.27 0.23 0.74 -3.12 0.00 0.00 179.24 176.90 3cfl h THR 547 N 0.38 0.92 -0.02 0.35 2.02 -1.90 -0.74 112.91 113.92 3cfl h THR 547 Ca 0.10 -0.15 0.01 0.00 0.77 0.00 0.00 66.41 67.14 3cfl h THR 547 Cb 0.02 0.43 -0.02 0.00 -1.74 0.00 0.00 68.15 66.84 3cfl h THR 547 CO -0.02 0.08 -0.06 0.58 0.37 0.00 0.00 175.52 176.47 3cfl h VAL 548 N 0.45 0.83 -0.55 3.16 2.07 -1.65 -2.67 116.25 117.89 3cfl h VAL 548 Ca 0.23 0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.70 3cfl h VAL 548 Cb 0.17 0.83 -0.03 0.00 -1.52 0.00 0.00 31.29 30.75 3cfl h VAL 548 CO -0.18 0.00 0.18 -0.50 0.02 0.00 0.00 177.57 177.09 3cfl h TRP 549 N -0.10 0.84 0.00 1.57 4.06 -1.57 -2.95 115.95 117.79 3cfl h TRP 549 Ca 0.03 -0.06 0.00 0.00 2.06 0.00 0.00 58.89 60.92 3cfl h TRP 549 Cb 0.14 -0.25 0.00 0.00 -1.00 0.00 0.00 29.16 28.05 3cfl h TRP 549 CO -0.14 0.68 0.00 0.39 -3.56 0.00 0.00 178.44 175.81 3cfl n GLU 550 N -4.30 0.21 -0.07 0.49 1.02 -0.30 -3.75 120.64 113.93 3cfl n GLU 550 Ca 0.04 0.21 0.09 0.00 -0.02 0.00 0.00 57.16 57.49 3cfl n GLU 550 Cb 0.20 -1.76 0.13 0.00 -0.02 0.00 0.00 31.44 29.99 3cfl n GLU 550 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 3cfl n ASN 551 N -2.13 2.33 -4.14 1.62 3.02 -1.02 -3.67 115.26 111.27 3cfl n ASN 551 Ca 0.05 -3.03 -0.10 0.00 -0.03 0.00 0.00 54.58 51.47 3cfl n ASN 551 Cb 0.38 -0.41 -0.10 0.00 -0.61 0.00 0.00 39.78 39.05 3cfl n ASN 551 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 3cfl s THR 552 N -2.77 0.59 -1.41 3.41 -4.23 -1.16 -4.73 115.64 105.35 3cfl s THR 552 Ca 0.30 -1.77 -0.05 0.00 -1.18 0.00 0.00 61.69 58.98 3cfl s THR 552 Cb 0.26 -1.48 0.01 0.00 1.34 0.00 0.00 72.50 72.63 3cfl s THR 552 CO 0.03 -0.82 0.72 0.59 -0.54 0.00 0.00 174.62 174.60 3cfl n ASN 553 N 0.23 -5.93 0.00 3.99 4.13 0.12 -2.72 115.26 115.08 3cfl n ASN 553 Ca -0.14 -0.33 0.00 0.00 1.68 0.00 0.00 54.58 55.78 3cfl n ASN 553 Cb 0.60 -4.70 0.00 0.00 -1.54 0.00 0.00 39.78 34.14 3cfl n ASN 553 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 3cfl n GLY 554 N -1.60 0.52 0.26 7.41 0.00 -1.26 -4.94 105.19 105.57 3cfl n GLY 554 Ca -0.07 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.09 3cfl n GLY 554 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3cfl h GLU 555 N 1.14 0.00 0.00 1.61 4.39 -1.76 -3.37 114.58 116.58 3cfl h GLU 555 Ca 0.00 0.00 -0.35 0.00 0.34 0.00 0.00 59.36 59.35 3cfl h GLU 555 Cb 0.06 0.00 -0.05 0.00 -0.10 0.00 0.00 28.75 28.65 3cfl h GLU 555 CO 0.00 0.08 -2.07 0.45 -1.16 0.00 0.00 179.01 176.31 3cfl n SER 556 N -3.21 1.94 0.00 1.42 2.88 -1.24 -4.90 113.62 110.50 3cfl n SER 556 Ca 0.00 0.36 0.00 0.00 -1.33 0.00 0.00 58.87 57.90 3cfl n SER 556 Cb 0.35 -0.83 0.00 0.00 -0.75 0.00 0.00 64.21 62.99 3cfl n SER 556 CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 175.04 174.16 3cfl n THR 557 N -4.32 0.00 -2.19 2.46 -2.24 -1.26 -5.00 114.28 101.74 3cfl n THR 557 Ca -0.44 0.00 -0.40 0.00 -2.27 0.00 0.00 64.05 60.95 3cfl n THR 557 Cb 0.78 -0.12 -0.02 0.00 -2.10 0.00 0.00 70.33 68.87 3cfl n THR 557 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3cfl s ALA 558 N -2.32 3.32 0.36 6.98 0.00 -1.26 -4.76 121.76 124.08 3cfl s ALA 558 Ca 0.00 1.13 0.08 0.00 0.00 0.00 0.00 51.96 53.17 3cfl s ALA 558 Cb 0.00 -3.44 0.80 0.00 0.00 0.00 0.00 23.12 20.48 3cfl s ALA 558 CO 0.00 -0.61 1.91 0.38 0.00 0.00 0.00 175.76 177.44 3cfl h ASP 559 N 3.01 0.64 1.08 0.00 2.03 -2.00 0.28 116.42 121.46 3cfl h ASP 559 Ca -0.49 0.02 -0.09 0.00 -0.73 0.00 0.00 57.03 55.74 3cfl h ASP 559 Cb 1.23 -0.11 -0.01 0.00 -0.83 0.00 0.00 39.33 39.61 3cfl h ASP 559 CO 0.64 0.37 -0.45 4.11 -1.03 0.00 0.00 179.24 182.88 3cfl h TRP 560 N 0.71 0.00 0.00 4.15 5.08 -2.02 -3.34 115.95 120.53 3cfl h TRP 560 Ca 0.38 0.00 0.00 0.00 1.08 0.00 0.00 58.89 60.35 3cfl h TRP 560 Cb 0.52 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.68 3cfl h TRP 560 CO -0.00 0.45 -1.82 0.00 -1.28 0.00 0.00 178.44 175.79 3cfl n ALA 561 N -2.27 2.75 -0.22 0.11 0.00 -0.34 -4.64 120.51 115.91 3cfl n ALA 561 Ca 0.01 -0.45 0.02 0.00 0.00 0.00 0.00 53.44 53.01 3cfl n ALA 561 Cb 0.61 -0.64 0.05 0.00 0.00 0.00 0.00 19.45 19.47 3cfl n ALA 561 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 3cfl n LYS 562 N -2.12 -0.09 -0.28 0.00 5.02 0.84 -1.53 118.16 119.99 3cfl n LYS 562 Ca -0.03 0.90 0.10 0.00 -2.02 0.00 0.00 58.31 57.26 3cfl n LYS 562 Cb 0.48 -1.35 0.25 0.00 -0.02 0.00 0.00 35.03 34.40 3cfl n LYS 562 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 3cfl n ASN 563 N -4.91 3.55 -4.72 4.39 3.02 -1.26 -4.30 115.26 111.03 3cfl n ASN 563 Ca 0.08 -1.98 -0.42 0.00 -0.03 0.00 0.00 54.58 52.23 3cfl n ASN 563 Cb 0.26 -0.37 -0.03 0.00 -0.61 0.00 0.00 39.78 39.03 3cfl n ASN 563 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 3cfl s LEU 564 N -1.07 4.41 -0.11 3.41 1.43 -0.58 -4.95 118.68 121.21 3cfl s LEU 564 Ca 0.39 1.98 0.00 0.00 -1.03 0.00 0.00 54.13 55.47 3cfl s LEU 564 Cb 0.21 -3.59 -0.02 0.00 0.03 0.00 0.00 46.19 42.82 3cfl s LEU 564 CO 0.28 -0.35 -0.11 -0.75 0.23 0.00 0.00 176.35 175.65 3cfl s LYS 565 N 0.57 3.23 0.35 1.70 2.36 -1.26 0.16 119.74 126.84 3cfl s LYS 565 Ca 0.54 -0.65 0.13 0.00 -2.55 0.00 0.00 55.97 53.44 3cfl s LYS 565 Cb -0.28 -2.63 0.96 0.00 -1.05 0.00 0.00 37.83 34.83 3cfl s LYS 565 CO 0.31 0.33 1.75 0.00 1.55 0.00 0.00 175.35 179.29 3cfl h ARG 566 N 6.34 0.51 0.00 4.03 3.08 -1.92 -1.57 114.38 124.84 3cfl h ARG 566 Ca -0.32 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 59.70 3cfl h ARG 566 Cb 1.20 -0.12 0.00 0.00 0.08 0.00 0.00 29.97 31.13 3cfl h ARG 566 CO 0.56 0.34 0.00 0.39 -1.07 0.00 0.00 179.97 180.18 3cfl n GLU 567 N -4.76 0.14 -0.05 0.04 -0.58 -1.26 -2.03 120.64 112.14 3cfl n GLU 567 Ca 0.26 0.45 0.10 0.00 -0.42 0.00 0.00 57.16 57.54 3cfl n GLU 567 Cb 0.78 -1.81 0.43 0.00 -0.57 0.00 0.00 31.44 30.26 3cfl n GLU 567 CO 0.00 0.00 0.00 -0.25 -0.48 0.00 0.00 177.13 176.40 3cfl n ASP 568 N -2.08 0.96 -4.32 1.62 8.00 -0.59 -4.81 116.55 115.33 3cfl n ASP 568 Ca 0.01 -1.61 -0.27 0.00 0.71 0.00 0.00 54.79 53.64 3cfl n ASP 568 Cb 0.16 -0.06 -0.13 0.00 -0.02 0.00 0.00 41.12 41.06 3cfl n ASP 568 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 3cfl s PHE 569 N -1.87 2.04 -0.01 1.24 0.08 -0.86 -0.68 117.98 117.92 3cfl s PHE 569 Ca 0.29 -0.40 0.03 0.00 0.12 0.00 0.00 56.93 56.98 3cfl s PHE 569 Cb 0.15 -1.15 -0.01 0.00 -0.57 0.00 0.00 43.02 41.44 3cfl s PHE 569 CO 0.23 0.21 -0.10 1.03 -0.10 0.00 0.00 175.22 176.50 3cfl s ARG 570 N -1.70 0.81 0.12 0.44 1.81 -0.34 -4.43 118.95 115.67 3cfl s ARG 570 Ca 0.10 -0.35 -0.27 0.00 -1.72 0.00 0.00 55.73 53.49 3cfl s ARG 570 Cb -0.10 -0.78 -0.07 0.00 -0.45 0.00 0.00 34.95 33.55 3cfl s ARG 570 CO 0.04 0.21 0.84 -0.51 -0.68 0.00 0.00 175.30 175.20 3cfl s LEU 571 N -0.21 4.53 -0.18 2.53 1.43 -0.06 -0.92 118.68 125.80 3cfl s LEU 571 Ca 0.04 1.66 -0.19 0.00 -1.03 0.00 0.00 54.13 54.60 3cfl s LEU 571 Cb -0.04 -3.39 -0.03 0.00 0.03 0.00 0.00 46.19 42.76 3cfl s LEU 571 CO -0.00 0.07 0.55 -0.76 0.23 0.00 0.00 176.35 176.44 3cfl s LEU 572 N -0.52 4.18 0.24 1.79 1.43 -0.11 -1.83 118.68 123.85 3cfl s LEU 572 Ca 0.40 0.77 0.05 0.00 -1.03 0.00 0.00 54.13 54.33 3cfl s LEU 572 Cb -0.23 -2.78 -0.03 0.00 0.03 0.00 0.00 46.19 43.19 3cfl s LEU 572 CO 0.27 -0.17 0.30 0.00 0.23 0.00 0.00 176.35 176.98 3cfl h LEU 574 N 1.36 0.00 -0.21 0.00 3.38 -1.87 -2.79 115.31 115.18 3cfl h LEU 574 Ca -0.51 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.46 3cfl h LEU 574 Cb 1.23 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.98 3cfl h LEU 574 CO 0.61 0.01 0.00 -0.90 0.09 0.00 0.00 178.44 178.26 3cfl n ASP 575 N -3.11 0.21 0.00 -0.43 5.75 -1.26 -4.85 116.55 112.86 3cfl n ASP 575 Ca 0.01 -1.99 0.00 0.00 -0.01 0.00 0.00 54.79 52.81 3cfl n ASP 575 Cb 0.36 -0.10 0.00 0.00 -1.03 0.00 0.00 41.12 40.34 3cfl n ASP 575 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3cfl n GLY 576 N 0.39 0.77 3.97 6.12 0.00 -1.05 -5.05 105.19 110.34 3cfl n GLY 576 Ca 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.81 3cfl n GLY 576 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3cfl s THR 577 N -2.83 4.46 -0.05 2.61 2.01 -1.25 -4.69 115.64 115.89 3cfl s THR 577 Ca 0.00 -0.76 0.06 0.00 0.31 0.00 0.00 61.69 61.29 3cfl s THR 577 Cb 0.00 -3.59 -0.01 0.00 0.01 0.00 0.00 72.50 68.91 3cfl s THR 577 CO 0.00 -0.31 -0.22 -0.13 -0.69 0.00 0.00 174.62 173.27 3cfl s ARG 578 N -4.27 2.17 0.07 4.92 0.52 -1.26 -1.61 118.95 119.49 3cfl s ARG 578 Ca 0.43 -0.78 0.03 0.00 -0.52 0.00 0.00 55.73 54.89 3cfl s ARG 578 Cb -0.10 -1.88 -0.03 0.00 0.52 0.00 0.00 34.95 33.46 3cfl s ARG 578 CO 0.33 0.34 -0.10 0.15 0.02 0.00 0.00 175.30 176.05 3cfl s LYS 579 N -0.13 0.73 0.87 3.54 1.02 -0.76 -4.97 119.74 120.03 3cfl s LYS 579 Ca -0.02 -0.99 -0.13 0.00 0.02 0.00 0.00 55.97 54.85 3cfl s LYS 579 Cb -0.12 -0.47 0.06 0.00 -0.52 0.00 0.00 37.83 36.77 3cfl s LYS 579 CO 0.03 0.08 0.76 -2.30 -0.92 0.00 0.00 175.35 172.99 3cfl n PRO 580 N 0.96 -0.10 0.07 -1.68 -0.02 -1.26 -0.88 135.00 132.08 3cfl n PRO 580 Ca -0.19 0.03 0.11 0.00 -2.02 0.00 0.00 63.50 61.43 3cfl n PRO 580 Cb 0.56 -2.09 0.44 0.00 -0.02 0.00 0.00 33.50 32.39 3cfl n PRO 580 CO 0.00 0.00 0.00 1.33 1.98 0.00 0.00 175.50 178.81 3cfl n VAL 581 N -3.44 0.74 0.42 -1.45 0.24 -1.26 -1.34 118.33 112.24 3cfl n VAL 581 Ca 0.10 0.12 0.10 0.00 -2.04 0.00 0.00 64.34 62.63 3cfl n VAL 581 Cb 0.52 -0.94 0.44 0.00 -1.47 0.00 0.00 33.84 32.39 3cfl n VAL 581 CO 0.00 0.00 0.00 0.35 -2.14 0.00 0.00 176.83 175.04 3cfl n THR 582 N -1.93 0.89 -1.30 3.34 -2.24 -1.26 -3.76 114.28 108.02 3cfl n THR 582 Ca 0.04 0.24 -0.10 0.00 -2.27 0.00 0.00 64.05 61.96 3cfl n THR 582 Cb 0.26 -1.12 0.21 0.00 -2.10 0.00 0.00 70.33 67.58 3cfl n THR 582 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3cfl n GLU 583 N -2.02 2.28 0.25 -0.78 4.71 -0.45 -4.71 120.64 119.93 3cfl n GLU 583 Ca 0.02 -3.09 0.12 0.00 -0.01 0.00 0.00 57.16 54.20 3cfl n GLU 583 Cb 0.21 -1.98 0.65 0.00 -1.01 0.00 0.00 31.44 29.31 3cfl n GLU 583 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 3cfl h ALA 584 N 1.26 1.20 0.00 0.62 0.00 -1.77 -1.50 119.26 119.08 3cfl h ALA 584 Ca 0.34 -0.14 -0.03 0.00 0.00 0.00 0.00 54.91 55.08 3cfl h ALA 584 Cb 2.12 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 19.88 3cfl h ALA 584 CO 0.65 0.19 -0.15 0.37 0.00 0.00 0.00 179.25 180.31 3cfl h GLN 585 N 0.00 0.00 -0.01 0.00 5.75 -1.92 -2.97 115.11 115.96 3cfl h GLN 585 Ca -0.00 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.50 3cfl h GLN 585 Cb 0.45 0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.00 3cfl h GLN 585 CO 0.02 0.15 -0.07 -1.13 -2.65 0.00 0.00 178.83 175.15 3cfl n SER 586 N -3.95 1.67 -3.15 -0.69 3.41 -0.64 -4.77 113.62 105.50 3cfl n SER 586 Ca -0.02 -1.33 -0.20 0.00 -0.26 0.00 0.00 58.87 57.06 3cfl n SER 586 Cb 0.24 0.16 -0.04 0.00 -0.26 0.00 0.00 64.21 64.31 3cfl n SER 586 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3cfl s HIS 588 N -1.61 1.76 -0.10 0.00 -0.00 -1.21 -4.66 115.29 109.47 3cfl s HIS 588 Ca 0.37 -0.67 0.15 0.00 -0.00 0.00 0.00 55.06 54.90 3cfl s HIS 588 Cb 0.26 -0.92 -0.10 0.00 -0.00 0.00 0.00 32.58 31.82 3cfl s HIS 588 CO -0.10 0.27 1.02 -0.07 -0.00 0.00 0.00 174.74 175.86 3cfl h LEU 589 N 2.45 0.00 -7.13 5.38 3.38 -0.95 -3.43 115.31 115.01 3cfl h LEU 589 Ca -0.39 0.00 0.34 0.00 0.09 0.00 0.00 57.88 57.92 3cfl h LEU 589 Cb 1.22 0.00 -0.14 0.00 0.09 0.00 0.00 40.66 41.84 3cfl h LEU 589 CO 0.64 0.65 0.88 0.00 0.09 0.00 0.00 178.44 180.70 3cfl s ALA 590 N -2.87 -2.29 -0.20 1.53 0.00 -1.21 -5.00 121.76 111.70 3cfl s ALA 590 Ca -0.01 0.95 -0.07 0.00 0.00 0.00 0.00 51.96 52.82 3cfl s ALA 590 Cb 0.08 0.22 -0.04 0.00 0.00 0.00 0.00 23.12 23.39 3cfl s ALA 590 CO 0.80 -0.97 0.07 0.54 0.00 0.00 0.00 175.76 176.19 3cfl s VAL 591 N -2.29 4.67 -0.13 0.00 0.11 -1.26 -1.11 120.40 120.39 3cfl s VAL 591 Ca 0.14 -0.07 -0.08 0.00 -2.93 0.00 0.00 61.98 59.04 3cfl s VAL 591 Cb 0.05 -3.13 -0.04 0.00 -1.53 0.00 0.00 36.38 31.72 3cfl s VAL 591 CO -0.05 0.42 0.14 0.00 -3.33 0.00 0.00 175.10 172.28 3cfl s ALA 592 N 0.77 3.84 0.29 1.54 0.00 0.39 -4.87 121.76 123.72 3cfl s ALA 592 Ca 0.04 -0.64 -0.30 0.00 0.00 0.00 0.00 51.96 51.06 3cfl s ALA 592 Cb -0.13 -2.01 -0.10 0.00 0.00 0.00 0.00 23.12 20.87 3cfl s ALA 592 CO 0.02 0.54 1.46 -1.25 0.00 0.00 0.00 175.76 176.53 3cfl s PRO 593 N -0.79 4.23 0.71 0.00 0.04 -1.26 -0.31 135.00 137.62 3cfl s PRO 593 Ca 0.14 2.38 -0.16 0.00 0.04 0.00 0.00 61.00 63.40 3cfl s PRO 593 Cb -0.12 -3.07 -0.01 0.00 0.04 0.00 0.00 34.50 31.34 3cfl s PRO 593 CO 0.03 -0.44 0.80 0.09 0.04 0.00 0.00 177.00 177.51 3cfl n ASN 594 N 1.83 -0.16 -4.76 6.66 3.02 -1.26 -4.46 115.26 116.12 3cfl n ASN 594 Ca 0.05 0.65 -0.41 0.00 -0.03 0.00 0.00 54.58 54.84 3cfl n ASN 594 Cb 0.40 -1.33 0.01 0.00 -0.61 0.00 0.00 39.78 38.24 3cfl n ASN 594 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 3cfl n HIS 595 N -2.42 2.78 -3.98 3.10 8.25 -1.26 -4.61 115.22 117.09 3cfl n HIS 595 Ca 0.12 0.46 -0.09 0.00 -0.26 0.00 0.00 57.72 57.95 3cfl n HIS 595 Cb 0.49 -2.49 -0.11 0.00 1.12 0.00 0.00 29.99 29.01 3cfl n HIS 595 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3cfl s ALA 596 N -1.14 0.11 -0.01 -1.41 0.00 -0.40 -0.54 121.76 118.36 3cfl s ALA 596 Ca 0.56 -0.61 -0.30 0.00 0.00 0.00 0.00 51.96 51.61 3cfl s ALA 596 Cb -0.48 0.17 -0.05 0.00 0.00 0.00 0.00 23.12 22.76 3cfl s ALA 596 CO 0.62 -0.20 1.29 0.08 0.00 0.00 0.00 175.76 177.55 3cfl s VAL 597 N -1.81 3.97 0.18 0.00 1.01 0.46 -0.07 120.40 124.13 3cfl s VAL 597 Ca -0.12 1.34 0.09 0.00 0.00 0.00 0.00 61.98 63.28 3cfl s VAL 597 Cb -0.07 -3.86 -0.04 0.00 0.00 0.00 0.00 36.38 32.41 3cfl s VAL 597 CO -0.02 0.01 -0.11 0.68 0.00 0.00 0.00 175.10 175.66 3cfl s VAL 598 N 2.11 3.09 0.28 2.92 -7.23 -0.32 0.14 120.40 121.39 3cfl s VAL 598 Ca 0.60 -1.67 -0.13 0.00 -1.81 0.00 0.00 61.98 58.97 3cfl s VAL 598 Cb -0.28 -2.52 0.00 0.00 0.56 0.00 0.00 36.38 34.14 3cfl s VAL 598 CO 0.25 -0.09 0.54 -0.94 -0.31 0.00 0.00 175.10 174.54 3cfl s SER 599 N -2.75 0.03 0.23 4.85 1.04 -0.83 -3.07 113.70 113.19 3cfl s SER 599 Ca 0.24 -0.99 -0.30 0.00 0.48 0.00 0.00 55.95 55.38 3cfl s SER 599 Cb -0.09 0.64 -0.10 0.00 0.10 0.00 0.00 66.02 66.57 3cfl s SER 599 CO 0.14 -1.24 1.44 -0.13 0.98 0.00 0.00 173.24 174.43 3cfl s ARG 600 N -3.72 4.28 0.30 4.02 0.52 -1.26 -0.63 118.95 122.46 3cfl s ARG 600 Ca 0.21 2.27 0.04 0.00 -0.52 0.00 0.00 55.73 57.73 3cfl s ARG 600 Cb -0.02 -3.13 0.78 0.00 0.52 0.00 0.00 34.95 33.10 3cfl s ARG 600 CO 0.11 -0.42 1.63 1.03 0.02 0.00 0.00 175.30 177.66 3cfl h SER 601 N 5.33 -0.06 0.33 0.23 0.87 -1.92 0.26 113.55 118.59 3cfl h SER 601 Ca -0.45 0.22 0.00 0.00 -1.23 0.00 0.00 61.79 60.33 3cfl h SER 601 Cb 1.22 0.31 0.00 0.00 -0.44 0.00 0.00 62.40 63.48 3cfl h SER 601 CO 0.79 -0.22 0.00 -0.90 -0.53 0.00 0.00 176.83 175.98 3cfl n ASP 602 N -5.28 0.27 -0.14 6.23 5.75 -1.26 -2.56 116.55 119.57 3cfl n ASP 602 Ca 0.23 0.59 0.04 0.00 -0.01 0.00 0.00 54.79 55.65 3cfl n ASP 602 Cb 0.75 -0.64 -0.02 0.00 -1.03 0.00 0.00 41.12 40.19 3cfl n ASP 602 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 3cfl n ARG 603 N -1.83 2.77 -0.20 0.11 5.12 0.88 -4.80 116.66 118.72 3cfl n ARG 603 Ca 0.01 -0.39 -0.00 0.00 -1.93 0.00 0.00 57.85 55.54 3cfl n ARG 603 Cb 0.11 -1.01 0.10 0.00 -1.16 0.00 0.00 32.46 30.51 3cfl n ARG 603 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 3cfl h ALA 604 N 1.49 0.75 -0.60 7.54 0.00 -1.19 -1.19 119.26 126.05 3cfl h ALA 604 Ca 0.00 0.10 -0.07 0.00 0.00 0.00 0.00 54.91 54.93 3cfl h ALA 604 Cb 0.28 0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.13 3cfl h ALA 604 CO 0.00 -0.23 0.10 0.00 0.00 0.00 0.00 179.25 179.12 3cfl h ALA 605 N 1.43 1.03 0.13 0.00 0.00 -1.87 -0.52 119.26 119.46 3cfl h ALA 605 Ca 0.30 -0.25 -0.29 0.00 0.00 0.00 0.00 54.91 54.67 3cfl h ALA 605 Cb 0.40 -0.24 0.03 0.00 0.00 0.00 0.00 17.79 17.98 3cfl h ALA 605 CO -0.33 0.62 -1.23 1.25 0.00 0.00 0.00 179.25 179.57 3cfl h HIS 606 N 0.92 0.99 -0.38 0.00 6.17 -1.77 -2.66 115.15 118.42 3cfl h HIS 606 Ca 0.19 -0.63 0.00 0.00 0.71 0.00 0.00 60.37 60.64 3cfl h HIS 606 Cb 0.40 -0.08 -0.02 0.00 2.52 0.00 0.00 27.41 30.24 3cfl h HIS 606 CO 0.03 1.47 0.24 0.28 0.71 0.00 0.00 177.93 180.66 3cfl h VAL 607 N 0.23 1.11 -0.01 5.26 2.07 -1.08 -2.54 116.25 121.29 3cfl h VAL 607 Ca -0.19 -0.22 0.03 0.00 0.82 0.00 0.00 66.70 67.14 3cfl h VAL 607 Cb 1.91 0.57 -0.04 0.00 -1.52 0.00 0.00 31.29 32.21 3cfl h VAL 607 CO 0.23 0.11 -0.22 -0.08 0.02 0.00 0.00 177.57 177.64 3cfl h GLU 608 N 0.51 -0.33 -0.51 1.57 4.81 -1.12 -1.42 114.58 118.10 3cfl h GLU 608 Ca 0.14 0.02 0.05 0.00 -0.13 0.00 0.00 59.36 59.45 3cfl h GLU 608 Cb -0.03 0.07 -0.05 0.00 0.63 0.00 0.00 28.75 29.37 3cfl h GLU 608 CO -0.03 -0.22 0.23 0.37 -0.73 0.00 0.00 179.01 178.63 3cfl h GLN 609 N -0.34 0.43 -0.44 1.92 4.15 -1.40 -1.71 115.11 117.72 3cfl h GLN 609 Ca 0.06 -0.03 -0.05 0.00 0.77 0.00 0.00 58.65 59.41 3cfl h GLN 609 Cb 0.42 -0.10 -0.02 0.00 0.21 0.00 0.00 27.48 28.00 3cfl h GLN 609 CO -0.20 0.29 0.10 0.28 -1.93 0.00 0.00 178.83 177.36 3cfl h VAL 610 N 0.45 1.24 -0.52 2.39 2.07 -1.31 -2.92 116.25 117.64 3cfl h VAL 610 Ca 0.23 -0.83 -0.08 0.00 0.82 0.00 0.00 66.70 66.84 3cfl h VAL 610 Cb 0.19 0.93 -0.02 0.00 -1.52 0.00 0.00 31.29 30.87 3cfl h VAL 610 CO -0.19 0.29 0.03 -0.07 0.02 0.00 0.00 177.57 177.65 3cfl h LEU 611 N 0.58 0.88 -0.71 2.57 4.07 -0.88 0.16 115.31 121.98 3cfl h LEU 611 Ca 0.14 -0.29 0.06 0.00 0.08 0.00 0.00 57.88 57.87 3cfl h LEU 611 Cb 0.34 -0.24 -0.06 0.00 1.08 0.00 0.00 40.66 41.78 3cfl h LEU 611 CO 0.00 0.95 0.40 -0.07 -1.08 0.00 0.00 178.44 178.65 3cfl h LEU 612 N 0.77 0.60 -0.61 1.67 3.38 -1.37 -0.69 115.31 119.07 3cfl h LEU 612 Ca 0.15 0.03 -0.13 0.00 0.09 0.00 0.00 57.88 58.03 3cfl h LEU 612 Cb 0.49 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.14 3cfl h LEU 612 CO 0.02 0.38 -0.25 -0.74 0.09 0.00 0.00 178.44 177.95 3cfl h HIS 613 N 0.73 0.97 -0.84 1.13 2.76 -1.26 -2.73 115.15 115.91 3cfl h HIS 613 Ca 0.32 -0.23 0.01 0.00 -2.20 0.00 0.00 60.37 58.27 3cfl h HIS 613 Cb 0.20 -0.23 -0.04 0.00 1.55 0.00 0.00 27.41 28.89 3cfl h HIS 613 CO -0.07 1.00 0.55 1.96 -1.30 0.00 0.00 177.93 180.07 3cfl h GLN 614 N 0.73 1.09 0.00 5.26 1.08 -0.29 -3.04 115.11 119.94 3cfl h GLN 614 Ca 0.09 -0.07 -0.16 0.00 -1.45 0.00 0.00 58.65 57.07 3cfl h GLN 614 Cb 0.78 -0.25 -0.02 0.00 -0.05 0.00 0.00 27.48 27.95 3cfl h GLN 614 CO 0.06 0.72 -0.74 -0.56 -0.95 0.00 0.00 178.83 177.37 3cfl h GLN 615 N 1.12 0.00 -0.73 1.46 3.07 -1.10 -0.52 115.11 118.41 3cfl h GLN 615 Ca 0.31 0.00 0.18 0.00 0.09 0.00 0.00 58.65 59.23 3cfl h GLN 615 Cb -0.11 0.00 -0.04 0.00 0.08 0.00 0.00 27.48 27.41 3cfl h GLN 615 CO -0.08 0.74 0.51 0.00 0.09 0.00 0.00 178.83 180.09 3cfl h ALA 616 N 1.26 2.36 0.06 0.06 0.00 -1.38 0.17 119.26 121.80 3cfl h ALA 616 Ca -0.01 -0.01 -0.35 0.00 0.00 0.00 0.00 54.91 54.54 3cfl h ALA 616 Cb 1.32 -0.00 -0.04 0.00 0.00 0.00 0.00 17.79 19.07 3cfl h ALA 616 CO 0.10 -0.57 -2.00 1.28 0.00 0.00 0.00 179.25 178.06 3cfl n LEU 617 N -4.42 2.48 0.00 0.00 4.77 -0.98 -2.37 117.00 116.48 3cfl n LEU 617 Ca 0.14 0.20 0.00 0.00 -0.03 0.00 0.00 56.01 56.32 3cfl n LEU 617 Cb 0.65 -1.02 0.00 0.00 -2.33 0.00 0.00 43.42 40.72 3cfl n LEU 617 CO 0.35 0.72 0.30 0.49 -1.33 0.00 0.00 177.39 177.92 3cfl n PHE 618 N -3.72 0.00 -0.55 -1.77 3.72 -0.24 -0.32 117.46 114.59 3cfl n PHE 618 Ca -0.37 -0.10 0.00 0.00 -0.05 0.00 0.00 57.45 56.93 3cfl n PHE 618 Cb 0.94 -0.01 0.00 0.00 -0.94 0.00 0.00 39.48 39.47 3cfl n PHE 618 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3cfl n GLY 619 N -0.10 -1.45 0.23 1.37 0.00 0.59 -1.20 105.19 104.63 3cfl n GLY 619 Ca 0.00 -1.58 0.00 0.00 0.00 0.00 0.00 46.02 44.44 3cfl n GLY 619 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 3cfl h LYS 620 N 0.00 0.27 -0.42 1.61 3.64 -1.79 -1.41 116.57 118.47 3cfl h LYS 620 Ca 0.00 -0.02 -0.27 0.00 -1.27 0.00 0.00 60.65 59.09 3cfl h LYS 620 Cb 0.00 -0.06 -0.18 0.00 -0.41 0.00 0.00 32.23 31.58 3cfl h LYS 620 CO 0.00 0.18 -0.33 0.09 -2.27 0.00 0.00 179.45 177.12 3cfl n ASN 621 N -5.10 3.31 -4.77 4.20 4.13 -1.26 -4.90 115.26 110.88 3cfl n ASN 621 Ca 0.08 -3.82 -0.33 0.00 1.68 0.00 0.00 54.58 52.20 3cfl n ASN 621 Cb 0.30 -0.55 0.06 0.00 -1.54 0.00 0.00 39.78 38.04 3cfl n ASN 621 CO 0.00 0.00 0.00 -0.83 0.28 0.00 0.00 177.26 176.71 3cfl s GLY 622 N -2.97 2.07 0.57 7.41 0.00 -0.53 -4.89 107.32 108.97 3cfl s GLY 622 Ca 0.46 0.51 0.27 0.00 0.00 0.00 0.00 44.72 45.95 3cfl s GLY 622 CO -0.01 0.86 2.05 0.50 0.00 0.00 0.00 173.10 176.50 3cfl h LYS 623 N -0.19 0.00 0.00 2.90 1.57 -1.20 -2.80 116.57 116.85 3cfl h LYS 623 Ca -0.46 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.32 3cfl h LYS 623 Cb 1.25 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.56 3cfl h LYS 623 CO 0.53 0.00 0.00 0.09 -0.57 0.00 0.00 179.45 179.50 3cfl n ASN 624 N -4.02 1.15 0.20 0.86 3.02 0.56 -4.87 115.26 112.16 3cfl n ASN 624 Ca 0.04 -1.29 -0.08 0.00 -0.03 0.00 0.00 54.58 53.22 3cfl n ASN 624 Cb 0.42 0.00 -0.04 0.00 -0.61 0.00 0.00 39.78 39.55 3cfl n ASN 624 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3cfl h PRO 626 N -0.70 1.01 0.19 0.00 0.11 -1.81 -2.96 132.00 127.84 3cfl h PRO 626 Ca -0.05 -0.06 -0.01 0.00 0.11 0.00 0.00 66.00 65.99 3cfl h PRO 626 Cb 0.41 -0.23 0.00 0.00 0.11 0.00 0.00 31.00 31.29 3cfl h PRO 626 CO 0.09 0.67 -0.09 -0.44 -0.21 0.00 0.00 178.00 178.02 3cfl h ASP 627 N 1.04 -0.21 0.00 -2.05 3.32 -1.84 -3.42 116.42 113.26 3cfl h ASP 627 Ca 0.34 0.01 -0.07 0.00 0.02 0.00 0.00 57.03 57.33 3cfl h ASP 627 Cb 0.06 0.05 -0.01 0.00 0.22 0.00 0.00 39.33 39.65 3cfl h ASP 627 CO -0.11 0.01 -0.95 0.29 -1.72 0.00 0.00 179.24 176.76 3cfl n LYS 628 N -3.57 0.50 -3.68 3.56 5.02 0.18 -5.05 118.16 115.12 3cfl n LYS 628 Ca -0.03 0.40 -0.11 0.00 -2.02 0.00 0.00 58.31 56.55 3cfl n LYS 628 Cb 0.10 -1.59 -0.09 0.00 -0.02 0.00 0.00 35.03 33.43 3cfl n LYS 628 CO 0.00 0.00 0.00 0.12 -0.52 0.00 0.00 177.40 177.00 3cfl s PHE 629 N -2.51 -0.70 -0.29 2.13 5.36 -0.48 -5.01 117.98 116.47 3cfl s PHE 629 Ca -0.23 1.55 -0.04 0.00 -0.96 0.00 0.00 56.93 57.25 3cfl s PHE 629 Cb 0.04 0.32 0.03 0.00 -0.34 0.00 0.00 43.02 43.08 3cfl s PHE 629 CO 0.36 -0.36 0.02 0.00 -1.46 0.00 0.00 175.22 173.78 3cfl h LEU 631 N 8.10 0.77 -3.32 0.00 3.38 -1.49 -2.97 115.31 119.79 3cfl h LEU 631 Ca -0.27 0.10 0.00 0.00 0.09 0.00 0.00 57.88 57.80 3cfl h LEU 631 Cb 1.09 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.81 3cfl h LEU 631 CO 0.57 0.26 0.00 0.49 0.09 0.00 0.00 178.44 179.85 3cfl n PHE 632 N -4.77 1.79 -4.43 1.13 3.72 -1.26 -4.72 117.46 108.92 3cfl n PHE 632 Ca 0.24 -0.66 -0.30 0.00 -0.05 0.00 0.00 57.45 56.68 3cfl n PHE 632 Cb 0.59 -0.38 -0.12 0.00 -0.94 0.00 0.00 39.48 38.64 3cfl n PHE 632 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 176.76 176.86 3cfl s LYS 633 N -2.31 1.95 -0.17 -1.08 3.01 -1.12 -4.22 119.74 115.81 3cfl s LYS 633 Ca 0.53 -1.07 0.05 0.00 -1.01 0.00 0.00 55.97 54.47 3cfl s LYS 633 Cb 0.37 -2.18 0.17 0.00 -1.01 0.00 0.00 37.83 35.19 3cfl s LYS 633 CO 0.20 0.51 0.97 -1.13 0.51 0.00 0.00 175.35 176.41 3cfl n SER 634 N 1.09 -0.73 -3.78 2.83 3.41 -1.26 -4.92 113.62 110.26 3cfl n SER 634 Ca -0.16 -1.57 -0.28 0.00 -0.26 0.00 0.00 58.87 56.60 3cfl n SER 634 Cb 0.52 0.40 0.01 0.00 -0.26 0.00 0.00 64.21 64.88 3cfl n SER 634 CO 0.00 0.00 0.00 -1.84 -0.16 0.00 0.00 175.04 173.04 3cfl n GLU 635 N -0.63 -1.03 -0.93 4.33 0.28 -1.26 -2.02 120.64 119.38 3cfl n GLU 635 Ca -0.09 0.44 0.00 0.00 -0.16 0.00 0.00 57.16 57.35 3cfl n GLU 635 Cb 0.67 -1.97 0.00 0.00 1.43 0.00 0.00 31.44 31.56 3cfl n GLU 635 CO 0.00 0.00 0.00 -2.37 -0.16 0.00 0.00 177.13 174.60 3cfl n THR 636 N -3.08 0.00 0.93 3.84 5.66 -1.26 -4.85 114.28 115.52 3cfl n THR 636 Ca -0.23 0.00 0.11 0.00 -3.05 0.00 0.00 64.05 60.88 3cfl n THR 636 Cb 0.58 -0.39 0.01 0.00 -1.55 0.00 0.00 70.33 68.98 3cfl n THR 636 CO 0.00 0.00 0.00 0.29 -3.05 0.00 0.00 175.07 172.31 3cfl n LYS 637 N -1.43 0.04 -3.67 1.09 5.02 -0.86 -4.83 118.16 113.53 3cfl n LYS 637 Ca 0.00 -0.01 -0.25 0.00 -2.02 0.00 0.00 58.31 56.03 3cfl n LYS 637 Cb 0.16 -1.51 0.03 0.00 -0.02 0.00 0.00 35.03 33.69 3cfl n LYS 637 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 3cfl n ASN 638 N -1.56 -3.35 -4.67 4.39 5.03 -1.26 -4.94 115.26 108.90 3cfl n ASN 638 Ca 0.04 -0.91 -0.39 0.00 0.87 0.00 0.00 54.58 54.19 3cfl n ASN 638 Cb 0.35 -3.79 -0.07 0.00 -1.02 0.00 0.00 39.78 35.25 3cfl n ASN 638 CO 0.00 0.00 0.00 -0.76 -1.83 0.00 0.00 177.26 174.67 3cfl s LEU 639 N -6.48 4.16 0.00 3.41 1.43 -1.26 -4.45 118.68 115.49 3cfl s LEU 639 Ca 0.25 0.61 0.00 0.00 -1.03 0.00 0.00 54.13 53.96 3cfl s LEU 639 Cb -0.07 -2.62 0.00 0.00 0.03 0.00 0.00 46.19 43.53 3cfl s LEU 639 CO 0.83 -0.12 0.00 0.18 0.23 0.00 0.00 176.35 177.47 3cfl n LEU 640 N 4.58 0.00 -4.22 1.79 4.77 -1.26 -4.72 117.00 117.94 3cfl n LEU 640 Ca -0.06 0.00 -0.16 0.00 -0.03 0.00 0.00 56.01 55.76 3cfl n LEU 640 Cb 0.51 0.00 -0.11 0.00 -2.33 0.00 0.00 43.42 41.49 3cfl n LEU 640 CO 0.41 0.00 -0.43 -0.36 -1.33 0.00 0.00 177.39 175.68 3cfl s PHE 641 N 0.00 1.23 0.38 -1.77 0.08 -1.26 -4.48 117.98 112.16 3cfl s PHE 641 Ca 0.00 -0.64 -0.28 0.00 0.12 0.00 0.00 56.93 56.13 3cfl s PHE 641 Cb 0.00 -0.65 -0.10 0.00 -0.57 0.00 0.00 43.02 41.70 3cfl s PHE 641 CO 0.00 0.07 1.43 -0.80 -0.10 0.00 0.00 175.22 175.82 3cfl s ASN 642 N -2.60 6.39 0.54 1.36 0.01 -1.26 -4.44 114.94 114.93 3cfl s ASN 642 Ca 0.09 2.94 0.28 0.00 -0.71 0.00 0.00 52.86 55.46 3cfl s ASN 642 Cb -0.03 -2.66 1.52 0.00 0.41 0.00 0.00 41.25 40.49 3cfl s ASN 642 CO 0.01 -0.83 2.10 0.44 -1.51 0.00 0.00 177.10 177.32 3cfl h ASP 643 N 3.00 0.00 -0.14 -1.22 3.32 -1.91 -2.70 116.42 116.77 3cfl h ASP 643 Ca -0.50 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.55 3cfl h ASP 643 Cb 1.24 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.79 3cfl h ASP 643 CO 0.64 0.10 0.00 -0.46 -1.72 0.00 0.00 179.24 177.80 3cfl n ASN 644 N -3.63 0.87 -4.66 6.45 0.23 -1.26 -4.77 115.26 108.48 3cfl n ASN 644 Ca -0.02 -1.83 -0.42 0.00 -0.53 0.00 0.00 54.58 51.77 3cfl n ASN 644 Cb 0.22 -0.09 -0.03 0.00 -2.08 0.00 0.00 39.78 37.80 3cfl n ASN 644 CO 0.00 0.00 0.00 -0.89 -0.93 0.00 0.00 177.26 175.44 3cfl s THR 645 N -1.82 3.84 -0.01 5.53 2.01 -1.02 -4.42 115.64 119.75 3cfl s THR 645 Ca 0.18 1.02 -0.21 0.00 0.31 0.00 0.00 61.69 62.99 3cfl s THR 645 Cb 0.09 -3.66 -0.24 0.00 0.01 0.00 0.00 72.50 68.70 3cfl s THR 645 CO 0.14 -0.09 1.06 -0.08 -0.69 0.00 0.00 174.62 174.97 3cfl h GLU 646 N 9.02 0.37 -2.71 4.92 4.81 -1.26 -3.46 114.58 126.26 3cfl h GLU 646 Ca -0.35 -0.42 0.11 0.00 -0.13 0.00 0.00 59.36 58.57 3cfl h GLU 646 Cb 1.15 0.12 -0.07 0.00 0.63 0.00 0.00 28.75 30.59 3cfl h GLU 646 CO 0.96 1.10 0.34 0.00 -0.73 0.00 0.00 179.01 180.68 3cfl s LEU 648 N -2.91 4.25 -0.07 0.00 1.43 -1.26 -0.68 118.68 119.44 3cfl s LEU 648 Ca 0.11 0.93 -0.01 0.00 -1.03 0.00 0.00 54.13 54.13 3cfl s LEU 648 Cb -0.04 -2.86 -0.03 0.00 0.03 0.00 0.00 46.19 43.29 3cfl s LEU 648 CO 0.04 -0.11 -0.01 0.00 0.23 0.00 0.00 176.35 176.50 3cfl s ALA 649 N 1.02 3.22 0.75 4.21 0.00 0.11 -4.55 121.76 126.52 3cfl s ALA 649 Ca 0.30 -0.84 -0.14 0.00 0.00 0.00 0.00 51.96 51.28 3cfl s ALA 649 Cb -0.16 -1.41 0.05 0.00 0.00 0.00 0.00 23.12 21.60 3cfl s ALA 649 CO 0.13 0.59 1.19 0.15 0.00 0.00 0.00 175.76 177.82 3cfl s LYS 650 N -0.94 2.06 -0.11 0.00 1.02 -0.03 -1.25 119.74 120.49 3cfl s LYS 650 Ca 0.14 1.68 -0.06 0.00 0.02 0.00 0.00 55.97 57.75 3cfl s LYS 650 Cb -0.11 -1.83 -0.02 0.00 -0.52 0.00 0.00 37.83 35.35 3cfl s LYS 650 CO 0.03 -1.88 -0.12 -0.07 -0.92 0.00 0.00 175.35 172.40 3cfl h LEU 651 N -0.49 0.00 -0.59 3.17 3.38 -1.88 -3.46 115.31 115.45 3cfl h LEU 651 Ca -0.47 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.50 3cfl h LEU 651 Cb 1.29 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.04 3cfl h LEU 651 CO 0.49 0.60 0.00 0.61 0.09 0.00 0.00 178.44 180.24 3cfl n GLY 652 N 1.68 -1.42 1.10 0.83 0.00 -1.26 -4.87 105.19 101.24 3cfl n GLY 652 Ca -0.05 -0.96 0.00 0.00 0.00 0.00 0.00 46.02 45.02 3cfl n GLY 652 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3cfl n GLY 653 N 1.34 0.71 3.43 -0.02 0.00 -1.26 -4.48 105.19 104.91 3cfl n GLY 653 Ca 0.00 -0.14 -0.10 0.00 0.00 0.00 0.00 46.02 45.77 3cfl n GLY 653 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3cfl n ARG 654 N -2.55 -0.66 -2.37 1.61 1.74 -1.26 -4.74 116.66 108.43 3cfl n ARG 654 Ca 0.00 -0.14 -0.36 0.00 -0.77 0.00 0.00 57.85 56.58 3cfl n ARG 654 Cb 0.00 -0.23 -0.02 0.00 -1.02 0.00 0.00 32.46 31.19 3cfl n ARG 654 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 3cfl s PRO 655 N -4.51 3.83 1.00 5.56 0.04 -1.26 -5.03 135.00 134.63 3cfl s PRO 655 Ca 0.08 1.64 -0.12 0.00 0.04 0.00 0.00 61.00 62.63 3cfl s PRO 655 Cb -0.04 -2.37 0.19 0.00 0.04 0.00 0.00 34.50 32.32 3cfl s PRO 655 CO 0.26 -0.46 1.09 0.95 0.04 0.00 0.00 177.00 178.88 3cfl s THR 656 N -1.65 2.07 0.50 1.26 -4.23 -1.26 -4.73 115.64 107.60 3cfl s THR 656 Ca 0.63 0.02 0.22 0.00 -1.18 0.00 0.00 61.69 61.39 3cfl s THR 656 Cb -0.25 -2.50 0.27 0.00 1.34 0.00 0.00 72.50 71.36 3cfl s THR 656 CO 0.30 -0.03 2.12 0.10 -0.54 0.00 0.00 174.62 176.57 3cfl h TYR 657 N -1.92 0.00 -0.09 3.99 -0.00 -1.95 0.28 116.97 117.29 3cfl h TYR 657 Ca -0.55 0.00 -0.12 0.00 0.00 0.00 0.00 58.73 58.06 3cfl h TYR 657 Cb 1.33 0.00 0.01 0.00 0.00 0.00 0.00 36.73 38.07 3cfl h TYR 657 CO 0.29 0.08 -0.42 0.93 -0.00 0.00 0.00 178.16 179.04 3cfl h GLU 658 N 0.00 0.44 -0.25 0.10 5.08 -1.96 -1.96 114.58 116.03 3cfl h GLU 658 Ca -0.00 -0.36 -0.10 0.00 -1.00 0.00 0.00 59.36 57.91 3cfl h GLU 658 Cb 0.16 0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.47 3cfl h GLU 658 CO 0.01 0.99 -0.26 0.93 -1.00 0.00 0.00 179.01 179.68 3cfl h GLU 659 N 0.00 0.49 -0.57 2.33 5.08 -1.86 0.51 114.58 120.57 3cfl h GLU 659 Ca -0.03 -0.19 -0.07 0.00 -1.00 0.00 0.00 59.36 58.07 3cfl h GLU 659 Cb 1.06 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 30.26 3cfl h GLU 659 CO 0.09 0.71 0.07 -0.92 -1.00 0.00 0.00 179.01 177.96 3cfl h TYR 660 N 0.43 1.02 0.03 4.33 3.20 -0.88 -3.13 116.97 121.97 3cfl h TYR 660 Ca 0.06 -0.15 -0.23 0.00 3.14 0.00 0.00 58.73 61.55 3cfl h TYR 660 Cb 0.69 -0.28 -0.02 0.00 1.54 0.00 0.00 36.73 38.66 3cfl h TYR 660 CO 0.02 0.90 -1.13 -0.07 -1.64 0.00 0.00 178.16 176.25 3cfl h LEU 661 N 0.85 0.11 0.00 2.82 3.38 -1.20 -3.48 115.31 117.79 3cfl h LEU 661 Ca 0.17 -0.12 0.00 0.00 0.09 0.00 0.00 57.88 58.02 3cfl h LEU 661 Cb 0.45 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.16 3cfl h LEU 661 CO 0.02 1.10 0.00 0.61 0.09 0.00 0.00 178.44 180.25 3cfl n GLY 662 N 1.42 0.04 0.19 0.83 0.00 0.16 -4.34 105.19 103.49 3cfl n GLY 662 Ca -0.04 -1.58 0.06 0.00 0.00 0.00 0.00 46.02 44.46 3cfl n GLY 662 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 3cfl h THR 663 N 0.00 0.94 0.23 2.61 2.02 -1.91 -2.15 112.91 114.65 3cfl h THR 663 Ca 0.00 -1.39 -0.01 0.00 0.77 0.00 0.00 66.41 65.78 3cfl h THR 663 Cb 0.00 1.83 -0.01 0.00 -1.74 0.00 0.00 68.15 68.23 3cfl h THR 663 CO 0.00 0.35 -0.22 -0.33 0.37 0.00 0.00 175.52 175.69 3cfl h GLU 664 N 0.00 -0.43 -0.79 6.66 4.39 -1.96 -2.81 114.58 119.64 3cfl h GLU 664 Ca -0.00 0.03 -0.04 0.00 0.34 0.00 0.00 59.36 59.68 3cfl h GLU 664 Cb 0.80 0.10 -0.04 0.00 -0.10 0.00 0.00 28.75 29.51 3cfl h GLU 664 CO 0.05 -0.29 0.33 -0.92 -1.16 0.00 0.00 179.01 177.02 3cfl h TYR 665 N -0.45 1.20 -0.75 4.33 3.20 -1.72 -2.84 116.97 119.93 3cfl h TYR 665 Ca -0.03 -0.08 -0.04 0.00 3.14 0.00 0.00 58.73 61.71 3cfl h TYR 665 Cb 0.38 -0.36 -0.03 0.00 1.54 0.00 0.00 36.73 38.26 3cfl h TYR 665 CO -0.13 0.90 0.30 0.28 -1.64 0.00 0.00 178.16 177.87 3cfl h VAL 666 N 1.15 1.25 -0.20 1.81 2.07 -1.48 -1.64 116.25 119.21 3cfl h VAL 666 Ca 0.27 -0.80 -0.16 0.00 0.82 0.00 0.00 66.70 66.82 3cfl h VAL 666 Cb 0.20 0.37 -0.01 0.00 -1.52 0.00 0.00 31.29 30.33 3cfl h VAL 666 CO -0.02 0.32 -0.54 0.71 0.02 0.00 0.00 177.57 178.06 3cfl h THR 667 N 1.09 1.31 -0.26 2.57 1.35 -1.44 -2.06 112.91 115.48 3cfl h THR 667 Ca 0.25 -1.77 0.05 0.00 -0.55 0.00 0.00 66.41 64.39 3cfl h THR 667 Cb 0.21 1.73 -0.05 0.00 -1.73 0.00 0.00 68.15 68.31 3cfl h THR 667 CO -0.02 0.56 -0.09 0.00 -0.25 0.00 0.00 175.52 175.72 3cfl h ALA 668 N 0.94 0.14 -0.31 6.62 0.00 -1.23 -1.27 119.26 124.15 3cfl h ALA 668 Ca 0.01 0.10 -0.04 0.00 0.00 0.00 0.00 54.91 54.99 3cfl h ALA 668 Cb 1.09 0.23 -0.01 0.00 0.00 0.00 0.00 17.79 19.10 3cfl h ALA 668 CO 0.10 -0.49 0.05 0.82 0.00 0.00 0.00 179.25 179.74 3cfl h ILE 669 N -0.03 1.23 -0.52 0.00 2.04 -1.19 -2.16 117.51 116.87 3cfl h ILE 669 Ca 0.13 -0.79 0.06 0.00 1.00 0.00 0.00 64.86 65.26 3cfl h ILE 669 Cb 0.23 1.16 -0.05 0.00 -0.74 0.00 0.00 36.82 37.42 3cfl h ILE 669 CO -0.28 0.26 0.22 0.00 0.00 0.00 0.00 178.15 178.35 3cfl h ALA 670 N 0.89 0.66 -0.64 1.87 0.00 -1.29 0.18 119.26 120.93 3cfl h ALA 670 Ca 0.09 0.05 -0.00 0.00 0.00 0.00 0.00 54.91 55.05 3cfl h ALA 670 Cb 0.33 -0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.09 3cfl h ALA 670 CO 0.01 -0.16 0.39 -0.91 0.00 0.00 0.00 179.25 178.57 3cfl h ASN 671 N 0.42 0.77 -0.45 0.00 2.35 -1.11 -2.56 115.58 115.00 3cfl h ASN 671 Ca 0.25 -0.06 -0.11 0.00 -0.55 0.00 0.00 56.30 55.82 3cfl h ASN 671 Cb 0.23 -0.19 -0.02 0.00 0.05 0.00 0.00 38.32 38.39 3cfl h ASN 671 CO -0.22 0.60 -0.14 0.25 -1.65 0.00 0.00 177.43 176.28 3cfl h LEU 672 N 0.87 0.93 -1.73 1.61 5.85 -1.11 -3.24 115.31 118.49 3cfl h LEU 672 Ca 0.23 -0.31 -0.03 0.00 0.84 0.00 0.00 57.88 58.61 3cfl h LEU 672 Cb -0.02 -0.25 -0.00 0.00 0.37 0.00 0.00 40.66 40.75 3cfl h LEU 672 CO -0.04 1.07 -0.14 0.11 -0.34 0.00 0.00 178.44 179.09 3cfl h LYS 673 N 0.82 0.00 0.00 1.25 1.79 -0.32 -1.58 116.57 118.53 3cfl h LYS 673 Ca 0.13 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.60 3cfl h LYS 673 Cb 0.68 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.33 3cfl h LYS 673 CO 0.05 0.14 0.00 0.36 -1.08 0.00 0.00 179.45 178.92 3cfl n LYS 674 N -3.54 0.28 0.07 3.15 2.85 -1.00 -1.83 118.16 118.14 3cfl n LYS 674 Ca -0.01 0.09 -0.07 0.00 -1.05 0.00 0.00 58.31 57.27 3cfl n LYS 674 Cb 0.28 -1.50 -0.08 0.00 -0.65 0.00 0.00 35.03 33.08 3cfl n LYS 674 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 3cfl n SER 676 N -3.41 2.03 0.00 0.00 7.64 -0.76 -5.04 113.62 114.08 3cfl n SER 676 Ca -0.00 0.25 0.00 0.00 1.01 0.00 0.00 58.87 60.13 3cfl n SER 676 Cb 0.90 -0.86 0.00 0.00 -1.01 0.00 0.00 64.21 63.24 3cfl n SER 676 CO 0.00 0.00 0.00 -0.11 -3.01 0.00 0.00 175.04 171.92 3cfl n LEU 681 N -3.78 0.00 -4.21 -3.43 7.94 -1.26 -5.16 117.00 107.11 3cfl n LEU 681 Ca -0.34 0.00 -0.41 0.00 -1.11 0.00 0.00 56.01 54.15 3cfl n LEU 681 Cb 0.93 0.00 -0.08 0.00 0.53 0.00 0.00 43.42 44.80 3cfl n LEU 681 CO 0.33 0.00 -0.00 -0.70 -1.11 0.00 0.00 177.39 175.90 3cfl s GLU 682 N 0.00 2.52 0.06 1.96 2.12 -1.26 -5.05 118.70 119.05 3cfl s GLU 682 Ca 0.00 -1.83 -0.25 0.00 0.36 0.00 0.00 54.97 53.24 3cfl s GLU 682 Cb 0.00 -3.93 0.06 0.00 0.26 0.00 0.00 34.13 30.52 3cfl s GLU 682 CO 0.00 -1.20 0.60 0.00 -0.54 0.00 0.00 175.26 174.13 3cfl s ALA 683 N 1.24 -1.58 0.14 6.30 0.00 -1.26 -5.13 121.76 121.47 3cfl s ALA 683 Ca 0.07 0.78 -0.31 0.00 0.00 0.00 0.00 51.96 52.50 3cfl s ALA 683 Cb -0.25 0.46 -0.09 0.00 0.00 0.00 0.00 23.12 23.24 3cfl s ALA 683 CO -0.01 -0.57 1.47 0.00 0.00 0.00 0.00 175.76 176.65 3cfl h ALA 685 N 6.80 1.00 -0.02 0.00 0.00 -1.91 -3.50 119.26 121.63 3cfl h ALA 685 Ca -0.42 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.49 3cfl h ALA 685 Cb 1.21 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.00 3cfl h ALA 685 CO 0.89 0.00 0.00 1.19 0.00 0.00 0.00 179.25 181.33