#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2a2k s GLU 377 N 0.00 0.89 0.84 2.12 1.03 -1.26 -4.97 118.70 117.35 2a2k s GLU 377 Ca 0.00 1.15 -0.13 0.00 0.03 0.00 0.00 54.97 56.02 2a2k s GLU 377 Cb 0.00 -1.74 0.10 0.00 -0.80 0.00 0.00 34.13 31.69 2a2k s GLU 377 CO 0.00 -2.59 1.20 -0.51 -1.33 0.00 0.00 175.26 172.03 2a2k s LEU 378 N -6.52 2.52 1.13 1.83 1.43 -1.26 -4.39 118.68 113.41 2a2k s LEU 378 Ca 0.65 0.69 -0.17 0.00 -1.03 0.00 0.00 54.13 54.27 2a2k s LEU 378 Cb -0.21 -3.09 0.25 0.00 0.03 0.00 0.00 46.19 43.17 2a2k s LEU 378 CO 0.59 -2.09 1.12 0.27 0.23 0.00 0.00 176.35 176.46 2a2k s ILE 379 N -3.63 1.75 0.43 -0.59 -4.36 -0.09 -4.78 121.20 109.93 2a2k s ILE 379 Ca 0.64 0.00 0.27 0.00 -0.26 0.00 0.00 60.65 61.31 2a2k s ILE 379 Cb -0.10 -2.52 0.46 0.00 1.25 0.00 0.00 42.46 41.55 2a2k s ILE 379 CO 0.50 0.00 1.66 1.23 0.24 0.00 0.00 174.94 178.57 2a2k h GLY 380 N -2.32 1.27 -2.90 6.27 0.00 -1.05 0.22 103.07 104.56 2a2k h GLY 380 Ca -0.48 -0.13 0.00 0.00 0.00 0.00 0.00 47.33 46.72 2a2k h GLY 380 CO 0.42 -0.34 0.00 2.09 0.00 0.00 0.00 176.54 178.71 2a2k n ASP 381 N -4.68 4.44 -3.01 0.19 5.68 -1.26 -4.87 116.55 113.05 2a2k n ASP 381 Ca 0.34 -2.27 -0.20 0.00 -0.50 0.00 0.00 54.79 52.16 2a2k n ASP 381 Cb 1.30 -0.54 0.01 0.00 -1.14 0.00 0.00 41.12 40.74 2a2k n ASP 381 CO 0.00 0.00 0.00 -1.22 -1.33 0.00 0.00 177.20 174.65 2a2k n TYR 382 N 1.33 -1.71 -0.02 2.11 4.01 0.76 -4.82 117.16 118.82 2a2k n TYR 382 Ca 0.25 0.34 -0.10 0.00 -0.16 0.00 0.00 57.90 58.23 2a2k n TYR 382 Cb 0.78 -3.33 -0.14 0.00 -0.31 0.00 0.00 39.34 36.34 2a2k n TYR 382 CO 0.00 0.00 0.00 -1.13 -0.46 0.00 0.00 176.86 175.27 2a2k n SER 383 N -2.21 1.02 -3.46 7.72 3.41 -1.26 -4.93 113.62 113.90 2a2k n SER 383 Ca -0.08 0.38 -0.05 0.00 -0.26 0.00 0.00 58.87 58.85 2a2k n SER 383 Cb 0.58 -0.14 0.00 0.00 -0.26 0.00 0.00 64.21 64.39 2a2k n SER 383 CO 0.00 0.00 0.00 -1.59 -0.16 0.00 0.00 175.04 173.29 2a2k s LYS 384 N -2.59 1.60 0.67 4.33 -2.85 -1.26 -5.04 119.74 114.60 2a2k s LYS 384 Ca -0.07 -0.96 -0.11 0.00 -1.00 0.00 0.00 55.97 53.82 2a2k s LYS 384 Cb 0.08 0.49 -0.01 0.00 -2.06 0.00 0.00 37.83 36.33 2a2k s LYS 384 CO 0.82 -0.74 1.05 0.00 0.10 0.00 0.00 175.35 176.58 2a2k s ALA 385 N -2.87 2.86 0.32 0.59 0.00 -1.26 -0.91 121.76 120.49 2a2k s ALA 385 Ca 0.15 -0.03 -0.29 0.00 0.00 0.00 0.00 51.96 51.79 2a2k s ALA 385 Cb -0.03 -3.12 -0.10 0.00 0.00 0.00 0.00 23.12 19.86 2a2k s ALA 385 CO 0.06 -1.01 1.35 -0.06 0.00 0.00 0.00 175.76 176.11 2a2k s PHE 386 N -3.13 2.99 0.04 0.00 0.08 -1.26 -4.70 117.98 112.00 2a2k s PHE 386 Ca 0.57 1.32 -0.11 0.00 0.12 0.00 0.00 56.93 58.83 2a2k s PHE 386 Cb -0.13 -3.75 -0.32 0.00 -0.57 0.00 0.00 43.02 38.25 2a2k s PHE 386 CO 0.54 -2.13 1.03 1.25 -0.10 0.00 0.00 175.22 175.81 2a2k h LEU 387 N 3.64 0.66 -9.93 -0.37 5.85 -2.00 -3.47 115.31 109.69 2a2k h LEU 387 Ca -0.49 -0.73 -0.54 0.00 0.84 0.00 0.00 57.88 56.97 2a2k h LEU 387 Cb 1.23 -0.22 -0.03 0.00 0.37 0.00 0.00 40.66 42.01 2a2k h LEU 387 CO 0.67 1.57 -0.07 -0.76 -0.34 0.00 0.00 178.44 179.52 2a2k s LEU 388 N -7.38 4.22 0.34 2.25 1.43 -1.26 -5.05 118.68 113.21 2a2k s LEU 388 Ca -0.07 1.04 -0.28 0.00 -1.03 0.00 0.00 54.13 53.78 2a2k s LEU 388 Cb 0.05 -3.59 -0.09 0.00 0.03 0.00 0.00 46.19 42.59 2a2k s LEU 388 CO 0.92 -0.03 1.19 -1.10 0.23 0.00 0.00 176.35 177.55 2a2k s GLN 389 N -2.52 4.36 0.34 1.70 -0.21 -1.26 -5.02 119.66 117.04 2a2k s GLN 389 Ca 0.45 1.94 0.09 0.00 0.02 0.00 0.00 55.36 57.86 2a2k s GLN 389 Cb -0.12 -2.98 -0.05 0.00 1.00 0.00 0.00 33.01 30.85 2a2k s GLN 389 CO 0.20 -0.09 0.03 0.95 -2.12 0.00 0.00 175.29 174.26 2a2k s THR 390 N -1.24 2.71 0.24 -0.19 -4.23 -1.26 -4.71 115.64 106.96 2a2k s THR 390 Ca 0.50 -1.94 0.06 0.00 -1.18 0.00 0.00 61.69 59.13 2a2k s THR 390 Cb -0.34 -2.82 -0.05 0.00 1.34 0.00 0.00 72.50 70.63 2a2k s THR 390 CO 0.44 -0.21 -0.07 0.68 -0.54 0.00 0.00 174.62 174.92 2a2k s VAL 391 N -2.50 1.51 0.42 2.29 -7.23 -0.15 -4.99 120.40 109.75 2a2k s VAL 391 Ca 0.35 -2.12 -0.24 0.00 -1.81 0.00 0.00 61.98 58.15 2a2k s VAL 391 Cb -0.01 -2.29 -0.08 0.00 0.56 0.00 0.00 36.38 34.56 2a2k s VAL 391 CO 0.20 -0.41 1.17 -0.62 -0.31 0.00 0.00 175.10 175.13 2a2k s ASP 392 N -3.37 6.42 0.09 4.85 2.15 -1.26 -4.02 116.67 121.53 2a2k s ASP 392 Ca 0.27 2.33 -0.03 0.00 0.43 0.00 0.00 52.55 55.54 2a2k s ASP 392 Cb 0.03 -2.61 -0.03 0.00 -0.30 0.00 0.00 42.92 40.01 2a2k s ASP 392 CO 0.09 -0.74 0.07 -0.83 -0.17 0.00 0.00 175.17 173.59 2a2k s GLY 393 N -1.20 0.50 0.18 2.66 0.00 -1.26 -4.96 107.32 103.23 2a2k s GLY 393 Ca 0.59 -1.11 -0.15 0.00 0.00 0.00 0.00 44.72 44.05 2a2k s GLY 393 CO 0.37 -1.17 1.67 1.70 0.00 0.00 0.00 173.10 175.67 2a2k h LYS 394 N 2.94 0.05 -6.01 2.90 3.64 -1.96 -3.34 116.57 114.79 2a2k h LYS 394 Ca -0.34 -0.00 -0.57 0.00 -1.27 0.00 0.00 60.65 58.46 2a2k h LYS 394 Cb 1.17 -0.01 -0.10 0.00 -0.41 0.00 0.00 32.23 32.88 2a2k h LYS 394 CO 0.61 0.03 0.87 -1.01 -2.27 0.00 0.00 179.45 177.68 2a2k s HIS 395 N -6.20 2.43 0.58 1.91 3.76 -1.26 -4.90 115.29 111.62 2a2k s HIS 395 Ca -0.14 -0.25 0.28 0.00 -0.15 0.00 0.00 55.06 54.80 2a2k s HIS 395 Cb 0.16 -4.50 1.54 0.00 1.11 0.00 0.00 32.58 30.88 2a2k s HIS 395 CO 0.72 -1.91 2.00 1.96 -0.85 0.00 0.00 174.74 176.65 2a2k h GLN 396 N 9.85 0.00 0.00 1.40 1.08 -2.03 -1.95 115.11 123.46 2a2k h GLN 396 Ca -0.28 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 56.92 2a2k h GLN 396 Cb 1.06 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.49 2a2k h GLN 396 CO 1.24 0.00 -0.51 -0.40 -0.95 0.00 0.00 178.83 178.21 2a2k n ASP 397 N -3.85 0.55 -4.96 1.46 5.75 -1.26 -4.90 116.55 109.33 2a2k n ASP 397 Ca 0.06 -0.01 -0.22 0.00 -0.01 0.00 0.00 54.79 54.61 2a2k n ASP 397 Cb 0.52 0.14 -0.02 0.00 -1.03 0.00 0.00 41.12 40.73 2a2k n ASP 397 CO 0.00 0.00 0.00 -0.76 -0.11 0.00 0.00 177.20 176.33 2a2k s LEU 398 N -3.58 4.21 -0.22 -2.12 1.43 -0.73 -5.09 118.68 112.58 2a2k s LEU 398 Ca 0.09 0.20 -0.09 0.00 -1.03 0.00 0.00 54.13 53.30 2a2k s LEU 398 Cb 0.16 -3.01 -0.04 0.00 0.03 0.00 0.00 46.19 43.32 2a2k s LEU 398 CO 0.69 -0.15 0.11 -0.54 0.23 0.00 0.00 176.35 176.70 2a2k s LYS 399 N -4.10 4.01 0.04 1.70 -0.14 -1.26 -4.89 119.74 115.10 2a2k s LYS 399 Ca 0.36 -0.31 0.04 0.00 -1.36 0.00 0.00 55.97 54.70 2a2k s LYS 399 Cb -0.09 -3.39 -0.04 0.00 -1.68 0.00 0.00 37.83 32.63 2a2k s LYS 399 CO 0.31 0.14 -0.06 0.71 -0.76 0.00 0.00 175.35 175.69 2a2k s TYR 400 N 0.79 2.88 0.18 3.18 1.51 -1.26 -0.46 117.35 124.17 2a2k s TYR 400 Ca 0.06 -0.06 0.08 0.00 -1.01 0.00 0.00 57.07 56.14 2a2k s TYR 400 Cb -0.13 -1.56 -0.04 0.00 -0.11 0.00 0.00 41.96 40.12 2a2k s TYR 400 CO 0.02 0.40 -0.16 0.96 -1.11 0.00 0.00 175.55 175.67 2a2k s ILE 401 N -1.10 1.71 0.58 2.71 -4.36 -0.28 -0.98 121.20 119.49 2a2k s ILE 401 Ca 0.19 -2.06 -0.03 0.00 -0.26 0.00 0.00 60.65 58.50 2a2k s ILE 401 Cb -0.11 -1.92 0.02 0.00 1.25 0.00 0.00 42.46 41.71 2a2k s ILE 401 CO 0.11 -0.49 0.85 -0.94 0.24 0.00 0.00 174.94 174.71 2a2k s SER 402 N -3.00 5.38 0.35 4.36 1.04 -1.26 -0.70 113.70 119.86 2a2k s SER 402 Ca 0.19 0.38 0.03 0.00 0.48 0.00 0.00 55.95 57.02 2a2k s SER 402 Cb -0.03 -1.31 0.65 0.00 0.10 0.00 0.00 66.02 65.43 2a2k s SER 402 CO 0.06 -1.14 2.00 -0.65 0.98 0.00 0.00 173.24 174.50 2a2k h PRO 403 N -0.09 0.82 -0.63 4.02 0.11 -1.94 -1.32 132.00 132.97 2a2k h PRO 403 Ca -0.44 -0.05 -0.01 0.00 0.11 0.00 0.00 66.00 65.61 2a2k h PRO 403 Cb 1.28 -0.19 -0.03 0.00 0.11 0.00 0.00 31.00 32.17 2a2k h PRO 403 CO 0.58 0.54 0.35 1.49 -0.21 0.00 0.00 178.00 180.76 2a2k h GLU 404 N 0.85 0.87 -0.30 1.05 4.81 -1.99 -0.26 114.58 119.61 2a2k h GLU 404 Ca 0.25 -0.10 -0.10 0.00 -0.13 0.00 0.00 59.36 59.29 2a2k h GLU 404 Cb -0.02 -0.17 -0.01 0.00 0.63 0.00 0.00 28.75 29.17 2a2k h GLU 404 CO -0.06 0.65 -0.22 1.15 -0.73 0.00 0.00 179.01 179.80 2a2k h THR 405 N 0.85 1.26 -0.71 0.32 2.02 -1.74 -0.21 112.91 114.71 2a2k h THR 405 Ca 0.22 -1.25 -0.03 0.00 0.77 0.00 0.00 66.41 66.12 2a2k h THR 405 Cb 0.02 1.27 -0.03 0.00 -1.74 0.00 0.00 68.15 67.68 2a2k h THR 405 CO -0.04 0.40 0.32 -0.03 0.37 0.00 0.00 175.52 176.54 2a2k h MET 406 N 0.50 1.03 -0.16 6.66 1.85 -0.64 -1.97 114.93 122.20 2a2k h MET 406 Ca 0.08 -0.17 -0.09 0.00 -0.61 0.00 0.00 59.70 58.91 2a2k h MET 406 Cb 0.66 -0.18 -0.01 0.00 0.43 0.00 0.00 31.60 32.49 2a2k h MET 406 CO 0.05 0.83 -0.31 0.28 -0.40 0.00 0.00 176.91 177.36 2a2k h VAL 407 N 1.00 1.27 -0.81 -5.77 2.07 -0.55 -1.67 116.25 111.78 2a2k h VAL 407 Ca 0.24 -1.31 0.00 0.00 0.82 0.00 0.00 66.70 66.45 2a2k h VAL 407 Cb 0.16 1.49 -0.04 0.00 -1.52 0.00 0.00 31.29 31.38 2a2k h VAL 407 CO -0.03 0.40 0.52 0.00 0.02 0.00 0.00 177.57 178.49 2a2k h ALA 408 N 1.40 1.03 -0.00 1.67 0.00 -0.35 0.19 119.26 123.20 2a2k h ALA 408 Ca 0.04 -0.07 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 2a2k h ALA 408 Cb 0.69 -0.33 -0.00 0.00 0.00 0.00 0.00 17.79 18.15 2a2k h ALA 408 CO 0.05 0.46 0.00 -0.07 0.00 0.00 0.00 179.25 179.70 2a2k h LEU 409 N 1.11 0.00 -2.06 0.00 3.38 -0.98 -0.66 115.31 116.09 2a2k h LEU 409 Ca 0.30 -0.26 -0.02 0.00 0.09 0.00 0.00 57.88 57.99 2a2k h LEU 409 Cb -0.10 -0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.65 2a2k h LEU 409 CO -0.06 0.26 -0.08 -0.07 0.09 0.00 0.00 178.44 178.58 2a2k h LEU 410 N -0.25 0.00 -2.02 1.67 3.38 -0.86 -1.97 115.31 115.25 2a2k h LEU 410 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2a2k h LEU 410 Cb 0.26 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.01 2a2k h LEU 410 CO 0.00 0.08 0.00 0.35 0.09 0.00 0.00 178.44 178.96 2a2k n THR 411 N -3.97 0.75 -1.19 0.22 -2.24 0.64 -4.94 114.28 103.53 2a2k n THR 411 Ca -0.03 -0.73 -0.06 0.00 -2.27 0.00 0.00 64.05 60.96 2a2k n THR 411 Cb 0.16 0.36 -0.03 0.00 -2.10 0.00 0.00 70.33 68.72 2a2k n THR 411 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2a2k n GLY 412 N 1.36 0.86 0.28 3.38 0.00 -0.74 -4.91 105.19 105.41 2a2k n GLY 412 Ca 0.18 -0.77 0.19 0.00 0.00 0.00 0.00 46.02 45.62 2a2k n GLY 412 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2a2k h LYS 413 N 0.00 0.00 -0.03 1.61 1.57 -1.33 -2.01 116.57 116.37 2a2k h LYS 413 Ca -0.13 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.65 2a2k h LYS 413 Cb 0.41 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.72 2a2k h LYS 413 CO 0.19 0.00 0.00 1.19 -0.57 0.00 0.00 179.45 180.26 2a2k n PHE 414 N -2.87 0.11 0.20 -1.35 3.72 -1.26 -4.80 117.46 111.21 2a2k n PHE 414 Ca -0.02 -0.93 0.16 0.00 -0.05 0.00 0.00 57.45 56.61 2a2k n PHE 414 Cb 0.13 -0.16 0.79 0.00 -0.94 0.00 0.00 39.48 39.30 2a2k n PHE 414 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 2a2k h SER 415 N 0.23 0.00 1.33 4.37 4.64 -1.60 0.32 113.55 122.85 2a2k h SER 415 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2a2k h SER 415 Cb 1.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.09 2a2k h SER 415 CO 0.03 0.00 0.00 -0.55 -0.87 0.00 0.00 176.83 175.44 2a2k h ASN 416 N 0.00 0.00 0.00 4.97 7.08 -1.87 -3.36 115.58 122.40 2a2k h ASN 416 Ca 0.08 0.00 -0.07 0.00 -3.08 0.00 0.00 56.30 53.23 2a2k h ASN 416 Cb 0.41 0.00 -0.01 0.00 -2.08 0.00 0.00 38.32 36.64 2a2k h ASN 416 CO -0.00 0.00 -1.27 -0.38 -2.08 0.00 0.00 177.43 173.70 2a2k n ILE 417 N -2.48 0.27 -3.19 6.14 5.41 -0.50 -4.97 119.36 120.05 2a2k n ILE 417 Ca 0.04 -0.10 -0.43 0.00 1.00 0.00 0.00 62.75 63.26 2a2k n ILE 417 Cb 0.38 -0.67 -0.07 0.00 -0.71 0.00 0.00 39.64 38.57 2a2k n ILE 417 CO 0.00 0.00 0.00 -0.69 0.00 0.00 0.00 176.55 175.86 2a2k s VAL 418 N -2.09 4.93 0.03 1.39 1.01 0.10 -0.31 120.40 125.45 2a2k s VAL 418 Ca -0.06 0.02 -0.21 0.00 0.00 0.00 0.00 61.98 61.72 2a2k s VAL 418 Cb 0.02 -4.13 -0.16 0.00 0.00 0.00 0.00 36.38 32.11 2a2k s VAL 418 CO 0.11 -0.50 1.32 -0.78 0.00 0.00 0.00 175.10 175.25 2a2k h ASP 419 N 8.78 0.32 -4.88 3.32 3.58 -1.13 -3.41 116.42 123.00 2a2k h ASP 419 Ca -0.26 -0.49 -0.09 0.00 0.42 0.00 0.00 57.03 56.61 2a2k h ASP 419 Cb 1.10 -0.09 -0.20 0.00 1.72 0.00 0.00 39.33 41.86 2a2k h ASP 419 CO 0.85 0.75 -0.07 -0.54 -2.88 0.00 0.00 179.24 177.35 2a2k s LYS 420 N -4.25 0.82 0.03 0.28 1.02 -1.17 -5.06 119.74 111.40 2a2k s LYS 420 Ca -0.14 0.09 -0.01 0.00 0.02 0.00 0.00 55.97 55.92 2a2k s LYS 420 Cb 0.05 0.38 -0.02 0.00 -0.52 0.00 0.00 37.83 37.71 2a2k s LYS 420 CO 0.74 -0.23 -0.00 -0.59 -0.92 0.00 0.00 175.35 174.35 2a2k s PHE 421 N -1.10 0.29 -0.07 3.18 -0.71 -1.26 -1.77 117.98 116.54 2a2k s PHE 421 Ca -0.11 -0.60 0.03 0.00 -1.04 0.00 0.00 56.93 55.21 2a2k s PHE 421 Cb -0.03 -0.21 0.01 0.00 -1.21 0.00 0.00 43.02 41.58 2a2k s PHE 421 CO 0.06 -0.26 -0.16 0.08 -1.34 0.00 0.00 175.22 173.61 2a2k s VAL 422 N -2.07 1.39 -0.37 -2.49 1.01 -0.50 -4.96 120.40 112.41 2a2k s VAL 422 Ca -0.10 -0.64 -0.16 0.00 0.00 0.00 0.00 61.98 61.09 2a2k s VAL 422 Cb -0.05 -1.24 -0.00 0.00 0.00 0.00 0.00 36.38 35.08 2a2k s VAL 422 CO -0.03 0.41 0.37 -0.63 0.00 0.00 0.00 175.10 175.23 2a2k s ILE 423 N 0.52 5.16 -0.48 2.22 1.01 -1.26 -0.91 121.20 127.46 2a2k s ILE 423 Ca -0.15 -0.10 -0.16 0.00 0.00 0.00 0.00 60.65 60.25 2a2k s ILE 423 Cb -0.16 -3.88 0.07 0.00 0.01 0.00 0.00 42.46 38.50 2a2k s ILE 423 CO 0.05 -0.19 0.43 -0.69 0.00 0.00 0.00 174.94 174.54 2a2k s VAL 424 N 2.02 5.19 -0.44 2.92 1.01 0.93 -0.91 120.40 131.12 2a2k s VAL 424 Ca 0.11 -1.00 -0.25 0.00 0.00 0.00 0.00 61.98 60.83 2a2k s VAL 424 Cb -0.17 -4.15 0.02 0.00 0.00 0.00 0.00 36.38 32.08 2a2k s VAL 424 CO 0.12 -0.61 0.92 -0.62 0.00 0.00 0.00 175.10 174.91 2a2k s ASP 425 N 2.64 6.54 -0.00 3.32 -1.08 -0.14 -1.79 116.67 126.16 2a2k s ASP 425 Ca 0.05 0.22 0.13 0.00 -0.52 0.00 0.00 52.55 52.44 2a2k s ASP 425 Cb -0.24 -2.45 0.38 0.00 -1.46 0.00 0.00 42.92 39.15 2a2k s ASP 425 CO 0.07 -1.01 1.31 0.00 0.52 0.00 0.00 175.17 176.07 2a2k s ARG 427 N -1.44 1.91 0.66 0.00 0.52 -1.26 -4.49 118.95 114.85 2a2k s ARG 427 Ca 0.29 0.08 -0.14 0.00 -0.52 0.00 0.00 55.73 55.44 2a2k s ARG 427 Cb 0.15 -1.95 -0.00 0.00 0.52 0.00 0.00 34.95 33.67 2a2k s ARG 427 CO 0.19 -1.63 1.08 0.71 0.02 0.00 0.00 175.30 175.68 2a2k s TYR 428 N -3.59 2.83 0.25 -0.53 2.02 -1.26 -4.33 117.35 112.73 2a2k s TYR 428 Ca 0.62 1.52 -0.05 0.00 -0.37 0.00 0.00 57.07 58.79 2a2k s TYR 428 Cb -0.11 -3.05 0.48 0.00 -0.40 0.00 0.00 41.96 38.88 2a2k s TYR 428 CO 0.49 -1.43 1.68 -1.35 -1.57 0.00 0.00 175.55 173.37 2a2k h PRO 429 N -0.12 0.24 -0.17 -1.71 0.11 -1.97 -0.86 132.00 127.52 2a2k h PRO 429 Ca -0.46 -0.01 -0.02 0.00 0.11 0.00 0.00 66.00 65.62 2a2k h PRO 429 Cb 1.23 -0.05 -0.01 0.00 0.11 0.00 0.00 31.00 32.27 2a2k h PRO 429 CO 0.55 0.16 0.01 0.10 -0.21 0.00 0.00 178.00 178.62 2a2k h TYR 430 N 0.25 0.24 -0.11 0.65 -0.00 -1.95 0.13 116.97 116.19 2a2k h TYR 430 Ca 0.42 -0.01 -0.04 0.00 -0.00 0.00 0.00 58.73 59.11 2a2k h TYR 430 Cb 0.74 -0.08 -0.00 0.00 -0.00 0.00 0.00 36.73 37.39 2a2k h TYR 430 CO -0.27 0.25 -0.07 0.93 -0.00 0.00 0.00 178.16 178.99 2a2k h GLU 431 N 0.25 0.24 -0.43 0.10 5.08 -1.44 -2.14 114.58 116.24 2a2k h GLU 431 Ca 0.06 -0.11 0.04 0.00 -1.00 0.00 0.00 59.36 58.34 2a2k h GLU 431 Cb 0.15 -0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.36 2a2k h GLU 431 CO 0.00 0.62 0.21 -0.92 -1.00 0.00 0.00 179.01 177.92 2a2k h TYR 432 N -0.14 0.39 0.00 4.33 3.20 -0.80 -1.93 116.97 122.03 2a2k h TYR 432 Ca 0.02 0.02 -0.02 0.00 3.14 0.00 0.00 58.73 61.89 2a2k h TYR 432 Cb 0.56 -0.11 -0.00 0.00 1.54 0.00 0.00 36.73 38.71 2a2k h TYR 432 CO 0.08 0.20 -0.09 0.93 -1.64 0.00 0.00 178.16 177.64 2a2k h GLU 433 N 0.43 0.00 -0.00 1.82 5.08 -0.71 -2.04 114.58 119.15 2a2k h GLU 433 Ca 0.19 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.55 2a2k h GLU 433 Cb 0.10 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.35 2a2k h GLU 433 CO -0.13 0.09 -0.01 0.41 -1.00 0.00 0.00 179.01 178.37 2a2k n GLY 434 N -1.15 -0.95 0.00 -3.84 0.00 -0.73 -4.63 105.19 93.89 2a2k n GLY 434 Ca -0.03 -0.22 0.00 0.00 0.00 0.00 0.00 46.02 45.78 2a2k n GLY 434 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2a2k n GLY 435 N 1.07 3.33 3.22 -0.02 0.00 -0.77 -3.52 105.19 108.50 2a2k n GLY 435 Ca 0.22 -0.32 -0.13 0.00 0.00 0.00 0.00 46.02 45.79 2a2k n GLY 435 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 2a2k s HIS 436 N 0.00 1.22 0.21 1.61 -3.43 -0.97 -4.63 115.29 109.29 2a2k s HIS 436 Ca 0.00 -1.33 -0.30 0.00 -0.80 0.00 0.00 55.06 52.64 2a2k s HIS 436 Cb 0.00 -0.63 -0.08 0.00 -1.43 0.00 0.00 32.58 30.44 2a2k s HIS 436 CO 0.00 -0.56 1.15 0.42 -2.00 0.00 0.00 174.74 173.74 2a2k s ILE 437 N -4.06 3.63 0.21 -5.38 1.01 -1.26 -0.24 121.20 115.10 2a2k s ILE 437 Ca 0.38 1.44 -0.32 0.00 0.00 0.00 0.00 60.65 62.14 2a2k s ILE 437 Cb 0.07 -3.92 -0.14 0.00 0.01 0.00 0.00 42.46 38.49 2a2k s ILE 437 CO 0.12 0.26 1.45 0.29 0.00 0.00 0.00 174.94 177.06 2a2k n LYS 438 N 2.14 2.02 -0.49 2.79 5.02 0.21 -1.36 118.16 128.49 2a2k n LYS 438 Ca 0.03 0.72 0.00 0.00 -2.02 0.00 0.00 58.31 57.04 2a2k n LYS 438 Cb 0.45 -2.41 0.00 0.00 -0.02 0.00 0.00 35.03 33.05 2a2k n LYS 438 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 2a2k n THR 439 N 2.36 0.00 -2.06 -0.18 -2.24 -1.26 -5.02 114.28 105.88 2a2k n THR 439 Ca 0.13 0.00 -0.37 0.00 -2.27 0.00 0.00 64.05 61.54 2a2k n THR 439 Cb 0.30 -0.03 0.01 0.00 -2.10 0.00 0.00 70.33 68.52 2a2k n THR 439 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2a2k s ALA 440 N -3.25 2.85 -0.12 6.98 0.00 -0.46 -4.69 121.76 123.06 2a2k s ALA 440 Ca 0.00 1.08 -0.02 0.00 0.00 0.00 0.00 51.96 53.02 2a2k s ALA 440 Cb 0.00 -3.46 -0.03 0.00 0.00 0.00 0.00 23.12 19.64 2a2k s ALA 440 CO 0.00 -0.99 -0.05 0.14 0.00 0.00 0.00 175.76 174.86 2a2k s VAL 441 N -1.48 3.81 -0.50 0.00 -7.23 -0.09 -4.94 120.40 109.98 2a2k s VAL 441 Ca 0.69 -0.40 -0.23 0.00 -1.81 0.00 0.00 61.98 60.22 2a2k s VAL 441 Cb -0.33 -2.63 0.04 0.00 0.56 0.00 0.00 36.38 34.02 2a2k s VAL 441 CO 0.39 0.53 0.84 0.21 -0.31 0.00 0.00 175.10 176.76 2a2k s ASN 442 N -0.05 6.36 -0.46 4.85 3.04 -1.26 -0.97 114.94 126.45 2a2k s ASN 442 Ca 0.01 -0.31 0.09 0.00 0.04 0.00 0.00 52.86 52.68 2a2k s ASN 442 Cb -0.13 -2.40 0.30 0.00 -1.54 0.00 0.00 41.25 37.48 2a2k s ASN 442 CO 0.03 -1.06 0.72 0.18 -3.04 0.00 0.00 177.10 173.93 2a2k n LEU 443 N 6.99 1.84 0.19 3.21 4.77 -0.81 -4.95 117.00 128.25 2a2k n LEU 443 Ca 0.01 -5.13 0.05 0.00 -0.03 0.00 0.00 56.01 50.91 2a2k n LEU 443 Cb 0.47 0.22 0.39 0.00 -2.33 0.00 0.00 43.42 42.18 2a2k n LEU 443 CO 0.61 2.21 0.72 1.55 -1.33 0.00 0.00 177.39 181.15 2a2k h PRO 444 N 3.46 0.00 -5.81 3.23 0.13 -1.76 -3.41 132.00 127.85 2a2k h PRO 444 Ca 0.11 0.00 -0.57 0.00 -0.87 0.00 0.00 66.00 64.67 2a2k h PRO 444 Cb 0.80 0.00 -0.07 0.00 0.13 0.00 0.00 31.00 31.86 2a2k h PRO 444 CO 0.61 0.36 -0.10 -0.51 -0.23 0.00 0.00 178.00 178.12 2a2k s LEU 445 N -7.57 4.30 0.25 1.56 1.43 -1.26 -4.98 118.68 112.41 2a2k s LEU 445 Ca -0.02 0.89 -0.04 0.00 -1.03 0.00 0.00 54.13 53.94 2a2k s LEU 445 Cb 0.13 -2.76 0.45 0.00 0.03 0.00 0.00 46.19 44.04 2a2k s LEU 445 CO 0.69 0.00 1.75 -0.33 0.23 0.00 0.00 176.35 178.69 2a2k h GLU 446 N 6.60 0.49 -0.14 1.70 5.08 -1.97 -0.87 114.58 125.47 2a2k h GLU 446 Ca -0.42 -0.03 -0.03 0.00 -1.00 0.00 0.00 59.36 57.89 2a2k h GLU 446 Cb 1.18 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 30.31 2a2k h GLU 446 CO 0.75 0.33 -0.03 0.07 -1.00 0.00 0.00 179.01 179.12 2a2k h ARG 447 N 0.51 0.21 0.13 2.33 0.11 -1.96 -0.16 114.38 115.55 2a2k h ARG 447 Ca 0.41 -0.03 -0.27 0.00 0.10 0.00 0.00 59.98 60.19 2a2k h ARG 447 Cb 0.59 -0.04 0.00 0.00 1.11 0.00 0.00 29.97 31.64 2a2k h ARG 447 CO -0.37 0.26 -1.24 -0.44 0.10 0.00 0.00 179.97 178.29 2a2k h ASP 448 N 0.21 0.42 -0.49 0.08 3.32 -1.58 -2.31 116.42 116.08 2a2k h ASP 448 Ca 0.05 -0.45 -0.07 0.00 0.02 0.00 0.00 57.03 56.57 2a2k h ASP 448 Cb 0.20 -0.14 -0.02 0.00 0.22 0.00 0.00 39.33 39.60 2a2k h ASP 448 CO 0.01 1.35 0.02 0.00 -1.72 0.00 0.00 179.24 178.90 2a2k h ALA 449 N 0.58 0.65 -0.59 3.45 0.00 -0.86 -1.19 119.26 121.31 2a2k h ALA 449 Ca -0.13 -0.27 -0.06 0.00 0.00 0.00 0.00 54.91 54.45 2a2k h ALA 449 Cb 1.97 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 19.55 2a2k h ALA 449 CO 0.20 0.44 0.12 1.49 0.00 0.00 0.00 179.25 181.50 2a2k h GLU 450 N 0.71 0.96 -0.35 0.00 4.81 -1.06 -1.16 114.58 118.49 2a2k h GLU 450 Ca 0.14 -0.24 -0.08 0.00 -0.13 0.00 0.00 59.36 59.05 2a2k h GLU 450 Cb 0.48 -0.12 -0.01 0.00 0.63 0.00 0.00 28.75 29.73 2a2k h GLU 450 CO 0.02 0.90 -0.08 0.66 -0.73 0.00 0.00 179.01 179.78 2a2k h SER 451 N 0.86 0.67 -0.62 1.04 4.64 -1.31 0.35 113.55 119.19 2a2k h SER 451 Ca 0.18 -0.36 -0.09 0.00 -0.47 0.00 0.00 61.79 61.05 2a2k h SER 451 Cb 0.39 -0.18 -0.02 0.00 -0.31 0.00 0.00 62.40 62.27 2a2k h SER 451 CO 0.01 0.88 0.04 0.15 -0.87 0.00 0.00 176.83 177.03 2a2k h PHE 452 N 0.46 1.16 0.06 4.77 3.04 -1.14 -2.79 116.94 122.49 2a2k h PHE 452 Ca 0.09 -0.18 -0.36 0.00 3.98 0.00 0.00 57.97 61.50 2a2k h PHE 452 Cb 0.58 -0.31 -0.04 0.00 2.56 0.00 0.00 35.95 38.74 2a2k h PHE 452 CO 0.05 1.00 -2.10 1.28 -2.02 0.00 0.00 178.31 176.52 2a2k n LEU 453 N -4.19 2.18 -0.18 0.59 4.77 -0.45 -4.68 117.00 115.04 2a2k n LEU 453 Ca 0.03 0.15 0.06 0.00 -0.03 0.00 0.00 56.01 56.22 2a2k n LEU 453 Cb 0.33 -0.70 -0.02 0.00 -2.33 0.00 0.00 43.42 40.69 2a2k n LEU 453 CO 0.44 0.76 0.14 0.18 -1.33 0.00 0.00 177.39 177.58 2a2k n LEU 454 N -3.29 1.08 -0.08 2.23 4.77 0.12 -3.66 117.00 118.17 2a2k n LEU 454 Ca -0.33 -0.68 -0.12 0.00 -0.03 0.00 0.00 56.01 54.86 2a2k n LEU 454 Cb 1.04 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 42.09 2a2k n LEU 454 CO 0.39 0.22 0.70 0.50 -1.33 0.00 0.00 177.39 177.88 2a2k h LYS 455 N 0.89 0.47 -2.41 3.23 3.64 -1.39 -3.37 116.57 117.64 2a2k h LYS 455 Ca 0.00 -0.18 -0.59 0.00 -1.27 0.00 0.00 60.65 58.61 2a2k h LYS 455 Cb 0.36 -0.02 -0.38 0.00 -0.41 0.00 0.00 32.23 31.78 2a2k h LYS 455 CO 0.00 0.70 -0.95 0.45 -2.27 0.00 0.00 179.45 177.38 2a2k s SER 456 N -6.08 1.65 0.14 4.20 0.15 -1.26 -5.12 113.70 107.38 2a2k s SER 456 Ca -0.14 -3.04 -0.31 0.00 0.70 0.00 0.00 55.95 53.16 2a2k s SER 456 Cb 0.07 -0.48 -0.18 0.00 -1.71 0.00 0.00 66.02 63.72 2a2k s SER 456 CO 0.76 -0.18 0.69 -2.65 1.20 0.00 0.00 173.24 173.07 2a2k n PRO 457 N 2.90 0.04 -2.58 5.44 -0.02 -1.24 -4.87 135.00 134.66 2a2k n PRO 457 Ca 0.28 0.01 -0.42 0.00 -2.02 0.00 0.00 63.50 61.35 2a2k n PRO 457 Cb 0.47 -1.17 -0.02 0.00 -0.02 0.00 0.00 33.50 32.75 2a2k n PRO 457 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 2a2k s ILE 458 N -0.70 4.01 0.27 4.25 1.09 -1.26 -5.01 121.20 123.85 2a2k s ILE 458 Ca 0.72 0.88 -0.04 0.00 -1.10 0.00 0.00 60.65 61.11 2a2k s ILE 458 Cb -1.02 -4.73 -0.05 0.00 -1.06 0.00 0.00 42.46 35.60 2a2k s ILE 458 CO 0.56 -1.36 0.53 0.00 -0.10 0.00 0.00 174.94 174.57 2a2k s ALA 459 N 4.97 3.66 0.00 9.38 0.00 -1.26 -4.97 121.76 133.53 2a2k s ALA 459 Ca 0.43 -0.59 0.00 0.00 0.00 0.00 0.00 51.96 51.79 2a2k s ALA 459 Cb -0.07 -2.25 0.00 0.00 0.00 0.00 0.00 23.12 20.79 2a2k s ALA 459 CO 0.25 0.29 0.00 -0.35 0.00 0.00 0.00 175.76 175.95 2a2k n PRO 460 N -0.85 0.00 -0.41 0.00 -0.04 -1.26 -4.98 135.00 127.46 2a2k n PRO 460 Ca -0.02 0.00 0.05 0.00 -0.04 0.00 0.00 63.50 63.49 2a2k n PRO 460 Cb 0.54 0.00 -0.02 0.00 -0.04 0.00 0.00 33.50 33.98 2a2k n PRO 460 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 2a2k n LYS 465 N 0.00 -0.87 -4.15 0.54 5.02 -1.26 -5.13 118.16 112.30 2a2k n LYS 465 Ca 0.00 0.65 -0.26 0.00 -2.02 0.00 0.00 58.31 56.68 2a2k n LYS 465 Cb 0.00 -1.05 -0.06 0.00 -0.02 0.00 0.00 35.03 33.90 2a2k n LYS 465 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 2a2k s ARG 466 N -2.27 2.65 -0.08 1.97 0.52 0.58 -4.83 118.95 117.49 2a2k s ARG 466 Ca 0.00 -1.03 0.05 0.00 -0.52 0.00 0.00 55.73 54.23 2a2k s ARG 466 Cb 0.00 -2.48 -0.00 0.00 0.52 0.00 0.00 34.95 32.98 2a2k s ARG 466 CO 0.00 0.46 -0.24 0.08 0.02 0.00 0.00 175.30 175.61 2a2k s VAL 467 N -1.82 2.02 0.02 3.52 1.01 -1.26 -0.60 120.40 123.30 2a2k s VAL 467 Ca 0.30 -1.03 0.04 0.00 0.00 0.00 0.00 61.98 61.29 2a2k s VAL 467 Cb -0.09 -1.73 -0.02 0.00 0.00 0.00 0.00 36.38 34.54 2a2k s VAL 467 CO 0.21 0.56 -0.12 -0.63 0.00 0.00 0.00 175.10 175.12 2a2k s ILE 468 N 0.10 0.96 -0.05 2.22 1.01 -0.73 -4.53 121.20 120.18 2a2k s ILE 468 Ca -0.11 -0.75 0.04 0.00 0.00 0.00 0.00 60.65 59.84 2a2k s ILE 468 Cb -0.16 -0.85 -0.02 0.00 0.01 0.00 0.00 42.46 41.44 2a2k s ILE 468 CO 0.06 0.10 -0.18 -0.76 0.00 0.00 0.00 174.94 174.17 2a2k s LEU 469 N -0.73 2.51 -0.17 2.97 1.43 -0.90 -1.42 118.68 122.37 2a2k s LEU 469 Ca 0.02 -0.31 0.01 0.00 -1.03 0.00 0.00 54.13 52.82 2a2k s LEU 469 Cb -0.06 -1.50 0.03 0.00 0.03 0.00 0.00 46.19 44.69 2a2k s LEU 469 CO 0.00 0.31 -0.14 -0.63 0.23 0.00 0.00 176.35 176.12 2a2k s ILE 470 N -0.50 1.66 -0.02 -0.59 1.09 -0.09 -1.03 121.20 121.72 2a2k s ILE 470 Ca 0.06 -0.79 -0.02 0.00 -1.10 0.00 0.00 60.65 58.80 2a2k s ILE 470 Cb -0.12 -1.61 -0.04 0.00 -1.06 0.00 0.00 42.46 39.64 2a2k s ILE 470 CO 0.01 0.38 0.12 -0.36 -0.10 0.00 0.00 174.94 174.99 2a2k s PHE 471 N 1.43 3.39 0.15 3.97 0.40 0.48 -0.05 117.98 127.75 2a2k s PHE 471 Ca 0.03 0.28 -0.19 0.00 -0.60 0.00 0.00 56.93 56.45 2a2k s PHE 471 Cb -0.14 -1.78 0.05 0.00 0.51 0.00 0.00 43.02 41.66 2a2k s PHE 471 CO -0.10 0.60 0.50 -3.38 0.70 0.00 0.00 175.22 173.53 2a2k s HIS 472 N -1.22 -0.33 0.00 0.36 -3.43 -0.74 -1.08 115.29 108.86 2a2k s HIS 472 Ca 0.24 0.05 0.00 0.00 -0.80 0.00 0.00 55.06 54.55 2a2k s HIS 472 Cb -0.12 0.40 0.00 0.00 -1.43 0.00 0.00 32.58 31.43 2a2k s HIS 472 CO 0.15 -0.79 0.00 -1.13 -2.00 0.00 0.00 174.74 170.96 2a2k n SER 473 N -0.30 0.00 -0.03 7.38 3.41 -1.26 -0.70 113.62 122.12 2a2k n SER 473 Ca -0.16 0.00 -0.14 0.00 -0.26 0.00 0.00 58.87 58.32 2a2k n SER 473 Cb 0.64 0.00 -0.10 0.00 -0.26 0.00 0.00 64.21 64.49 2a2k n SER 473 CO 0.00 0.00 0.00 -0.08 -0.16 0.00 0.00 175.04 174.80 2a2k h GLU 474 N 0.00 0.13 -0.00 4.33 4.81 -1.94 -1.39 114.58 120.52 2a2k h GLU 474 Ca 0.00 -0.09 0.00 0.00 -0.13 0.00 0.00 59.36 59.14 2a2k h GLU 474 Cb 0.00 0.01 0.00 0.00 0.63 0.00 0.00 28.75 29.39 2a2k h GLU 474 CO 0.00 0.68 -0.08 1.19 -0.73 0.00 0.00 179.01 180.07 2a2k n PHE 475 N -4.69 0.00 -3.72 0.92 3.72 -1.26 -1.18 117.46 111.26 2a2k n PHE 475 Ca -0.08 0.00 -0.27 0.00 -0.05 0.00 0.00 57.45 57.04 2a2k n PHE 475 Cb 0.35 0.00 0.04 0.00 -0.94 0.00 0.00 39.48 38.93 2a2k n PHE 475 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14 2a2k n SER 476 N -0.19 -5.35 -0.10 4.37 7.64 -1.26 -3.55 113.62 115.19 2a2k n SER 476 Ca 0.02 -0.64 -0.12 0.00 1.01 0.00 0.00 58.87 59.14 2a2k n SER 476 Cb 0.12 -4.26 -0.12 0.00 -1.01 0.00 0.00 64.21 58.94 2a2k n SER 476 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 2a2k n SER 477 N -2.83 1.46 0.06 6.43 3.41 -1.26 -4.67 113.62 116.23 2a2k n SER 477 Ca 0.02 -0.06 0.00 0.00 -0.26 0.00 0.00 58.87 58.57 2a2k n SER 477 Cb 0.54 0.28 0.00 0.00 -0.26 0.00 0.00 64.21 64.77 2a2k n SER 477 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2a2k n GLU 478 N -2.91 0.00 -0.21 4.33 -0.58 -1.26 -4.79 120.64 115.22 2a2k n GLU 478 Ca -0.34 0.00 -0.05 0.00 -0.42 0.00 0.00 57.16 56.35 2a2k n GLU 478 Cb 1.00 -0.18 0.05 0.00 -0.57 0.00 0.00 31.44 31.74 2a2k n GLU 478 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2a2k h ARG 479 N 0.00 0.72 0.31 3.49 3.08 -1.92 -0.73 114.38 119.32 2a2k h ARG 479 Ca 0.00 -0.04 -0.02 0.00 0.07 0.00 0.00 59.98 59.99 2a2k h ARG 479 Cb 0.00 -0.16 0.00 0.00 0.08 0.00 0.00 29.97 29.89 2a2k h ARG 479 CO 0.00 0.47 -0.15 0.78 -1.07 0.00 0.00 179.97 180.00 2a2k h GLY 480 N 0.74 -0.44 0.79 0.04 0.00 -1.88 -2.08 103.07 100.24 2a2k h GLY 480 Ca 0.24 0.16 0.05 0.00 0.00 0.00 0.00 47.33 47.78 2a2k h GLY 480 CO -0.09 -0.16 0.58 -2.55 0.00 0.00 0.00 176.54 174.32 2a2k h PRO 481 N -0.58 1.05 -0.54 4.80 0.11 -1.81 -1.61 132.00 133.42 2a2k h PRO 481 Ca -0.04 -0.06 -0.00 0.00 0.11 0.00 0.00 66.00 66.00 2a2k h PRO 481 Cb 0.43 -0.24 -0.03 0.00 0.11 0.00 0.00 31.00 31.27 2a2k h PRO 481 CO 0.07 0.69 0.32 -0.09 -0.21 0.00 0.00 178.00 178.79 2a2k h ARG 482 N 1.08 0.74 -0.29 1.05 2.43 -1.04 -1.47 114.38 116.87 2a2k h ARG 482 Ca 0.38 -0.07 -0.10 0.00 -0.81 0.00 0.00 59.98 59.38 2a2k h ARG 482 Cb 0.10 -0.15 -0.01 0.00 -0.42 0.00 0.00 29.97 29.48 2a2k h ARG 482 CO -0.15 0.54 -0.24 1.98 -1.51 0.00 0.00 179.97 180.59 2a2k h MET 483 N 0.73 0.55 -0.35 0.20 4.05 -1.02 -0.93 114.93 118.15 2a2k h MET 483 Ca 0.19 -0.21 -0.01 0.00 -0.28 0.00 0.00 59.70 59.40 2a2k h MET 483 Cb -0.01 -0.03 -0.02 0.00 -0.80 0.00 0.00 31.60 30.75 2a2k h MET 483 CO -0.04 0.75 0.19 0.00 0.23 0.00 0.00 176.91 178.04 2a2k h ARG 485 N 0.44 0.94 -0.14 0.00 3.08 -1.07 -2.68 114.38 114.95 2a2k h ARG 485 Ca 0.12 -0.32 -0.00 0.00 0.07 0.00 0.00 59.98 59.85 2a2k h ARG 485 Cb 0.07 -0.07 -0.01 0.00 0.08 0.00 0.00 29.97 30.05 2a2k h ARG 485 CO -0.02 0.98 0.09 0.35 -1.07 0.00 0.00 179.97 180.30 2a2k h PHE 486 N 0.84 0.18 -0.94 3.04 3.57 -0.81 -1.20 116.94 121.62 2a2k h PHE 486 Ca 0.14 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.63 2a2k h PHE 486 Cb 0.62 -0.06 -0.05 0.00 2.79 0.00 0.00 35.95 39.25 2a2k h PHE 486 CO 0.04 0.14 0.56 0.82 -2.23 0.00 0.00 178.31 177.65 2a2k h ILE 487 N 0.17 1.26 -0.65 1.41 1.08 -1.06 -1.28 117.51 118.43 2a2k h ILE 487 Ca 0.05 -0.57 -0.07 0.00 -0.39 0.00 0.00 64.86 63.88 2a2k h ILE 487 Cb 0.01 -0.06 -0.03 0.00 -3.07 0.00 0.00 36.82 33.67 2a2k h ILE 487 CO -0.01 0.27 0.12 -0.09 -0.69 0.00 0.00 178.15 177.75 2a2k h ARG 488 N 1.30 1.06 -0.25 2.37 9.65 -1.22 0.17 114.38 127.45 2a2k h ARG 488 Ca 0.34 -0.27 0.02 0.00 -1.10 0.00 0.00 59.98 58.97 2a2k h ARG 488 Cb -0.05 -0.13 -0.02 0.00 -1.39 0.00 0.00 29.97 28.38 2a2k h ARG 488 CO -0.06 0.96 0.12 1.49 2.80 0.00 0.00 179.97 185.28 2a2k h GLU 489 N 1.00 0.25 -0.46 0.20 4.81 -0.52 -0.07 114.58 119.79 2a2k h GLU 489 Ca 0.20 -0.02 -0.13 0.00 -0.13 0.00 0.00 59.36 59.29 2a2k h GLU 489 Cb 0.41 -0.06 -0.01 0.00 0.63 0.00 0.00 28.75 29.72 2a2k h GLU 489 CO 0.01 0.17 -0.22 0.00 -0.73 0.00 0.00 179.01 178.24 2a2k h ARG 490 N 0.26 0.95 -0.45 1.92 2.47 -0.95 -1.91 114.38 116.67 2a2k h ARG 490 Ca 0.10 -0.40 -0.00 0.00 -1.26 0.00 0.00 59.98 58.42 2a2k h ARG 490 Cb 0.03 -0.03 -0.02 0.00 -1.65 0.00 0.00 29.97 28.30 2a2k h ARG 490 CO -0.07 1.06 0.28 0.22 0.56 0.00 0.00 179.97 182.02 2a2k h ASP 491 N 0.82 0.53 -0.70 7.04 1.82 -0.35 -1.87 116.42 123.71 2a2k h ASP 491 Ca 0.11 -0.04 -0.04 0.00 -0.39 0.00 0.00 57.03 56.67 2a2k h ASP 491 Cb 0.78 -0.13 -0.03 0.00 0.68 0.00 0.00 39.33 40.63 2a2k h ASP 491 CO 0.07 0.42 0.29 0.03 -1.61 0.00 0.00 179.24 178.43 2a2k h ARG 492 N 0.60 1.04 -0.14 0.28 2.47 -0.91 -2.98 114.38 114.73 2a2k h ARG 492 Ca 0.16 -0.18 -0.03 0.00 -1.26 0.00 0.00 59.98 58.67 2a2k h ARG 492 Cb -0.03 -0.17 -0.01 0.00 -1.65 0.00 0.00 29.97 28.11 2a2k h ARG 492 CO -0.03 0.86 -0.03 0.00 0.56 0.00 0.00 179.97 181.33 2a2k h ALA 493 N 1.14 1.69 -0.65 0.04 0.00 -0.75 -2.76 119.26 117.97 2a2k h ALA 493 Ca 0.24 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 55.03 2a2k h ALA 493 Cb 0.19 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.91 2a2k h ALA 493 CO -0.02 0.23 0.00 1.33 0.00 0.00 0.00 179.25 180.79 2a2k n VAL 494 N -4.39 1.76 -4.30 0.00 0.24 -0.76 -4.96 118.33 105.91 2a2k n VAL 494 Ca -0.01 -1.19 -0.16 0.00 -2.04 0.00 0.00 64.34 60.94 2a2k n VAL 494 Cb 0.18 0.16 -0.10 0.00 -1.47 0.00 0.00 33.84 32.61 2a2k n VAL 494 CO 0.00 0.00 0.00 0.20 -2.14 0.00 0.00 176.83 174.89 2a2k s ASN 495 N -0.94 1.94 -0.25 -1.34 0.01 -1.04 -5.08 114.94 108.24 2a2k s ASN 495 Ca 0.51 -1.11 -0.18 0.00 -0.71 0.00 0.00 52.86 51.37 2a2k s ASN 495 Cb 0.32 -0.02 -0.03 0.00 0.41 0.00 0.00 41.25 41.93 2a2k s ASN 495 CO 0.25 -0.39 0.50 -1.81 -1.51 0.00 0.00 177.10 174.14 2a2k s ASP 496 N -3.25 6.44 0.26 -1.22 1.01 -1.26 -4.93 116.67 113.71 2a2k s ASP 496 Ca 0.23 0.53 -0.30 0.00 0.71 0.00 0.00 52.55 53.72 2a2k s ASP 496 Cb 0.04 -2.27 -0.14 0.00 1.01 0.00 0.00 42.92 41.55 2a2k s ASP 496 CO 0.05 -0.25 1.11 0.00 0.21 0.00 0.00 175.17 176.29 2a2k n TYR 497 N 5.32 1.43 -0.79 4.23 4.19 -1.26 -1.48 117.16 128.80 2a2k n TYR 497 Ca -0.05 0.66 0.08 0.00 3.31 0.00 0.00 57.90 61.90 2a2k n TYR 497 Cb 0.50 -2.29 0.38 0.00 0.49 0.00 0.00 39.34 38.42 2a2k n TYR 497 CO 0.00 0.00 0.00 -0.35 0.91 0.00 0.00 176.86 177.42 2a2k n PRO 498 N 1.13 4.30 -1.84 2.98 -0.04 -1.26 -5.12 135.00 135.15 2a2k n PRO 498 Ca 0.11 -3.03 -0.39 0.00 -0.04 0.00 0.00 63.50 60.15 2a2k n PRO 498 Cb 0.30 -2.08 0.03 0.00 -0.04 0.00 0.00 33.50 31.71 2a2k n PRO 498 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 2a2k s SER 499 N -0.91 5.56 0.01 3.54 0.01 -0.55 -4.03 113.70 117.34 2a2k s SER 499 Ca 0.52 2.77 -0.11 0.00 1.31 0.00 0.00 55.95 60.44 2a2k s SER 499 Cb 0.37 -2.64 0.01 0.00 0.21 0.00 0.00 66.02 63.98 2a2k s SER 499 CO 0.19 -1.37 0.22 -0.76 0.41 0.00 0.00 173.24 171.93 2a2k s LEU 500 N -3.20 1.22 0.09 2.44 1.43 -1.26 -4.53 118.68 114.88 2a2k s LEU 500 Ca 0.67 -0.16 0.04 0.00 -1.03 0.00 0.00 54.13 53.65 2a2k s LEU 500 Cb -0.40 1.00 -0.23 0.00 0.03 0.00 0.00 46.19 46.58 2a2k s LEU 500 CO 0.49 -0.47 1.19 1.88 0.23 0.00 0.00 176.35 179.67 2a2k h TYR 501 N 3.82 0.16 -2.27 0.29 0.05 -1.96 -3.39 116.97 113.66 2a2k h TYR 501 Ca -0.31 -0.11 -0.59 0.00 0.05 0.00 0.00 58.73 57.77 2a2k h TYR 501 Cb 1.19 -0.01 -0.40 0.00 1.01 0.00 0.00 36.73 38.52 2a2k h TYR 501 CO 0.53 1.10 -0.83 0.66 -1.05 0.00 0.00 178.16 178.57 2a2k n TYR 502 N -3.39 1.46 0.34 4.88 4.01 -1.26 -4.94 117.16 118.26 2a2k n TYR 502 Ca -0.04 -3.84 0.14 0.00 -0.16 0.00 0.00 57.90 54.01 2a2k n TYR 502 Cb 0.97 -0.37 0.60 0.00 -0.31 0.00 0.00 39.34 40.23 2a2k n TYR 502 CO 0.00 0.00 0.00 -1.00 -0.46 0.00 0.00 176.86 175.40 2a2k h PRO 503 N 4.50 0.00 -4.53 -0.72 0.13 -1.87 -3.41 132.00 126.10 2a2k h PRO 503 Ca 0.16 0.00 -0.64 0.00 -0.87 0.00 0.00 66.00 64.65 2a2k h PRO 503 Cb 0.79 0.00 -0.38 0.00 0.13 0.00 0.00 31.00 31.54 2a2k h PRO 503 CO 0.61 0.00 -0.78 -2.00 -0.23 0.00 0.00 178.00 175.60 2a2k s GLU 504 N -3.49 1.78 0.01 0.86 2.12 -1.26 -0.37 118.70 118.34 2a2k s GLU 504 Ca 0.02 -1.22 0.02 0.00 0.36 0.00 0.00 54.97 54.16 2a2k s GLU 504 Cb 0.09 -2.73 -0.01 0.00 0.26 0.00 0.00 34.13 31.74 2a2k s GLU 504 CO 0.44 -0.64 -0.06 -1.64 -0.54 0.00 0.00 175.26 172.82 2a2k s MET 505 N 1.25 0.47 0.25 4.30 -1.94 -1.26 -2.13 119.30 120.24 2a2k s MET 505 Ca -0.04 -0.34 0.04 0.00 -1.71 0.00 0.00 55.69 53.64 2a2k s MET 505 Cb -0.19 -0.40 -0.05 0.00 2.01 0.00 0.00 34.83 36.19 2a2k s MET 505 CO -0.07 0.10 -0.01 0.71 -0.01 0.00 0.00 175.02 175.74 2a2k s TYR 506 N -0.43 1.69 -0.09 -0.03 2.02 -0.20 -4.51 117.35 115.80 2a2k s TYR 506 Ca -0.01 -0.87 0.03 0.00 -0.37 0.00 0.00 57.07 55.85 2a2k s TYR 506 Cb -0.04 -0.99 -0.02 0.00 -0.40 0.00 0.00 41.96 40.52 2a2k s TYR 506 CO -0.00 0.04 -0.17 0.42 -1.57 0.00 0.00 175.55 174.27 2a2k s ILE 507 N -3.31 2.79 -0.47 2.71 -1.09 0.39 -0.39 121.20 121.83 2a2k s ILE 507 Ca 0.29 -0.79 -0.29 0.00 -2.23 0.00 0.00 60.65 57.64 2a2k s ILE 507 Cb 0.05 -2.11 0.03 0.00 -1.58 0.00 0.00 42.46 38.85 2a2k s ILE 507 CO 0.10 0.56 1.11 -0.22 -1.23 0.00 0.00 174.94 175.26 2a2k s LEU 508 N -0.13 3.69 0.09 2.97 2.96 -0.24 -1.12 118.68 126.90 2a2k s LEU 508 Ca -0.02 0.43 -0.33 0.00 -0.22 0.00 0.00 54.13 54.00 2a2k s LEU 508 Cb -0.14 -3.50 -0.12 0.00 0.50 0.00 0.00 46.19 42.93 2a2k s LEU 508 CO 0.04 -1.22 1.77 1.17 -1.32 0.00 0.00 176.35 176.79 2a2k n LYS 509 N 7.74 2.47 0.00 1.98 3.00 0.12 -1.67 118.16 131.80 2a2k n LYS 509 Ca 0.11 0.90 0.00 0.00 -0.00 0.00 0.00 58.31 59.32 2a2k n LYS 509 Cb 0.49 -2.75 0.00 0.00 0.00 0.00 0.00 35.03 32.77 2a2k n LYS 509 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2a2k n GLY 510 N 4.04 1.88 7.00 3.14 0.00 -1.25 -4.69 105.19 115.31 2a2k n GLY 510 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.21 2a2k n GLY 510 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2a2k n GLY 511 N -2.00 0.52 0.26 -0.02 0.00 -0.67 -2.49 105.19 100.78 2a2k n GLY 511 Ca 0.00 -0.89 0.00 0.00 0.00 0.00 0.00 46.02 45.14 2a2k n GLY 511 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 2a2k h TYR 512 N 0.00 0.47 -0.88 1.61 3.20 -0.75 -2.05 116.97 118.58 2a2k h TYR 512 Ca 0.00 -0.05 0.12 0.00 3.14 0.00 0.00 58.73 61.94 2a2k h TYR 512 Cb 0.00 -0.13 -0.07 0.00 1.54 0.00 0.00 36.73 38.07 2a2k h TYR 512 CO 0.00 0.51 0.57 -0.22 -1.64 0.00 0.00 178.16 177.37 2a2k h LYS 513 N 0.43 0.76 0.00 1.82 3.11 -1.20 -1.34 116.57 120.14 2a2k h LYS 513 Ca 0.09 -0.05 -0.01 0.00 -2.81 0.00 0.00 60.65 57.87 2a2k h LYS 513 Cb 0.37 -0.17 -0.00 0.00 -1.00 0.00 0.00 32.23 31.42 2a2k h LYS 513 CO 0.02 0.50 -1.39 0.39 -2.81 0.00 0.00 179.45 176.16 2a2k n GLU 514 N -4.55 0.63 -0.02 1.90 -0.58 -1.04 -4.34 120.64 112.64 2a2k n GLU 514 Ca 0.16 0.01 -0.15 0.00 -0.42 0.00 0.00 57.16 56.76 2a2k n GLU 514 Cb 0.38 -1.72 -0.12 0.00 -0.57 0.00 0.00 31.44 29.42 2a2k n GLU 514 CO 0.00 0.00 0.00 0.35 -0.48 0.00 0.00 177.13 177.00 2a2k h PHE 515 N 0.00 0.26 -0.51 -0.32 3.57 -0.72 -3.33 116.94 115.90 2a2k h PHE 515 Ca -0.02 -0.15 0.09 0.00 3.53 0.00 0.00 57.97 61.43 2a2k h PHE 515 Cb 1.05 -0.03 -0.07 0.00 2.79 0.00 0.00 35.95 39.68 2a2k h PHE 515 CO 0.00 0.97 0.07 0.35 -2.23 0.00 0.00 178.31 177.47 2a2k h PHE 516 N -0.52 0.10 0.00 0.41 3.57 -1.47 -0.15 116.94 118.89 2a2k h PHE 516 Ca -0.04 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.50 2a2k h PHE 516 Cb 1.05 0.03 0.00 0.00 2.79 0.00 0.00 35.95 39.82 2a2k h PHE 516 CO 0.19 -0.04 0.00 -0.35 -2.23 0.00 0.00 178.31 175.87 2a2k n PRO 517 N -5.15 0.17 -0.07 6.41 -0.04 -1.26 -2.44 135.00 132.63 2a2k n PRO 517 Ca 0.06 0.49 -0.20 0.00 -0.04 0.00 0.00 63.50 63.80 2a2k n PRO 517 Cb 0.26 -1.89 -0.13 0.00 -0.04 0.00 0.00 33.50 31.70 2a2k n PRO 517 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 2a2k n GLN 518 N -2.23 0.69 -3.21 0.54 1.13 -0.46 -4.78 117.38 109.06 2a2k n GLN 518 Ca 0.01 0.22 -0.23 0.00 -1.94 0.00 0.00 57.00 55.05 2a2k n GLN 518 Cb 0.17 -1.61 -0.06 0.00 0.11 0.00 0.00 30.24 28.85 2a2k n GLN 518 CO 0.00 0.00 0.00 0.72 -1.44 0.00 0.00 177.06 176.34 2a2k n HIS 519 N -3.44 0.47 0.07 1.08 8.25 -0.19 -4.96 115.22 116.51 2a2k n HIS 519 Ca -0.40 -3.71 0.09 0.00 -0.26 0.00 0.00 57.72 53.44 2a2k n HIS 519 Cb 1.00 -0.40 0.55 0.00 1.12 0.00 0.00 29.99 32.26 2a2k n HIS 519 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 2a2k h PRO 520 N 3.79 0.26 0.00 -0.41 0.13 -1.71 -1.60 132.00 132.45 2a2k h PRO 520 Ca 0.10 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 65.21 2a2k h PRO 520 Cb 0.85 -0.06 0.00 0.00 0.13 0.00 0.00 31.00 31.92 2a2k h PRO 520 CO 0.53 0.17 0.00 -1.71 -0.23 0.00 0.00 178.00 176.77 2a2k n ASN 521 N -4.49 0.00 -1.16 1.44 5.15 -1.26 -1.75 115.26 113.19 2a2k n ASN 521 Ca 0.03 -0.93 0.08 0.00 -0.60 0.00 0.00 54.58 53.16 2a2k n ASN 521 Cb 0.20 0.00 0.28 0.00 -0.53 0.00 0.00 39.78 39.72 2a2k n ASN 521 CO 0.00 0.00 0.00 0.49 1.40 0.00 0.00 177.26 179.15 2a2k n PHE 522 N -0.97 1.04 -4.35 1.20 3.01 -0.60 -4.96 117.46 111.83 2a2k n PHE 522 Ca 0.20 -0.62 -0.22 0.00 1.01 0.00 0.00 57.45 57.81 2a2k n PHE 522 Cb 0.09 -0.17 -0.11 0.00 -0.01 0.00 0.00 39.48 39.28 2a2k n PHE 522 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2a2k s GLU 524 N -2.84 0.56 1.04 0.00 -1.05 0.66 -4.14 118.70 112.93 2a2k s GLU 524 Ca 0.17 1.22 -0.14 0.00 -0.15 0.00 0.00 54.97 56.07 2a2k s GLU 524 Cb -0.06 0.40 0.21 0.00 -0.44 0.00 0.00 34.13 34.24 2a2k s GLU 524 CO 0.07 -0.18 1.10 -1.25 0.95 0.00 0.00 175.26 175.95 2a2k s PRO 525 N 2.18 0.11 -1.44 -4.83 0.04 -1.26 -2.30 135.00 127.49 2a2k s PRO 525 Ca -0.07 0.36 -0.13 0.00 0.04 0.00 0.00 61.00 61.19 2a2k s PRO 525 Cb -0.09 -1.71 0.05 0.00 0.04 0.00 0.00 34.50 32.79 2a2k s PRO 525 CO -0.18 -2.91 2.22 1.04 0.04 0.00 0.00 177.00 177.21 2a2k n GLN 526 N -4.27 3.02 -4.00 4.56 6.02 -1.26 -4.23 117.38 117.22 2a2k n GLN 526 Ca 0.07 -2.72 -0.12 0.00 -0.01 0.00 0.00 57.00 54.21 2a2k n GLN 526 Cb 0.58 -3.21 -0.03 0.00 1.02 0.00 0.00 30.24 28.61 2a2k n GLN 526 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.06 176.39 2a2k s ASP 527 N 2.78 0.49 -0.12 1.08 -1.08 -1.26 -5.10 116.67 113.46 2a2k s ASP 527 Ca 0.47 -1.29 -0.04 0.00 -0.52 0.00 0.00 52.55 51.17 2a2k s ASP 527 Cb 0.14 0.70 0.06 0.00 -1.46 0.00 0.00 42.92 42.36 2a2k s ASP 527 CO -0.07 -1.38 0.17 -0.47 0.52 0.00 0.00 175.17 173.94 2a2k s TYR 528 N -3.03 -0.18 -0.36 -5.34 5.04 -1.23 -4.23 117.35 108.02 2a2k s TYR 528 Ca 0.25 0.45 -0.05 0.00 -2.44 0.00 0.00 57.07 55.28 2a2k s TYR 528 Cb -0.02 -0.31 0.07 0.00 0.35 0.00 0.00 41.96 42.04 2a2k s TYR 528 CO 0.16 -0.38 0.12 0.50 -1.34 0.00 0.00 175.55 174.62 2a2k s ARG 529 N 2.29 2.42 0.72 4.97 3.52 -1.26 -5.02 118.95 126.59 2a2k s ARG 529 Ca 0.04 -1.40 -0.15 0.00 -0.13 0.00 0.00 55.73 54.09 2a2k s ARG 529 Cb -0.13 -3.46 0.03 0.00 -1.56 0.00 0.00 34.95 29.83 2a2k s ARG 529 CO -0.08 -0.80 1.18 -2.14 -0.81 0.00 0.00 175.30 172.66 2a2k s PRO 530 N 1.30 2.26 0.29 5.12 0.02 -1.26 -4.63 135.00 138.11 2a2k s PRO 530 Ca 0.00 1.68 -0.02 0.00 0.02 0.00 0.00 61.00 62.68 2a2k s PRO 530 Cb -0.21 -1.86 0.42 0.00 0.02 0.00 0.00 34.50 32.87 2a2k s PRO 530 CO -0.00 -1.72 1.96 1.98 -0.33 0.00 0.00 177.00 178.88 2a2k h MET 531 N -0.25 1.12 -0.87 5.54 1.85 -1.99 -2.12 114.93 118.22 2a2k h MET 531 Ca -0.47 -0.07 -0.08 0.00 -0.61 0.00 0.00 59.70 58.47 2a2k h MET 531 Cb 1.28 -0.25 -0.05 0.00 0.43 0.00 0.00 31.60 33.01 2a2k h MET 531 CO 0.50 0.74 0.10 0.09 -0.40 0.00 0.00 176.91 177.95 2a2k n ASN 532 N -4.41 3.29 -4.68 1.39 3.02 -1.26 -4.90 115.26 107.71 2a2k n ASN 532 Ca 0.10 -2.55 -0.46 0.00 -0.03 0.00 0.00 54.58 51.65 2a2k n ASN 532 Cb 0.04 -0.61 -0.04 0.00 -0.61 0.00 0.00 39.78 38.56 2a2k n ASN 532 CO 0.00 0.00 0.00 1.57 -2.62 0.00 0.00 177.26 176.21 2a2k n HIS 533 N 0.11 2.35 -0.00 3.10 -0.00 -0.80 -4.84 115.22 115.14 2a2k n HIS 533 Ca 0.18 0.18 0.22 0.00 -0.00 0.00 0.00 57.72 58.31 2a2k n HIS 533 Cb 0.82 -2.58 0.72 0.00 -0.00 0.00 0.00 29.99 28.95 2a2k n HIS 533 CO 0.00 0.00 0.00 0.93 -0.00 0.00 0.00 176.34 177.27 2a2k h GLU 534 N 6.61 0.00 -0.05 1.57 5.08 -1.92 -1.36 114.58 124.51 2a2k h GLU 534 Ca -0.45 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.91 2a2k h GLU 534 Cb 1.25 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.50 2a2k h GLU 534 CO 0.91 0.00 0.00 0.00 -1.00 0.00 0.00 179.01 178.92 2a2k n ALA 535 N -2.51 2.57 -1.64 3.43 0.00 -1.26 -4.09 120.51 117.00 2a2k n ALA 535 Ca 0.11 -0.45 0.06 0.00 0.00 0.00 0.00 53.44 53.16 2a2k n ALA 535 Cb 0.71 -1.16 0.16 0.00 0.00 0.00 0.00 19.45 19.16 2a2k n ALA 535 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 2a2k n PHE 536 N 0.15 0.00 -0.32 0.00 3.01 -0.51 -4.79 117.46 114.99 2a2k n PHE 536 Ca 0.18 -1.18 -0.04 0.00 1.01 0.00 0.00 57.45 57.43 2a2k n PHE 536 Cb 0.33 -0.20 0.10 0.00 -0.01 0.00 0.00 39.48 39.70 2a2k n PHE 536 CO 0.00 0.00 0.00 0.87 1.01 0.00 0.00 176.76 178.64 2a2k h LYS 537 N 0.74 1.24 -0.23 -1.08 1.57 -1.71 -1.44 116.57 115.65 2a2k h LYS 537 Ca -0.03 -0.14 -0.16 0.00 -1.87 0.00 0.00 60.65 58.44 2a2k h LYS 537 Cb 1.15 -0.24 -0.01 0.00 0.08 0.00 0.00 32.23 33.21 2a2k h LYS 537 CO 0.01 0.90 -0.51 -0.44 -0.57 0.00 0.00 179.45 178.85 2a2k h ASP 538 N 1.24 0.72 -0.33 0.86 3.32 -1.92 -2.88 116.42 117.42 2a2k h ASP 538 Ca 0.31 -0.37 -0.05 0.00 0.02 0.00 0.00 57.03 56.94 2a2k h ASP 538 Cb 0.03 -0.20 -0.02 0.00 0.22 0.00 0.00 39.33 39.35 2a2k h ASP 538 CO -0.05 1.10 0.04 -0.33 -1.72 0.00 0.00 179.24 178.28 2a2k h GLU 539 N 0.51 0.66 -0.19 3.56 3.07 -1.80 -0.49 114.58 119.90 2a2k h GLU 539 Ca 0.02 -0.14 -0.02 0.00 -0.50 0.00 0.00 59.36 58.72 2a2k h GLU 539 Cb 1.06 -0.09 -0.01 0.00 -0.84 0.00 0.00 28.75 28.87 2a2k h GLU 539 CO 0.10 0.65 0.05 1.25 -1.40 0.00 0.00 179.01 179.66 2a2k h LEU 540 N 0.63 0.28 -0.44 1.33 6.46 -1.16 -1.73 115.31 120.68 2a2k h LEU 540 Ca 0.14 -0.21 -0.02 0.00 -0.12 0.00 0.00 57.88 57.66 2a2k h LEU 540 Cb 0.33 -0.07 -0.02 0.00 -0.73 0.00 0.00 40.66 40.17 2a2k h LEU 540 CO 0.01 0.42 0.20 0.11 -0.62 0.00 0.00 178.44 178.56 2a2k h LYS 541 N 0.13 0.64 -0.49 1.25 1.57 -1.27 -1.74 116.57 116.65 2a2k h LYS 541 Ca 0.06 -0.10 0.06 0.00 -1.87 0.00 0.00 60.65 58.79 2a2k h LYS 541 Cb 0.24 -0.11 -0.05 0.00 0.08 0.00 0.00 32.23 32.39 2a2k h LYS 541 CO -0.00 0.56 0.21 1.15 -0.57 0.00 0.00 179.45 180.80 2a2k h THR 542 N 0.56 0.89 -0.24 -0.16 2.02 -0.99 -2.56 112.91 112.44 2a2k h THR 542 Ca 0.15 -0.14 -0.04 0.00 0.77 0.00 0.00 66.41 67.15 2a2k h THR 542 Cb 0.14 0.44 -0.01 0.00 -1.74 0.00 0.00 68.15 66.98 2a2k h THR 542 CO -0.02 0.08 0.01 0.15 0.37 0.00 0.00 175.52 176.11 2a2k h PHE 543 N 0.42 0.45 -0.30 3.16 3.57 -1.11 -3.12 116.94 120.02 2a2k h PHE 543 Ca 0.23 -0.08 0.06 0.00 3.53 0.00 0.00 57.97 61.71 2a2k h PHE 543 Cb 0.19 -0.12 -0.01 0.00 2.79 0.00 0.00 35.95 38.80 2a2k h PHE 543 CO -0.13 0.58 0.21 0.00 -2.23 0.00 0.00 178.31 176.74 2a2k h ARG 544 N 0.20 0.15 0.00 1.11 3.08 -1.07 0.18 114.38 118.03 2a2k h ARG 544 Ca 0.07 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.11 2a2k h ARG 544 Cb 0.39 -0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.41 2a2k h ARG 544 CO 0.01 0.10 0.00 1.28 -1.07 0.00 0.00 179.97 180.29 2a2k n LEU 545 N -4.48 0.00 -0.21 3.04 4.77 -0.99 -1.75 117.00 117.38 2a2k n LEU 545 Ca 0.03 0.00 0.08 0.00 -0.03 0.00 0.00 56.01 56.09 2a2k n LEU 545 Cb 0.26 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.32 2a2k n LEU 545 CO 0.35 0.00 0.14 0.29 -1.33 0.00 0.00 177.39 176.84 2a2k n LYS 546 N -0.95 1.76 -1.74 3.23 5.02 0.05 -5.00 118.16 120.53 2a2k n LYS 546 Ca 0.13 -0.47 -0.31 0.00 -2.02 0.00 0.00 58.31 55.64 2a2k n LYS 546 Cb 0.06 -1.26 0.04 0.00 -0.02 0.00 0.00 35.03 33.85 2a2k n LYS 546 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 2a2k s THR 547 N -2.15 3.99 0.10 -0.18 -4.23 -0.72 -4.98 115.64 107.47 2a2k s THR 547 Ca 0.10 0.65 0.14 0.00 -1.18 0.00 0.00 61.69 61.39 2a2k s THR 547 Cb 0.13 -3.53 0.01 0.00 1.34 0.00 0.00 72.50 70.44 2a2k s THR 547 CO 0.51 -0.84 1.54 0.08 -0.54 0.00 0.00 174.62 175.36 2a2k h ARG 548 N -0.63 0.00 -2.19 3.99 -0.00 -1.95 -3.46 114.38 110.14 2a2k h ARG 548 Ca -0.45 0.00 -0.07 0.00 -0.00 0.00 0.00 59.98 59.47 2a2k h ARG 548 Cb 1.22 0.00 -0.20 0.00 -0.00 0.00 0.00 29.97 30.99 2a2k h ARG 548 CO 0.61 0.60 0.08 0.45 -0.00 0.00 0.00 179.97 181.70 2a2k s SER 549 N -6.59 -0.61 0.00 0.08 0.15 -1.26 -5.23 113.70 100.25 2a2k s SER 549 Ca 0.01 0.85 0.00 0.00 0.70 0.00 0.00 55.95 57.51 2a2k s SER 549 Cb 0.10 0.80 0.00 0.00 -1.71 0.00 0.00 66.02 65.21 2a2k s SER 549 CO 0.75 -0.45 0.18 -2.67 1.20 0.00 0.00 173.24 172.25