NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 503 D 4.5260 8.2076 120.1932 53.7952 41.4316 175.9080 504 F 4.2519 8.4692 123.2209 58.8936 38.0910 176.6267 505 C 4.5257 8.5778 119.5463 58.8594 40.9574 175.3557 506 L 4.3946 7.6536 118.0478 54.6077 41.9171 176.6915 507 E 4.2582 7.6897 119.4734 54.9987 30.0781 175.1102 508 P 4.4059 0.0000 0.0000 61.5028 32.1796 174.4266 509 P 3.6333 0.0000 0.0000 62.6163 31.4390 175.2735 510 Y 4.6532 7.8700 121.4367 56.0664 40.1309 175.4079 511 T 4.1528 8.2918 125.5172 64.8361 68.8556 176.1706 512 G 3.7058 6.7193 105.7287 43.9864 0.0000 171.3073 513 P 4.3246 0.0000 0.0000 64.8468 32.0557 177.8382 514 C 4.4733 7.8277 116.5928 57.2838 40.6930 173.0413 515 M 4.5244 8.2436 119.9688 55.5627 32.0276 176.4397 516 A 4.2846 7.8128 121.6052 51.3340 20.8147 177.6708 517 R 4.6482 8.1839 118.7421 54.2721 29.8673 172.6698 518 I 4.4080 8.4131 122.5434 59.0466 39.7633 174.7295 519 I 4.3565 8.3079 128.4262 60.9311 37.9779 175.2590 520 R 4.8180 8.2159 125.4111 54.5590 34.6676 173.6921 521 Y 5.6989 9.4429 117.0436 56.6992 41.4669 175.4344 522 F 5.7434 9.4580 116.5209 55.5033 42.0213 172.8292 523 Y 4.4189 9.9293 123.3206 57.4034 39.5246 174.8213 524 N 4.5516 8.3613 126.4763 51.3049 38.3254 174.6476 525 A 3.6865 8.2996 131.0549 55.2695 18.9516 179.8654 526 K 4.0690 7.9278 116.6067 57.5993 31.7824 182.0580 527 A 4.1621 8.0026 120.4152 52.1405 18.9222 177.5127 528 G 3.8286 8.4962 103.8472 45.7433 0.0000 173.0384 529 L 4.5901 6.9490 117.7742 54.5626 44.2088 174.2743 530 C 5.0750 8.6174 116.7866 56.1486 40.4503 173.3367 531 Q 4.8574 8.6182 121.7988 54.1392 32.7446 174.4731 532 T 5.3629 8.5779 110.2630 60.5048 70.7881 173.7151 533 F 4.9958 8.2192 116.3869 56.0304 41.7445 172.6997 534 V 4.3181 8.4160 119.7787 61.9956 32.3446 174.1354 535 Y 4.7888 8.8540 130.1515 56.0437 40.3523 176.4490 536 G 3.8723 8.1069 113.4885 46.1351 0.0000 174.9310 537 G 3.8343 6.3045 107.0575 45.4190 0.0000 172.4751 538 C 4.9065 7.0126 112.0238 55.0996 44.4289 173.0841 539 R 3.8501 8.8190 116.3050 57.0596 26.8838 176.8872 540 A 4.2161 8.4249 119.4443 52.5927 18.9695 178.4478 541 K 4.3962 8.3269 121.2686 54.8448 33.9808 177.2205 542 R 3.6454 8.1322 118.0301 58.9872 30.3313 177.6456 543 N 4.7704 7.8780 118.0055 51.2350 37.3722 173.6623 544 N 5.0550 6.5340 116.3537 52.7287 41.7358 173.1916 545 F 5.0979 9.5216 124.7074 55.6290 42.6251 176.4272 546 K 4.4944 8.8836 121.8621 58.3749 32.7679 177.6326 547 S 4.4195 7.6866 112.5104 55.6360 67.1072 174.6552 548 A 3.3946 7.3024 124.0014 54.9264 18.0614 179.9715 549 E 3.7962 7.7650 116.8215 59.5861 29.5907 179.0894 550 D 4.2590 7.8648 118.8015 57.2766 40.8711 177.9292 551 C 2.4500 7.5808 118.5104 59.2257 43.7885 175.7315 552 L 3.8156 7.9469 120.8609 57.5321 40.8878 179.5710 553 R 3.7826 7.5847 117.9104 59.6326 30.1244 178.5387 554 T 4.0516 7.5689 114.1598 66.4090 69.0681 175.5629 555 C 4.5096 8.1978 117.0565 55.5112 41.4365 174.1034 556 G 3.8463 6.8442 108.9846 47.3691 0.0000 173.6653 557 G 3.8015 8.9974 111.9525 45.5020 0.0000 173.0355 558 A 4.0998 7.2158 127.4194 52.1209 18.5237 177.9412 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 503 D 8.21 4.53 0.00 2.64 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 504 F 8.47 4.25 0.00 3.38 3.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 505 C 8.58 4.53 0.00 2.90 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 506 L 7.65 4.39 0.00 1.76 1.74 0.93 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 507 E 7.69 4.26 0.00 2.11 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.46 0.00 508 P 0.00 4.41 0.00 2.07 2.00 0.00 3.77 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.93 0.00 509 P 0.00 3.63 0.00 0.54 0.49 0.00 3.23 0.00 0.00 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.44 0.00 510 Y 7.87 4.65 0.00 2.79 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 511 T 8.29 4.15 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 512 G 6.72 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 513 P 0.00 4.32 0.00 2.17 2.19 0.00 3.76 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.02 0.00 514 C 7.83 4.47 0.00 2.81 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 515 M 8.24 4.52 0.00 1.95 2.01 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.41 0.00 516 A 7.81 4.28 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 517 R 8.18 4.65 0.00 1.73 1.76 0.00 3.33 0.00 0.00 3.19 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.53 0.00 518 I 8.41 4.41 2.03 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.55 0.98 0.00 0.00 519 I 8.31 4.36 1.81 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.42 0.73 0.00 0.00 520 R 8.22 4.82 0.00 0.99 1.97 0.00 3.39 0.00 0.00 3.26 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.53 0.00 521 Y 9.44 5.70 0.00 3.18 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 522 F 9.46 5.74 0.00 3.21 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 523 Y 9.93 4.42 0.00 2.99 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 524 N 8.36 4.55 0.00 2.13 2.44 0.00 0.00 6.65 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 525 A 8.30 3.69 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 526 K 7.93 4.07 0.00 1.75 1.74 0.00 1.81 0.00 0.00 1.71 0.00 0.00 2.93 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.39 1.26 7.81 527 A 8.00 4.16 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 528 G 8.50 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 529 L 6.95 4.59 0.00 1.69 1.71 0.79 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 530 C 8.62 5.08 0.00 2.92 3.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 531 Q 8.62 4.86 0.00 1.33 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.81 0.00 0.00 0.00 0.00 0.00 2.10 1.89 0.00 532 T 8.58 5.36 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.64 0.00 0.00 533 F 8.22 5.00 0.00 3.03 3.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 534 V 8.42 4.32 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.00 0.00 0.90 0.00 0.00 535 Y 8.85 4.79 0.00 2.54 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 536 G 8.11 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 537 G 6.30 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 538 C 7.01 4.91 0.00 3.06 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 539 R 8.82 3.85 0.00 2.20 2.31 0.00 3.31 0.00 0.00 3.33 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.68 0.00 540 A 8.42 4.22 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 541 K 8.33 4.40 0.00 1.75 1.70 0.00 1.43 0.00 0.00 1.50 0.00 0.00 2.97 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.16 1.20 7.81 542 R 8.13 3.65 0.00 1.16 0.70 0.00 2.28 0.00 0.00 2.80 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 1.29 0.00 543 N 7.88 4.77 0.00 3.17 2.87 0.00 0.00 6.70 7.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 544 N 6.53 5.05 0.00 2.67 2.57 0.00 0.00 7.08 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 545 F 9.52 5.10 0.00 3.21 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 546 K 8.88 4.49 0.00 1.84 1.95 0.00 1.79 0.00 0.00 1.81 0.00 0.00 2.98 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.50 1.49 7.81 547 S 7.69 4.42 0.00 3.97 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 548 A 7.30 3.39 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 549 E 7.77 3.80 0.00 1.97 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.38 0.00 550 D 7.86 4.26 0.00 2.89 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 551 C 7.58 2.45 0.00 2.82 3.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 552 L 7.95 3.82 0.00 1.58 1.61 0.87 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 553 R 7.58 3.78 0.00 1.88 1.98 0.00 3.23 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.62 0.00 554 T 7.57 4.05 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 555 C 8.20 4.51 0.00 2.66 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 556 G 6.84 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 557 G 9.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 558 A 7.22 4.10 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00