NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.2502 8.3144 120.1354 55.9505 33.5061 174.9199 2 E 3.9398 8.6039 123.8688 53.7616 30.3097 175.8102 3 S 4.3572 8.9385 123.1542 58.2294 66.1055 174.6402 4 A 4.0316 8.5263 124.2064 55.2140 18.1795 179.9985 5 A 3.9722 7.9822 118.6766 55.3774 18.5506 179.6233 6 A 4.0172 8.0807 119.3761 54.9617 18.3552 179.8129 7 K 4.0149 8.2719 118.3524 59.5835 32.3002 178.7510 8 F 4.0458 8.3998 120.9321 61.3432 39.3783 176.8907 9 E 3.9919 8.3335 118.0723 59.4791 29.0903 179.3341 10 R 3.8285 7.8600 117.3054 59.6122 30.2546 178.2224 11 Q 4.0462 8.1508 116.5975 57.7461 28.9147 176.3213 12 H 4.6752 7.7895 113.2104 54.8921 30.7173 172.9458 13 M 4.5591 7.5990 119.7985 53.7392 33.8291 176.7116 14 D 4.7334 8.1843 122.3432 52.9788 42.0929 174.9133 15 S 4.1515 8.0413 116.6709 57.5235 63.8576 174.8602 16 G 4.3368 8.0146 114.5976 44.9215 0.0000 172.3376 17 N 4.5274 8.3841 117.3685 55.5973 39.1935 176.6715 18 S 4.7647 7.5474 114.2473 55.8855 62.9036 172.7218 19 P 4.2324 0.0000 0.0000 65.3224 31.7569 178.4056 20 S 4.5493 7.9012 110.9315 57.7874 63.4481 173.8809 21 S 4.2328 7.7062 117.4970 58.4659 62.7472 175.3996 22 S 4.2629 8.6986 121.7619 60.8809 62.9958 175.7432 23 S 4.4251 8.0463 113.9438 59.6423 63.1919 174.2073 24 N 4.6816 8.2557 118.8141 54.1039 39.3630 176.2121 25 Y 4.1213 8.0647 120.2567 61.3146 38.7214 177.6974 26 C 4.1604 8.3090 116.4682 59.9653 39.5662 175.8486 27 N 4.4233 8.1868 117.5315 56.4452 38.2194 177.3389 28 L 3.9574 7.8954 120.1262 57.9777 41.8006 179.4597 29 M 3.7254 7.8932 118.9923 58.5450 31.6673 178.7370 30 M 4.1776 8.2456 119.1568 58.2100 31.9468 178.5217 31 C 4.1595 7.5982 119.2226 61.7674 31.6706 174.8700 32 C 3.9271 8.1002 119.5454 62.8013 31.0756 174.9848 33 R 4.1937 8.3326 114.3263 55.9752 29.2082 176.5823 34 K 3.8740 7.6913 116.0592 58.3948 30.2674 175.7715 35 M 4.6908 8.3722 114.8523 55.3781 32.4470 177.1859 36 T 5.0902 7.6766 107.1119 60.3075 69.6155 172.5524 37 Q 4.6156 8.4569 120.9472 56.3844 30.3928 174.3805 38 G 4.2042 10.9101 115.0671 45.0497 0.0000 172.9908 39 K 3.6921 6.9071 116.4231 55.2779 35.2881 174.9954 40 C 4.8594 8.4124 117.1006 55.1170 40.5114 173.9532 41 K 4.1363 8.5053 127.3541 55.7371 32.3882 174.5285 42 P 4.6991 0.0000 0.0000 65.6380 32.0448 176.3840 43 V 5.0936 7.4982 117.3896 61.0364 35.0065 174.1067 44 N 4.5309 8.6855 122.4579 52.9716 42.7771 173.0585 45 T 4.7553 7.8280 122.1393 61.6571 71.2334 173.5510 46 F 4.6792 8.7997 123.7036 55.6129 42.0678 174.3594 47 V 4.4015 8.4509 123.2991 61.3509 32.8533 175.0584 48 H 5.0376 8.9261 126.0915 56.1086 29.1310 174.9491 49 E 4.6516 8.0743 116.7458 54.1872 32.2831 176.4682 50 S 4.2245 8.3052 114.1234 58.5453 64.2978 174.9375 51 L 4.0421 8.5695 128.4170 57.8584 41.9789 179.2686 52 A 4.0098 7.9182 120.7336 55.2618 18.1987 179.1643 53 D 4.3378 7.9581 116.0076 57.3744 41.1336 178.6948 54 V 3.7738 7.8007 118.6862 65.8564 31.5854 178.3264 55 K 3.9800 8.2234 118.1402 59.2545 31.8718 179.1452 56 A 4.0055 7.9257 120.5878 54.8833 18.2129 179.6522 57 V 3.7574 7.4830 116.9051 66.2288 31.2747 176.8718 58 C 3.9317 7.7893 114.0024 57.6801 39.8508 173.8623 59 S 4.6204 7.6578 114.5567 57.9137 64.2120 174.7835 60 Q 4.5985 7.3615 120.8128 56.4937 27.9385 177.2403 61 K 4.2448 8.6936 128.5995 56.9685 33.0236 175.7448 62 K 4.2276 8.6717 129.5095 56.4787 32.7814 176.1022 63 V 4.5204 8.2447 118.8437 60.1911 36.7598 174.1886 64 T 4.2102 8.2440 118.9836 63.3080 69.4044 175.9344 65 C 4.7330 8.6209 122.9471 56.2602 41.0578 175.1735 66 K 3.8309 8.7899 121.2741 59.3497 31.6154 178.1081 67 N 4.6230 8.1320 113.9020 52.5988 37.4008 175.9343 68 G 3.9417 7.9384 107.7592 45.6040 0.0000 174.4367 69 Q 4.2029 8.2405 119.1307 56.2778 29.2394 176.4412 70 T 4.6478 8.3263 108.7807 61.5625 69.2584 174.0559 71 N 4.9779 7.8850 118.5971 53.6464 38.3060 174.6487 72 C 5.5087 7.4616 116.2250 56.8958 43.8412 172.9053 73 Y 5.2572 8.8536 117.9877 56.4613 41.9711 173.8372 74 Q 5.2647 9.3644 124.8213 53.9545 31.6883 174.9016 75 S 4.5500 8.8609 122.0987 58.3294 63.0578 174.5805 76 K 4.0673 9.3145 125.2680 58.7441 32.2333 176.6939 77 S 5.0576 7.7004 112.6500 56.4495 65.8312 174.2403 78 T 4.2443 8.2363 111.3502 61.9553 69.8558 173.8050 79 M 5.0078 8.9326 122.0296 53.4589 36.5975 175.1298 80 R 4.6274 9.4024 122.3854 56.2157 31.1972 175.7619 81 I 5.1026 8.8806 117.4423 59.2830 41.8262 174.3014 82 T 5.0971 9.0609 119.5646 61.8953 71.5188 172.6282 83 D 4.9139 9.6218 127.3263 53.2027 43.2381 174.1762 84 C 5.5325 9.0752 123.8796 55.3160 38.5153 172.8565 85 R 5.2487 8.8046 124.2658 53.9683 32.9838 174.1180 86 E 4.0705 8.9103 127.8402 56.9492 30.3691 176.7361 87 T 4.2345 8.6731 117.2913 60.7708 70.2772 176.0787 88 G 3.6662 8.7196 111.5717 48.5687 0.0000 175.3023 89 S 4.2035 7.9115 113.4087 60.2845 63.5682 174.7291 90 S 4.1234 7.3284 115.8593 58.4147 62.5177 173.5716 91 K 4.3750 8.9331 128.3849 55.0976 34.6622 174.4084 92 Y 4.3560 8.7780 127.8757 57.7847 39.0117 173.9910 93 P 3.2723 0.0000 0.0000 62.8010 31.7242 176.8311 94 N 4.6666 7.9663 119.7284 52.3243 37.1609 172.1563 95 C 4.7127 8.2113 118.1257 56.1055 41.8783 173.0987 96 A 5.0481 8.8668 125.6516 50.3425 21.7729 174.4753 97 Y 5.0366 9.5527 119.3639 55.9659 41.9737 174.9311 98 K 4.5605 9.2429 123.7831 55.4883 34.2773 175.1436 99 T 5.0456 8.5700 123.9523 62.6473 70.0634 174.2060 100 T 4.6399 8.9363 122.7781 61.8875 72.2777 172.7825 101 Q 4.9845 8.7800 125.5179 54.6027 30.4334 175.3638 102 V 4.5632 8.7172 116.0777 60.0650 37.2442 173.9471 103 E 5.3045 8.6646 120.3990 53.9759 31.3652 175.6505 104 K 4.7789 8.2969 122.7496 54.5450 37.3960 175.6030 105 H 4.8050 9.3969 119.2706 55.8377 29.9808 174.9096 106 I 4.9103 9.0246 114.9884 59.2631 41.1128 174.3362 107 I 4.9375 8.1321 123.7293 59.7288 40.3876 175.1296 108 V 4.7049 8.6308 118.9633 59.4113 36.3954 174.2540 109 A 5.0853 8.8143 124.5036 51.0474 20.7600 175.6445 110 C 5.4108 8.9132 119.3244 55.6106 42.6240 173.3828 111 G 3.9435 9.2480 108.3904 46.5183 0.0000 173.2282 112 G 4.0723 8.9944 109.2506 44.4704 0.0000 172.5992 113 K 4.4025 8.1886 118.9863 53.6732 34.3280 174.3517 114 P 4.3220 0.0000 0.0000 62.7978 31.6597 175.6254 115 S 4.6669 8.3755 114.4999 58.4021 62.6415 173.4582 116 V 4.6306 8.5470 119.7470 58.5075 36.3195 173.3477 117 P 4.7843 0.0000 0.0000 63.2708 31.3810 176.8239 118 V 4.4924 8.8429 115.8964 60.9304 33.5658 175.0360 119 H 4.6372 7.8845 117.9548 55.2754 33.1513 171.8913 120 F 4.5715 8.7474 127.5109 57.2875 39.8955 174.2728 121 D 4.5771 8.3708 126.4249 55.6930 42.0915 175.5661 122 A 4.6699 6.5383 117.2290 51.5179 22.7233 174.4176 123 S 5.2048 8.7485 112.7072 56.7435 66.2925 174.7398 124 V 4.1441 8.8400 121.8816 61.9809 31.5293 175.1949 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 1 K 8.31 4.25 0.00 1.75 1.82 0.00 1.61 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.35 1.50 7.81 2 E 8.60 3.94 0.00 2.02 1.87 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 2.31 2.37 0.00 3 S 8.94 4.36 0.00 4.10 3.99 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 4 A 8.53 4.03 1.36 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 5 A 7.98 3.97 1.34 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 6 A 8.08 4.02 1.35 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 7 K 8.27 4.01 0.00 1.97 2.04 0.00 1.67 0.00 0.00 1.61 0.00 0.00 2.91 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.45 7.81 8 F 8.40 4.05 0.00 3.19 3.26 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 9 E 8.33 3.99 0.00 2.28 2.02 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 0.00 2.49 2.71 0.00 10 R 7.86 3.83 0.00 1.78 2.08 0.00 3.23 0.00 0.00 3.21 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.63 0.00 11 Q 8.15 4.05 0.00 1.69 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.47 0.00 0.00 0.00 0.00 0.00 2.28 2.50 0.00 12 H 7.79 4.68 0.00 2.04 2.86 0.00 5.63 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 M 7.60 4.56 0.00 2.04 2.11 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.63 0.00 14 D 8.18 4.73 0.00 2.53 2.50 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 15 S 8.04 4.15 0.00 3.90 3.81 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 16 G 8.01 4.34 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 17 N 8.38 4.53 0.00 2.73 2.88 0.00 0.00 6.71 7.57 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 18 S 7.55 4.76 0.00 3.84 3.76 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 19 P 0.00 4.23 0.00 2.17 2.18 0.00 3.84 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.95 0.00 20 S 7.90 4.55 0.00 4.00 3.99 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 21 S 7.71 4.23 0.00 3.95 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 0.00 22 S 8.70 4.26 0.00 4.03 4.11 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 23 S 8.05 4.43 0.00 4.04 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 0.00 24 N 8.26 4.68 0.00 3.13 2.90 0.00 0.00 6.50 7.06 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 25 Y 8.06 4.12 0.00 3.12 3.05 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 0.00 26 C 8.31 4.16 0.00 3.18 3.13 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 0.00 27 N 8.19 4.42 0.00 2.95 2.92 0.00 0.00 7.15 6.74 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 28 L 7.90 3.96 0.00 1.54 1.59 0.89 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 29 M 7.89 3.73 0.00 0.95 1.25 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.79 0.00 30 M 8.25 4.18 0.00 1.59 1.81 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 2.41 0.00 31 C 7.60 4.16 0.00 3.08 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 32 C 8.10 3.93 0.00 2.88 3.04 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 33 R 8.33 4.19 0.00 1.98 2.02 0.00 3.58 0.00 0.00 3.22 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.85 0.00 34 K 7.69 3.87 0.00 1.92 1.89 0.00 1.67 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.38 1.59 7.81 35 M 8.37 4.69 0.00 2.01 2.08 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.41 0.00 36 T 7.68 5.09 4.42 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 1.38 0.00 0.00 37 Q 8.46 4.62 0.00 2.07 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.68 0.00 0.00 0.00 0.00 0.00 2.33 2.50 0.00 38 G 10.91 4.20 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 0.00 0.00 0.00 39 K 6.91 3.69 0.00 1.69 1.62 0.00 1.42 0.00 0.00 1.68 0.00 0.00 2.90 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.33 1.33 7.81 40 C 8.41 4.86 0.00 3.13 3.18 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 41 K 8.51 4.14 0.00 1.85 1.78 0.00 1.79 0.00 0.00 1.70 0.00 0.00 3.25 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.62 1.39 7.81 42 P 0.00 4.70 0.00 2.18 2.32 0.00 3.72 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 1.99 0.00 43 V 7.50 5.09 2.10 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 0.80 0.00 0.00 0.97 0.00 0.00 44 N 8.69 4.53 0.00 2.69 2.28 0.00 0.00 7.03 7.16 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 45 T 7.83 4.76 2.69 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 0.92 0.00 0.00 46 F 8.80 4.68 0.00 3.01 2.89 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 0.00 0.00 0.00 47 V 8.45 4.40 2.13 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 0.85 0.00 0.00 1.01 0.00 0.00 48 H 8.93 5.04 0.00 3.14 3.28 0.00 5.68 0.00 0.00 0.00 0.00 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 8.07 4.65 0.00 1.96 1.88 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 2.25 2.23 0.00 50 S 8.31 4.22 0.00 3.89 3.74 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 51 L 8.57 4.04 0.00 1.81 1.66 0.94 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 52 A 7.92 4.01 1.32 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 53 D 7.96 4.34 0.00 2.83 2.75 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 54 V 7.80 3.77 2.11 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 1.08 0.00 0.00 1.00 0.00 0.00 55 K 8.22 3.98 0.00 2.03 1.82 0.00 1.85 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.45 1.52 7.81 56 A 7.93 4.01 1.36 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 57 V 7.48 3.76 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 1.07 0.00 0.00 1.03 0.00 0.00 58 C 7.79 3.93 0.00 2.94 2.78 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 59 S 7.66 4.62 0.00 3.86 3.75 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 60 Q 7.36 4.60 0.00 2.23 1.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.89 0.00 0.00 0.00 0.00 0.00 2.31 2.44 0.00 61 K 8.69 4.24 0.00 1.91 1.84 0.00 1.61 0.00 0.00 1.55 0.00 0.00 2.76 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.42 1.39 7.81 62 K 8.67 4.23 0.00 1.74 1.58 0.00 1.77 0.00 0.00 1.63 0.00 0.00 2.87 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.15 0.86 7.81 63 V 8.24 4.52 2.01 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 0.84 0.00 0.00 64 T 8.24 4.21 4.20 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 1.20 0.00 0.00 65 C 8.62 4.73 0.00 3.09 3.14 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 66 K 8.79 3.83 0.00 1.78 1.88 0.00 1.71 0.00 0.00 1.77 0.00 0.00 3.03 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.47 1.57 7.81 67 N 8.13 4.62 0.00 2.79 2.89 0.00 0.00 6.23 7.00 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 68 G 7.94 3.94 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 0.00 0.00 0.00 69 Q 8.24 4.20 0.00 2.20 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.08 6.77 0.00 0.00 0.00 0.00 0.00 2.35 2.40 0.00 70 T 8.33 4.65 4.18 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 1.22 0.00 0.00 71 N 7.89 4.98 0.00 2.97 3.06 0.00 0.00 6.04 7.68 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 72 C 7.46 5.51 0.00 3.00 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 73 Y 8.85 5.26 0.00 2.87 2.85 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 74 Q 9.36 5.26 0.00 2.04 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.99 0.00 0.00 0.00 0.00 0.00 2.26 2.25 0.00 75 S 8.86 4.55 0.00 4.00 3.89 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 0.00 0.00 0.00 76 K 9.31 4.07 0.00 1.76 2.06 0.00 1.77 0.00 0.00 1.72 0.00 0.00 2.98 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.48 1.44 7.81 77 S 7.70 5.06 0.00 3.77 3.74 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 78 T 8.24 4.24 4.17 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 0.96 0.00 0.00 79 M 8.93 5.01 0.00 1.93 1.98 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.50 0.00 80 R 9.40 4.63 0.00 1.79 1.91 0.00 3.06 0.00 0.00 3.22 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.73 0.00 81 I 8.88 5.10 1.91 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.93 1.04 0.00 0.00 82 T 9.06 5.10 4.53 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 1.43 0.00 0.00 83 D 9.62 4.91 0.00 2.78 2.56 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 84 C 9.08 5.53 0.00 2.99 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 85 R 8.80 5.25 0.00 2.07 1.78 0.00 3.14 0.00 0.00 3.12 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.59 0.00 86 E 8.91 4.07 0.00 2.13 1.74 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 2.02 1.77 0.00 87 T 8.67 4.23 4.21 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 1.20 0.00 0.00 88 G 8.72 3.67 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 89 S 7.91 4.20 0.00 3.97 3.99 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 90 S 7.33 4.12 0.00 3.87 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 91 K 8.93 4.37 0.00 1.77 1.60 0.00 1.71 0.00 0.00 1.57 0.00 0.00 2.85 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.36 1.39 7.81 92 Y 8.78 4.36 0.00 2.95 2.91 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 93 P 0.00 3.27 0.00 1.77 1.05 0.00 3.60 0.00 0.00 3.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.69 0.00 94 N 7.97 4.67 0.00 2.92 2.76 0.00 0.00 7.02 8.50 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 95 C 8.21 4.71 0.00 3.17 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 96 A 8.87 5.05 1.11 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 0.00 0.00 97 Y 9.55 5.04 0.00 2.95 2.92 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 98 K 9.24 4.56 0.00 1.79 1.72 0.00 1.67 0.00 0.00 1.70 0.00 0.00 2.89 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.40 1.58 7.81 99 T 8.57 5.05 4.33 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 1.31 0.00 0.00 100 T 8.94 4.64 4.28 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 1.23 0.00 0.00 101 Q 8.78 4.98 0.00 1.90 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.83 6.79 0.00 0.00 0.00 0.00 0.00 2.19 2.32 0.00 102 V 8.72 4.56 2.10 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 0.96 0.00 0.00 103 E 8.66 5.30 0.00 1.80 1.86 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 2.19 2.14 0.00 104 K 8.30 4.78 0.00 1.70 1.85 0.00 1.70 0.00 0.00 1.87 0.00 0.00 2.84 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.44 1.48 7.81 105 H 9.40 4.80 0.00 3.25 3.23 0.00 5.76 0.00 0.00 0.00 0.00 6.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 I 9.02 4.91 1.76 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.22 1.14 0.00 0.00 107 I 8.13 4.94 1.82 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.58 0.81 0.00 0.00 108 V 8.63 4.70 2.16 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 0.57 0.00 0.00 0.95 0.00 0.00 109 A 8.81 5.09 1.31 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 0.00 110 C 8.91 5.41 0.00 2.96 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 0.00 111 G 9.25 3.94 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 0.00 0.00 0.00 112 G 8.99 4.07 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 0.00 0.00 0.00 113 K 8.19 4.40 0.00 1.66 1.65 0.00 1.80 0.00 0.00 1.76 0.00 0.00 2.91 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.31 1.41 7.81 114 P 0.00 4.32 0.00 2.20 2.04 0.00 3.81 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.96 0.00 115 S 8.38 4.67 0.00 3.88 3.76 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 0.00 116 V 8.55 4.63 2.08 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 0.69 0.00 0.00 0.93 0.00 0.00 117 P 0.00 4.78 0.00 1.96 2.02 0.00 3.62 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.11 0.00 118 V 8.84 4.49 2.11 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 0.74 0.00 0.00 1.04 0.00 0.00 119 H 7.88 4.64 0.00 3.22 3.10 0.00 5.85 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 F 8.75 4.57 0.00 3.03 2.83 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 0.00 121 D 8.37 4.58 0.00 2.55 2.55 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 0.00 122 A 6.54 4.67 1.18 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 0.00 123 S 8.75 5.20 0.00 4.03 4.10 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 0.00 124 V 8.84 4.14 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 0.80 0.00 0.00 0.93 0.00 0.00