NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 R 4.2242 8.2549 119.6875 56.5884 31.3744 175.5169 3 H 4.6248 8.4954 116.5809 54.6167 30.1690 171.4604 4 L 5.7673 9.1729 135.0000 55.6919 44.7026 174.1730 5 K 3.9068 8.0516 115.7553 56.4279 32.1760 176.0726 6 S 4.6487 7.6670 111.7961 56.4671 66.0233 173.4870 7 G 3.7808 8.3332 109.6376 44.8413 0.0000 173.4764 8 R 4.0202 8.3824 119.4775 55.4783 30.5160 176.4765 9 K 3.9663 8.2949 118.4597 57.6344 32.6546 176.7375 10 L 4.1477 7.7936 113.7670 54.5544 43.7451 174.0030 11 N 4.5375 8.5745 124.6242 53.5416 41.0922 174.7511 12 R 3.5782 12.0000 118.1298 56.3728 29.8252 174.6683 13 H 4.8928 7.6048 112.4693 53.9589 30.9300 175.4279 14 S 3.9523 8.2098 112.9094 61.8736 63.4875 177.0144 15 S 4.0715 8.3271 116.6787 60.7685 62.7307 175.5960 16 H 4.1634 8.0342 121.8018 58.7240 29.6464 176.5622 17 R 3.7340 7.9593 120.7292 59.4069 29.7594 178.0901 18 L 3.5997 7.6867 119.1612 58.0371 42.2763 178.3777 19 A 3.9400 8.5498 121.9947 56.1262 18.2451 178.4531 20 L 3.7554 8.8958 118.8513 57.9894 41.6038 178.4285 21 Y 4.2263 7.3216 118.7222 62.0111 38.3695 178.8116 22 R 4.0550 8.0636 118.3048 59.1044 30.1217 178.6599 23 N 4.1537 8.3799 115.1335 56.9734 38.7767 177.5150 24 Q 4.0533 8.3167 119.0335 58.6536 28.6937 178.6869 25 A 4.0498 8.3388 122.0609 55.1293 18.4611 179.4058 26 K 3.8803 8.2625 116.6938 60.1460 32.1454 179.2971 27 S 4.0847 8.1587 114.7814 61.5798 62.7984 176.6268 28 L 4.0299 8.3613 123.4293 58.0407 41.5893 179.0606 29 L 4.0301 8.4946 118.5751 58.0269 41.6727 179.1251 30 T 4.0222 8.0117 114.8317 66.4689 68.7791 175.4733 31 H 4.9003 8.2327 115.1178 54.6775 29.4915 177.2631 32 G 4.3812 8.5240 112.8334 46.3753 0.0000 174.0848 33 R 5.2231 8.4158 117.0540 54.4462 33.7214 174.8771 34 I 4.7666 8.6219 121.7735 59.8832 42.4549 173.5829 35 T 5.1926 8.4615 121.7846 62.2895 71.3795 173.3486 36 T 4.7268 8.5641 116.8303 60.7401 72.5494 173.3009 37 T 4.5902 8.4256 109.7800 60.9682 70.0238 175.2184 38 V 3.5517 8.6088 123.3330 66.0537 31.5238 176.2158 39 P 4.2374 0.0000 0.0000 66.0432 30.9849 178.5974 40 K 4.0301 7.9921 115.3314 59.8276 32.2369 178.7936 41 A 4.1100 8.6260 121.8095 54.3508 18.1279 179.6985 42 K 4.0233 8.4001 117.2835 59.5188 32.2851 178.6356 43 E 3.9505 8.1799 119.3301 59.0738 29.6000 178.3626 44 L 3.8186 8.2741 121.0339 58.0805 41.9954 178.7330 45 R 3.9550 8.1060 115.6271 59.7405 28.9522 178.6748 46 G 3.7504 8.0554 106.6119 47.1150 0.0000 174.9366 47 F 4.1476 7.7400 122.2685 60.2280 39.2501 177.2165 48 V 3.6966 7.8629 117.7171 64.9908 31.7063 177.2391 49 D 4.5693 8.4250 119.3182 57.9392 40.6629 178.6622 50 H 4.1310 7.9244 118.1398 59.3813 29.6231 177.0659 51 L 3.7914 6.9121 118.7701 58.2435 41.6761 178.9951 52 I 3.4652 7.9735 119.6168 64.5580 36.9353 177.4394 53 H 3.7528 8.7049 118.7329 59.6905 29.8353 177.2625 54 L 3.8862 8.1322 120.4702 57.8089 41.2817 179.2781 55 A 2.6765 7.6195 118.9660 53.3091 18.1254 179.2735 56 K 3.7970 7.1946 118.1553 58.7145 32.6561 177.7140 57 R 4.0979 6.7445 115.8649 56.3273 30.4741 176.7487 58 G 4.1753 8.4188 107.9242 45.4907 0.0000 173.8622 59 D 4.4011 8.1786 120.4044 53.5366 39.7474 177.0281 60 L 3.7875 8.8344 124.5453 58.8391 41.7394 178.2383 61 H 4.0885 8.5184 117.1267 59.4534 29.6018 176.5634 62 A 3.9845 8.3421 122.2032 56.1348 18.2602 178.6906 63 R 3.4652 8.2211 115.8174 60.0342 29.5670 178.1792 64 R 3.9244 8.3680 120.6993 59.5835 30.7016 178.2821 65 L 3.9339 8.3183 120.3862 58.4186 42.0347 179.0438 66 V 3.7809 8.3825 118.1333 66.1463 31.3014 178.0862 67 L 4.2682 8.0679 117.7036 57.0141 41.4163 179.1434 68 R 4.1341 8.1728 118.5490 59.0325 30.1253 176.7187 69 D 4.4759 8.1718 117.6126 55.1058 40.8373 176.8046 70 L 4.1057 8.2319 122.2504 56.0139 42.8798 177.1116 71 Q 4.3978 8.4773 120.4130 56.1044 31.1518 175.4884 72 D 4.5243 7.9502 117.4218 53.4659 41.8022 176.1475 73 V 3.5263 8.4352 127.4360 66.6062 31.5965 176.8152 74 K 3.7011 8.4289 118.0001 59.5143 31.7390 177.6407 75 L 3.8661 8.8795 119.9808 58.4883 42.0691 179.4803 76 V 3.6866 8.4380 117.9812 66.9366 31.3414 177.4033 77 R 4.0632 8.5331 116.6762 59.5002 29.8217 178.4085 78 K 3.9219 8.3458 118.4314 59.7716 32.4292 178.4727 79 L 3.9425 8.3332 120.5855 58.3096 41.8255 179.0214 80 F 3.7532 9.0792 117.1553 60.6355 39.0276 177.3090 81 D 4.5160 8.6935 117.3453 57.5103 40.9623 178.4374 82 E 4.1602 7.9835 117.0675 59.2768 30.1950 178.6618 83 I 3.8817 8.2728 120.1433 63.3733 37.3299 177.8361 84 A 3.8688 8.3723 121.7172 54.9834 18.0504 177.6249 85 P 4.0921 0.0000 0.0000 65.9011 31.4899 178.0343 86 R 3.8722 7.2108 115.2207 58.8293 31.6100 176.9685 87 Y 4.5130 7.6544 111.1377 57.0977 36.5027 176.8756 88 R 4.1126 9.4434 131.6034 58.5466 30.0937 175.4420 89 D 4.6798 7.9701 113.0844 54.1995 41.4336 175.7338 90 R 4.5051 7.8292 120.2560 54.6265 31.3545 175.8280 91 Q 4.2014 8.6586 127.2170 55.2067 27.7591 174.8830 92 G 3.1874 9.1031 115.6205 44.9257 0.0000 170.6762 93 G 3.5152 7.2544 103.1351 46.5944 0.0000 173.4096 94 Y 4.1345 6.1329 112.6255 57.4618 38.0147 176.0529 95 T 4.8472 7.1127 110.0421 62.1553 70.6280 172.2090 96 R 4.7287 9.1730 128.9522 54.4300 33.8765 174.0082 97 V 4.9871 8.3991 123.9974 61.1378 34.0741 174.4204 98 L 4.8218 8.6454 127.5711 52.5203 44.9748 176.1464 99 K 4.3341 8.7806 123.9569 56.4918 32.6206 176.4441 100 L 4.5368 8.2882 125.4118 53.3953 42.6050 177.0419 101 A 4.0632 8.4387 126.3556 53.1027 19.1688 175.9192 102 E 4.1069 8.9555 120.7076 57.0149 28.9380 174.8873 103 R 4.7655 8.0074 120.9491 53.8234 32.9747 176.1568 104 R 3.8980 8.1640 118.5345 57.2250 30.8115 178.1930 105 R 4.6857 8.4492 124.8731 53.8337 28.5517 175.8872 106 G 4.0730 6.8554 105.3727 45.6785 0.0000 171.5368 107 D 4.7362 8.6118 122.0988 52.6740 40.3706 176.9645 108 G 3.7975 8.7111 106.1502 46.1776 0.0000 173.8797 109 A 4.1551 8.1837 122.9131 51.2516 18.9038 176.0150 110 P 4.5438 0.0000 0.0000 63.3614 32.9989 175.6205 111 L 4.9623 8.1673 120.7685 53.4155 45.9164 174.6032 112 A 4.9112 8.4764 118.3498 51.1533 23.1764 175.9056 113 L 4.5743 8.8391 122.3473 54.6732 43.3879 176.4974 114 V 5.3749 9.2124 124.5835 60.4496 32.8711 173.9874 115 E 4.6038 8.4526 128.4916 55.4287 31.1584 176.3550 116 L 4.0894 8.7091 127.6425 58.6736 42.9366 175.3631 117 V 3.9394 7.4400 115.9435 60.3416 31.3386 169.7460 118 E 4.2990 8.6560 125.4303 56.1934 29.8487 174.8425 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 2 R 8.25 4.22 0.00 1.78 1.91 0.00 3.15 0.00 0.00 3.21 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.69 0.00 3 H 8.50 4.62 0.00 3.16 3.17 0.00 5.84 0.00 0.00 0.00 0.00 6.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 L 9.17 5.77 0.00 1.68 1.70 0.97 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 5 K 8.05 3.91 0.00 1.77 1.85 0.00 1.68 0.00 0.00 1.77 0.00 0.00 3.07 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.46 1.53 7.81 6 S 7.67 4.65 0.00 3.92 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 7 G 8.33 3.78 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 0.00 0.00 0.00 8 R 8.38 4.02 0.00 1.82 2.14 0.00 3.40 0.00 0.00 3.28 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.58 0.00 9 K 8.29 3.97 0.00 1.88 1.87 0.00 1.63 0.00 0.00 1.72 0.00 0.00 3.00 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.52 1.54 7.81 10 L 7.79 4.15 0.00 1.59 1.60 0.94 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 11 N 8.57 4.54 0.00 2.65 2.69 0.00 0.00 7.29 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 R 12.00 3.58 0.00 1.75 1.61 0.00 2.95 0.00 0.00 2.96 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 1.26 0.00 13 H 7.60 4.89 0.00 3.31 3.42 0.00 5.69 0.00 0.00 0.00 0.00 6.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 S 8.21 3.95 0.00 4.04 4.14 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 15 S 8.33 4.07 0.00 4.09 4.19 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 16 H 8.03 4.16 0.00 2.82 3.06 0.00 5.70 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 R 7.96 3.73 0.00 1.85 1.88 0.00 3.10 0.00 0.00 3.04 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 1.03 0.00 18 L 7.69 3.60 0.00 1.71 1.88 0.99 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 19 A 8.55 3.94 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 L 8.90 3.76 0.00 1.55 1.41 0.90 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 21 Y 7.32 4.23 0.00 2.07 1.53 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 0.00 22 R 8.06 4.05 0.00 2.04 2.01 0.00 3.22 0.00 0.00 3.25 7.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.93 0.00 23 N 8.38 4.15 0.00 2.91 2.90 0.00 0.00 7.20 7.29 0.00 0.00 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 Q 8.32 4.05 0.00 2.26 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.82 0.00 0.00 0.00 0.00 0.00 2.40 2.41 0.00 25 A 8.34 4.05 1.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.26 3.88 0.00 2.02 1.93 0.00 1.71 0.00 0.00 1.84 0.00 0.00 3.03 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.59 1.64 7.81 27 S 8.16 4.08 0.00 4.04 3.96 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 28 L 8.36 4.03 0.00 1.92 1.71 0.97 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 29 L 8.49 4.03 0.00 1.79 1.74 0.96 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 30 T 8.01 4.02 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 0.94 0.00 0.00 31 H 8.23 4.90 0.00 3.30 3.27 0.00 5.75 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 G 8.52 4.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.42 5.22 0.00 1.62 1.81 0.00 3.15 0.00 0.00 3.48 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.57 0.00 34 I 8.62 4.77 1.92 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 1.31 0.94 0.00 0.00 35 T 8.46 5.19 4.25 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 36 T 8.56 4.73 4.26 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 1.26 0.00 0.00 37 T 8.43 4.59 4.25 0.00 0.00 0.00 0.00 0.00 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 38 V 8.61 3.55 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 1.15 0.00 0.00 1.00 0.00 0.00 39 P 0.00 4.24 0.00 2.20 2.12 0.00 3.58 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.21 0.00 40 K 7.99 4.03 0.00 1.88 1.91 0.00 1.72 0.00 0.00 1.71 0.00 0.00 3.08 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.53 1.48 7.81 41 A 8.63 4.11 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 42 K 8.40 4.02 0.00 1.90 1.90 0.00 1.70 0.00 0.00 1.62 0.00 0.00 2.96 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.48 1.64 7.81 43 E 8.18 3.95 0.00 2.23 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 1.76 0.00 44 L 8.27 3.82 0.00 1.94 1.66 1.01 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 45 R 8.11 3.95 0.00 2.04 2.17 0.00 3.00 0.00 0.00 3.30 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.86 0.00 46 G 8.06 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 0.00 0.00 0.00 47 F 7.74 4.15 0.00 2.80 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 V 7.86 3.70 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 1.14 0.00 0.00 49 D 8.42 4.57 0.00 3.00 2.76 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 50 H 7.92 4.13 0.00 3.08 3.30 0.00 5.79 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 L 6.91 3.79 0.00 1.59 1.66 0.93 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 52 I 7.97 3.47 1.73 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 1.62 0.83 0.14 0.00 0.00 53 H 8.70 3.75 0.00 3.39 3.41 0.00 5.59 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 L 8.13 3.89 0.00 1.76 1.64 0.88 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 55 A 7.62 2.68 0.21 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 0.00 0.00 56 K 7.19 3.80 0.00 1.44 1.67 0.00 1.65 0.00 0.00 1.32 0.00 0.00 2.84 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.30 1.39 7.81 57 R 6.74 4.10 0.00 2.16 1.94 0.00 3.20 0.00 0.00 3.26 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.70 0.00 58 G 8.42 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 0.00 0.00 0.00 0.00 59 D 8.18 4.40 0.00 2.91 2.88 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 0.00 0.00 0.00 60 L 8.83 3.79 0.00 1.67 1.73 0.89 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 61 H 8.52 4.09 0.00 3.24 3.60 0.00 5.78 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 A 8.34 3.98 1.68 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 0.00 0.00 0.00 0.00 0.00 0.00 63 R 8.22 3.47 0.00 1.45 1.86 0.00 2.91 0.00 0.00 3.12 8.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.09 0.00 64 R 8.37 3.92 0.00 1.81 1.99 0.00 3.26 0.00 0.00 3.16 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.87 0.00 65 L 8.32 3.93 0.00 1.88 1.62 0.85 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 66 V 8.38 3.78 2.39 0.00 0.00 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 1.01 0.00 0.00 67 L 8.07 4.27 0.00 1.71 1.72 0.92 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 68 R 8.17 4.13 0.00 1.92 2.03 0.00 3.17 0.00 0.00 3.25 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.84 0.00 69 D 8.17 4.48 0.00 2.73 2.74 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 70 L 8.23 4.11 0.00 1.68 1.69 0.98 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 71 Q 8.48 4.40 0.00 1.98 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 7.06 0.00 0.00 0.00 0.00 0.00 2.24 2.37 0.00 72 D 7.95 4.52 0.00 2.80 2.57 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 0.00 0.00 0.00 0.00 73 V 8.44 3.53 2.07 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 0.90 0.00 0.00 0.92 0.00 0.00 74 K 8.43 3.70 0.00 2.06 1.91 0.00 1.70 0.00 0.00 1.74 0.00 0.00 3.00 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.52 1.59 7.81 75 L 8.88 3.87 0.00 1.93 1.90 0.96 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 76 V 8.44 3.69 2.26 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 0.92 0.00 0.00 1.00 0.00 0.00 77 R 8.53 4.06 0.00 2.08 1.94 0.00 3.22 0.00 0.00 3.08 7.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.65 0.00 78 K 8.35 3.92 0.00 1.87 2.07 0.00 1.65 0.00 0.00 1.59 0.00 0.00 2.95 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.47 1.51 7.81 79 L 8.33 3.94 0.00 1.93 2.00 0.89 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 80 F 9.08 3.75 0.00 3.02 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 81 D 8.69 4.52 0.00 2.64 2.74 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 82 E 7.98 4.16 0.00 2.11 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.39 0.00 83 I 8.27 3.88 1.99 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.45 1.00 0.00 0.00 84 A 8.37 3.87 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 85 P 0.00 4.09 0.00 1.95 2.09 0.00 3.62 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.09 0.00 86 R 7.21 3.87 0.00 1.08 1.32 0.00 3.01 0.00 0.00 2.99 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.42 0.00 87 Y 7.65 4.51 0.00 2.84 2.26 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 88 R 9.44 4.11 0.00 1.89 2.14 0.00 3.39 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 1.49 1.55 0.00 89 D 7.97 4.68 0.00 2.73 2.71 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 90 R 7.83 4.51 0.00 1.98 2.19 0.00 3.34 0.00 0.00 3.12 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.66 0.00 91 Q 8.66 4.20 0.00 2.08 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.91 0.00 0.00 0.00 0.00 0.00 2.29 2.38 0.00 92 G 9.10 3.19 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 0.00 93 G 7.25 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 Y 6.13 4.13 0.00 2.54 1.43 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.11 4.85 4.30 0.00 0.00 0.00 0.00 0.00 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 96 R 9.17 4.73 0.00 1.85 1.71 0.00 3.09 0.00 0.00 3.10 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.53 0.00 97 V 8.40 4.99 2.07 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 0.88 0.00 0.00 0.92 0.00 0.00 98 L 8.65 4.82 0.00 1.61 1.51 0.93 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 99 K 8.78 4.33 0.00 1.64 1.76 0.00 1.74 0.00 0.00 1.70 0.00 0.00 2.84 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.44 1.47 7.81 100 L 8.29 4.54 0.00 1.60 1.60 0.96 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 101 A 8.44 4.06 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 E 8.96 4.11 0.00 2.10 2.21 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 2.17 2.29 0.00 103 R 8.01 4.77 0.00 1.77 2.00 0.00 3.70 0.00 0.00 3.22 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.56 0.00 104 R 8.16 3.90 0.00 2.11 1.89 0.00 3.17 0.00 0.00 3.17 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.66 0.00 105 R 8.45 4.69 0.00 1.80 1.90 0.00 3.24 0.00 0.00 3.23 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.62 0.00 106 G 6.86 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 0.00 107 D 8.61 4.74 0.00 2.77 2.71 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 0.00 108 G 8.71 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 0.00 109 A 8.18 4.16 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 P 0.00 4.54 0.00 2.13 2.19 0.00 3.65 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.01 0.00 111 L 8.17 4.96 0.00 1.59 1.61 0.92 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 112 A 8.48 4.91 1.20 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 0.00 113 L 8.84 4.57 0.00 1.85 1.61 0.93 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 114 V 9.21 5.37 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 0.98 0.00 0.00 0.94 0.00 0.00 115 E 8.45 4.60 0.00 2.11 1.81 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 2.38 2.33 0.00 116 L 8.71 4.09 0.00 2.07 1.77 1.04 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 117 V 7.44 3.94 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 0.99 0.00 0.00 118 E 8.66 4.30 0.00 1.89 1.81 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 2.16 2.33 0.00