NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9091 8.3393 109.7372 43.2162 0.0000 173.7893 2 S 4.3944 6.9580 113.7850 56.9758 64.9527 173.9693 3 S 4.8134 8.6358 115.9394 56.9369 67.6042 175.0698 4 G 4.2350 8.0155 109.0972 44.5578 0.0000 172.4289 5 S 4.4832 7.9208 115.7425 57.9360 66.4132 176.1184 6 S 4.5272 9.6480 119.2731 58.2119 63.6445 173.9297 7 G 4.3067 7.4922 117.2171 45.1586 0.0000 169.7541 8 Q 4.5647 8.1557 119.1534 53.9463 30.6626 176.0343 9 E 4.5070 8.5968 122.8132 54.5269 29.3691 174.8134 10 R 4.4418 7.8856 120.1724 54.0584 31.5122 174.9304 11 L 4.5653 8.0138 121.5142 53.2646 43.8013 176.4919 12 K 4.2717 8.5936 120.6824 57.7464 33.2942 176.4805 13 I 4.4482 7.5176 117.6084 59.8555 38.5045 173.7129 14 T 4.4269 8.0119 118.8872 64.2118 71.4639 174.0844 15 A 4.6416 7.5612 123.1025 52.9361 23.8932 175.8375 16 L 4.7548 7.3349 114.3444 51.7890 44.6194 174.6255 17 P 4.3540 0.0000 0.0000 62.4357 32.5756 175.3063 18 L 3.9955 8.2906 125.7469 55.5150 42.3433 175.1177 19 Y 4.8687 8.6442 121.3676 59.2553 41.0300 175.2204 20 F 5.0077 7.5225 118.9210 56.8992 43.4289 172.5258 21 E 4.3495 6.1931 118.1528 53.9560 31.8875 174.8248 22 G 4.1999 6.3450 113.3302 45.6614 0.0000 172.0020 23 F 4.6554 8.9455 121.5519 58.2624 39.5775 174.3329 24 L 4.6557 8.4955 126.0445 53.0989 45.0871 174.8173 25 L 4.8158 8.4581 124.3615 53.2628 43.7814 175.5604 26 I 4.5280 8.3151 124.6865 59.5837 39.9375 174.8389 27 K 4.0631 8.2045 125.9511 54.9200 35.6330 175.0542 28 R 4.9055 8.2721 124.4934 54.1803 35.1774 173.8771 29 S 4.0907 8.7842 116.3003 61.3594 62.2800 172.9477 30 G 4.0286 9.4275 119.6421 46.7625 0.0000 173.9436 31 Y 3.9289 8.4437 117.7983 61.1238 38.1151 176.6794 32 R 4.4892 8.6266 119.6630 55.7421 29.4978 175.8452 33 E 4.6257 7.5731 115.2386 54.4978 32.1840 174.8400 34 Y 3.9671 8.5791 120.6730 57.6170 38.5860 176.1017 35 E 4.5860 9.4595 123.9751 55.8673 31.9691 174.4851 36 H 5.1294 8.1964 121.1534 55.0867 31.4733 173.3961 37 Y 4.7763 7.7872 118.2843 56.9371 43.2575 173.8020 38 W 4.9673 9.9457 134.1690 57.9632 30.1383 174.5891 39 T 5.0203 8.2468 123.0538 62.9714 69.8472 173.3102 40 E 4.7530 10.0593 125.6078 54.4242 33.5888 174.5720 41 L 4.8780 8.6507 127.0150 54.2648 43.6505 175.5483 42 R 4.2129 7.7942 123.7983 55.8139 33.9081 176.1211 43 G 4.2873 8.5945 112.8337 46.3461 0.0000 173.8730 44 T 4.8309 8.5387 104.2220 61.7809 72.1370 174.4746 45 T 4.7192 8.8483 119.4943 62.0494 71.4488 173.0608 46 L 4.3938 8.1894 126.6123 54.2674 43.1976 175.5910 47 F 4.1234 9.1304 123.4466 55.4776 41.5276 174.5526 48 F 5.6231 8.4916 123.5406 56.4889 40.9202 174.8885 49 Y 5.5208 9.8600 120.8653 56.7995 41.7104 176.0561 50 T 4.7108 8.9936 108.4607 63.1757 70.7989 174.1601 51 D 4.7050 7.8689 119.0665 52.6786 44.7427 176.1895 52 K 3.6322 8.3725 120.9757 59.9202 32.7303 178.5694 53 K 4.0082 8.0743 117.9117 59.2375 32.1223 177.7456 54 S 4.2245 7.4163 113.2071 59.5657 63.2847 174.4046 55 I 4.1427 8.5185 124.5927 62.4964 38.1399 175.9875 56 I 4.2493 7.6339 121.4601 59.3218 37.4562 175.0949 57 Y 3.5558 8.4255 124.7197 56.7132 37.9927 176.5493 58 V 3.8142 8.5284 124.1442 65.3656 31.8137 175.7526 59 D 4.9056 8.1057 117.4128 53.3650 45.7951 175.0686 60 K 3.8568 8.4442 118.6959 55.2076 35.8547 175.5099 61 L 4.9182 7.8586 121.4151 54.1961 45.0158 174.8849 62 D 4.5220 8.2290 117.4434 53.6597 44.1800 176.7712 63 I 4.8312 7.9598 121.0508 60.6601 36.8565 177.0078 64 V 3.8410 8.2271 123.8552 64.8791 32.1656 176.0130 65 D 4.7070 7.9000 117.4247 53.3654 41.0629 175.2699 66 L 3.9795 7.8182 118.1336 56.0166 42.2122 177.0065 67 T 4.2905 9.4477 122.9378 64.4439 69.8645 174.4058 68 C 4.9434 7.0137 117.3071 59.7768 32.3031 172.1051 69 L 5.2987 8.2322 121.0950 53.8857 44.3539 175.8534 70 T 4.7579 8.5654 115.6446 60.2424 71.8875 173.0323 71 E 5.3634 8.6771 120.5016 54.7055 33.2131 175.4868 72 Q 4.4317 8.6716 121.7785 54.3523 30.3908 175.0651 73 N 4.1265 9.4620 122.2828 56.0570 38.8072 175.5947 74 S 3.4731 7.8939 116.5623 59.5093 59.5936 171.1815 75 T 4.1981 7.9398 111.9948 61.1623 67.8403 173.3151 76 E 4.7628 8.0039 131.0458 56.4558 36.3065 175.6650 77 K 4.6563 7.7637 116.5595 54.5244 35.5659 177.0527 78 N 4.6609 8.5376 120.8035 52.6135 36.7704 173.6532 79 C 4.7829 7.8159 118.7221 57.6883 32.7932 173.1232 80 A 4.5538 8.3881 123.3724 50.7961 19.5371 176.6708 81 K 4.3148 8.4721 122.2848 54.6476 35.5031 175.4976 82 F 6.0101 7.3052 119.5913 54.4514 42.0318 173.6267 83 T 4.8386 8.2239 116.1897 61.9168 71.3335 173.8952 84 L 4.4643 9.2995 126.9015 53.9915 42.4892 176.1427 85 V 4.2134 8.4230 125.6853 62.2613 32.3801 174.9964 86 L 4.9959 8.0433 124.5713 52.0546 45.4364 175.6965 87 P 4.6191 0.0000 0.0000 63.8500 31.6577 176.2144 88 K 4.4134 7.4973 115.0380 57.3905 33.2151 175.7107 89 E 4.6920 7.5144 117.1458 54.9942 32.4450 173.6431 90 E 4.8904 8.4642 123.2288 55.8241 31.2726 175.8793 91 V 4.5248 8.4328 120.8463 61.4954 35.6696 174.1993 92 Q 4.8345 9.3108 125.7627 55.1179 30.5004 174.8039 93 L 5.2754 8.3519 120.8928 53.4368 46.5711 175.2765 94 K 4.3778 8.5608 121.4837 55.7809 36.0461 175.1651 95 T 5.0196 7.7859 114.0966 60.5137 71.2707 172.5651 96 E 4.3226 8.9800 118.2370 58.8129 30.6404 176.0019 97 N 5.0901 7.6482 113.6591 50.7067 44.2557 174.9993 98 T 3.9042 8.5188 114.8470 66.1273 67.2247 174.7297 99 E 3.9533 8.4684 119.5013 59.4639 29.3975 178.9469 100 S 4.6593 8.3167 114.1325 62.8524 63.2160 176.5377 101 G 4.0735 8.3609 106.7433 48.6833 0.0000 174.8410 102 E 4.0445 9.0107 120.3378 59.1239 29.6582 179.6668 103 E 3.5656 8.2649 118.3035 59.2882 29.1884 178.9209 104 W 4.6202 9.1608 119.0734 59.9327 29.2379 178.3407 105 R 3.6042 8.9626 118.6455 59.6384 29.6083 178.5347 106 G 3.4846 8.2951 105.1562 47.9748 0.0000 175.1967 107 F 4.2331 8.4256 120.8298 60.2935 39.1394 177.8070 108 I 3.9502 9.1097 119.9074 64.5489 36.9631 178.3154 109 L 4.5014 8.4199 121.3797 57.5262 41.2406 179.9890 110 T 4.7449 7.7989 116.8611 65.3109 68.3069 176.1770 111 V 4.3857 7.8466 113.1524 61.3881 33.0550 176.8915 112 T 4.5901 7.5338 107.6656 63.4563 72.1151 175.2388 113 E 4.1548 8.4511 120.7745 55.7726 29.8675 177.4494 114 L 4.5212 7.5719 115.4701 54.9918 40.3117 174.3617 115 S 4.3579 7.3434 114.5343 57.2592 64.3546 172.0873 116 V 4.5638 8.0744 117.5834 60.3349 34.0283 174.1412 117 P 4.3611 0.0000 0.0000 62.9219 31.7476 176.0087 118 Q 4.3611 8.6035 120.4545 55.8707 29.7332 175.7227 119 N 4.9184 7.7321 115.8015 52.7593 38.2327 172.5808 120 V 5.2493 7.0925 110.1535 58.9963 35.6071 175.7672 121 S 4.5538 8.6384 112.0106 57.9352 63.3249 173.9373 122 L 4.0893 7.7197 118.6535 55.8278 41.8464 174.8478 123 L 4.7621 7.8736 118.8679 52.5003 44.2737 175.4876 124 P 4.2700 0.0000 0.0000 65.2941 31.5468 178.3341 125 G 3.6221 7.9443 106.7668 47.1498 0.0000 175.1089 126 Q 4.1549 7.7673 118.6008 57.8922 29.4363 177.6820 127 V 3.3864 7.8799 119.6007 66.1150 31.3764 177.8316 128 I 3.6635 7.1128 118.9637 64.5824 36.4740 177.7964 129 K 4.0337 7.7400 118.4898 59.8529 31.9433 178.8515 130 L 4.0548 7.5622 118.6341 58.2956 41.5002 179.5305 131 H 4.0687 7.9129 115.0965 58.9128 28.7884 177.3797 132 E 3.9113 8.8721 121.1245 59.5398 29.3118 179.3103 133 V 2.9848 8.8701 118.6341 66.5882 31.3799 177.1063 134 L 3.8155 8.0481 119.5999 57.9087 41.6515 178.3560 135 E 4.0172 8.7148 118.4386 59.7590 29.4113 180.1749 136 R 3.9812 8.0842 117.7421 59.3390 30.5878 178.7241 137 E 4.2291 8.2869 117.2666 58.8355 29.5819 178.9351 138 K 3.8347 8.4949 120.2583 59.6264 32.1761 178.7720 139 K 3.8344 7.7454 118.4559 59.8521 31.5475 178.8192 140 R 3.8916 7.7622 118.0409 59.9265 29.6273 178.2631 141 R 3.7408 8.1033 116.8786 60.0395 30.1262 177.2667 142 I 3.2886 8.1804 115.4685 64.5169 37.7510 176.3792 143 E 4.4615 7.4706 126.0114 55.1152 28.6167 174.7807 144 S 4.4396 8.1030 113.8637 59.4745 64.7621 174.6135 145 G 3.9320 8.1134 107.3538 44.6827 0.0000 171.0412 146 P 4.2912 0.0000 0.0000 61.8778 30.9350 176.9870 147 S 4.1443 8.4941 119.3327 58.4249 61.8118 173.6208 148 S 3.9054 8.6601 125.5232 58.0001 62.2432 172.4203 149 G 3.7268 8.2324 108.7935 46.0643 0.0000 172.6417 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 G 8.34 3.91 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 0.00 0.00 0.00 2 S 6.96 4.39 0.00 4.01 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 3 S 8.64 4.81 0.00 3.82 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 4 G 8.02 4.24 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 0.00 5 S 7.92 4.48 0.00 3.80 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 6 S 9.65 4.53 0.00 3.80 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 7 G 7.49 4.31 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 0.00 8 Q 8.16 4.56 0.00 2.01 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 7.02 0.00 0.00 0.00 0.00 0.00 2.24 2.33 0.00 9 E 8.60 4.51 0.00 1.90 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 2.20 2.28 0.00 10 R 7.89 4.44 0.00 1.71 1.80 0.00 3.33 0.00 0.00 3.19 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.54 0.00 11 L 8.01 4.57 0.00 1.58 1.56 0.91 0.90 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 12 K 8.59 4.27 0.00 1.69 1.79 0.00 1.73 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.33 1.42 7.81 13 I 7.52 4.45 1.86 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.74 0.90 0.00 0.00 14 T 8.01 4.43 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 1.18 0.00 0.00 15 A 7.56 4.64 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 16 L 7.33 4.75 0.00 1.41 1.43 1.00 1.06 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 17 P 0.00 4.35 0.00 2.13 2.18 0.00 3.54 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.00 0.00 18 L 8.29 4.00 0.00 1.53 1.52 0.96 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 19 Y 8.64 4.87 0.00 2.72 2.40 0.00 0.00 0.00 0.00 0.00 0.00 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 F 7.52 5.01 0.00 1.51 1.76 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 21 E 6.19 4.35 0.00 1.63 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 2.01 2.54 0.00 22 G 6.34 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 23 F 8.95 4.66 0.00 3.28 3.08 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 0.00 0.00 0.00 0.00 24 L 8.50 4.66 0.00 1.30 1.12 0.28 -0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 25 L 8.46 4.82 0.00 1.56 1.55 0.77 1.19 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 26 I 8.32 4.53 1.57 0.00 0.00 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 -0.36 0.42 0.00 0.00 27 K 8.20 4.06 0.00 0.79 0.74 0.00 1.05 0.00 0.00 0.61 0.00 0.00 2.35 0.00 0.00 2.70 0.00 0.00 0.00 0.00 0.96 0.95 7.81 28 R 8.27 4.91 0.00 2.10 1.83 0.00 3.30 0.00 0.00 3.30 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.47 0.00 29 S 8.78 4.09 0.00 3.83 3.86 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 0.00 0.00 0.00 30 G 9.43 4.03 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 0.00 31 Y 8.44 3.93 0.00 3.03 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 32 R 8.63 4.49 0.00 1.92 2.21 0.00 3.22 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 1.47 1.68 0.00 33 E 7.57 4.63 0.00 1.98 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 2.24 2.31 0.00 34 Y 8.58 3.97 0.00 2.91 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 35 E 9.46 4.59 0.00 2.37 2.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 2.27 0.00 36 H 8.20 5.13 0.00 3.05 3.01 0.00 5.76 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 Y 7.79 4.78 0.00 2.90 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 38 W 9.95 4.97 0.00 3.55 3.30 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 0.00 39 T 8.25 5.02 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 1.32 0.00 0.00 40 E 10.06 4.75 0.00 2.09 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 2.39 0.00 41 L 8.65 4.88 0.00 1.75 1.47 0.93 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 42 R 7.79 4.21 0.00 1.83 1.54 0.00 2.74 0.00 0.00 3.19 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.27 0.00 43 G 8.59 4.29 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 0.00 44 T 8.54 4.83 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 1.32 0.00 0.00 45 T 8.85 4.72 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.26 0.00 0.00 46 L 8.19 4.39 0.00 1.38 1.39 1.03 1.35 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 47 F 9.13 4.12 0.00 3.06 2.68 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 48 F 8.49 5.62 0.00 2.88 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 49 Y 9.86 5.52 0.00 3.55 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 50 T 8.99 4.71 4.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 51 D 7.87 4.71 0.00 2.74 2.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 K 8.37 3.63 0.00 1.57 1.40 0.00 1.23 0.00 0.00 1.52 0.00 0.00 2.67 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.24 1.31 7.81 53 K 8.07 4.01 0.00 1.74 1.91 0.00 1.62 0.00 0.00 1.68 0.00 0.00 3.02 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.42 1.48 7.81 54 S 7.42 4.22 0.00 4.27 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 I 8.52 4.14 1.92 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 1.42 0.65 0.94 0.00 0.00 56 I 7.63 4.25 1.82 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.76 0.55 0.00 0.00 57 Y 8.43 3.56 0.00 2.74 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 58 V 8.53 3.81 2.25 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 0.63 0.00 0.00 1.02 0.00 0.00 59 D 8.11 4.91 0.00 2.68 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 60 K 8.44 3.86 0.00 0.79 0.74 0.00 0.61 0.00 0.00 0.86 0.00 0.00 2.58 0.00 0.00 2.77 0.00 0.00 0.00 0.00 0.98 0.95 7.81 61 L 7.86 4.92 0.00 1.20 1.53 1.09 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 62 D 8.23 4.52 0.00 2.53 2.43 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 63 I 7.96 4.83 1.90 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 1.33 0.90 0.94 0.00 0.00 64 V 8.23 3.84 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 0.77 0.00 0.00 0.94 0.00 0.00 65 D 7.90 4.71 0.00 2.65 2.67 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 66 L 7.82 3.98 0.00 1.78 1.61 0.93 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 67 T 9.45 4.29 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 1.22 0.00 0.00 68 C 7.01 4.94 0.00 2.94 2.90 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.23 5.30 0.00 1.53 1.43 0.42 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 70 T 8.57 4.76 4.29 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 1.24 0.00 0.00 71 E 8.68 5.36 0.00 1.88 1.91 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 2.36 2.39 0.00 72 Q 8.67 4.43 0.00 1.90 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.70 6.91 0.00 0.00 0.00 0.00 0.00 2.30 2.36 0.00 73 N 9.46 4.13 0.00 2.70 2.89 0.00 0.00 7.34 7.58 0.00 0.00 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 S 7.89 3.47 0.00 4.10 3.86 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 0.00 0.00 0.00 75 T 7.94 4.20 4.24 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 1.22 0.00 0.00 76 E 8.00 4.76 0.00 1.88 1.91 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 2.11 2.24 0.00 77 K 7.76 4.66 0.00 1.68 1.62 0.00 1.68 0.00 0.00 1.69 0.00 0.00 2.88 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.31 1.47 7.81 78 N 8.54 4.66 0.00 2.72 2.79 0.00 0.00 6.77 7.67 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 79 C 7.82 4.78 0.00 2.84 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 A 8.39 4.55 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 81 K 8.47 4.31 0.00 1.60 1.63 0.00 1.56 0.00 0.00 1.79 0.00 0.00 2.67 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.19 1.18 7.81 82 F 7.31 6.01 0.00 3.12 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 83 T 8.22 4.84 4.31 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 1.26 0.00 0.00 84 L 9.30 4.46 0.00 1.58 1.67 0.95 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 85 V 8.42 4.21 2.22 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 1.04 0.00 0.00 1.03 0.00 0.00 86 L 8.04 5.00 0.00 1.75 1.50 0.95 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 87 P 0.00 4.62 0.00 2.18 2.16 0.00 3.71 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.08 0.00 88 K 7.50 4.41 0.00 1.78 1.85 0.00 1.73 0.00 0.00 1.63 0.00 0.00 2.92 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.36 1.32 7.81 89 E 7.51 4.69 0.00 1.96 1.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.33 0.00 90 E 8.46 4.89 0.00 1.90 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 2.29 2.31 0.00 91 V 8.43 4.52 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 0.96 0.00 0.00 92 Q 9.31 4.83 0.00 1.85 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.47 0.00 0.00 0.00 0.00 0.00 2.31 2.27 0.00 93 L 8.35 5.28 0.00 1.72 1.46 0.97 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 94 K 8.56 4.38 0.00 0.84 0.74 0.00 1.19 0.00 0.00 1.41 0.00 0.00 2.13 0.00 0.00 2.52 0.00 0.00 0.00 0.00 0.94 0.91 7.81 95 T 7.79 5.02 4.39 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 0.00 0.00 0.00 1.34 0.00 0.00 96 E 8.98 4.32 0.00 2.09 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 0.00 2.31 2.45 0.00 97 N 7.65 5.09 0.00 2.74 2.71 0.00 0.00 6.82 7.10 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 98 T 8.52 3.90 4.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 99 E 8.47 3.95 0.00 2.10 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 2.45 2.41 0.00 100 S 8.32 4.66 0.00 4.22 4.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 G 8.36 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 0.00 102 E 9.01 4.04 0.00 2.17 2.03 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 2.38 2.55 0.00 103 E 8.26 3.57 0.00 2.19 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 1.60 2.07 0.00 104 W 9.16 4.62 0.00 3.78 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 R 8.96 3.60 0.00 2.06 1.90 0.00 3.09 0.00 0.00 3.26 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.77 0.00 106 G 8.30 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.43 4.23 0.00 3.10 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 0.00 108 I 9.11 3.95 2.11 0.00 0.00 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 1.69 0.82 0.91 0.00 0.00 109 L 8.42 4.50 0.00 1.78 1.70 0.85 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 110 T 7.80 4.74 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 1.17 0.00 0.00 111 V 7.85 4.39 2.36 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 0.83 0.00 0.00 1.14 0.00 0.00 112 T 7.53 4.59 4.24 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 1.35 0.00 0.00 113 E 8.45 4.15 0.00 2.12 2.00 0.00 0.00 0.00 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 2.40 0.00 114 L 7.57 4.52 0.00 1.84 1.76 0.96 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 115 S 7.34 4.36 0.00 3.88 3.60 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 0.00 116 V 8.07 4.56 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 0.79 0.00 0.00 0.69 0.00 0.00 117 P 0.00 4.36 0.00 2.15 1.99 0.00 3.67 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.90 0.00 118 Q 8.60 4.36 0.00 2.02 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 7.48 0.00 0.00 0.00 0.00 0.00 2.25 2.28 0.00 119 N 7.73 4.92 0.00 2.66 2.75 0.00 0.00 6.78 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 V 7.09 5.25 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 0.68 0.00 0.00 0.92 0.00 0.00 121 S 8.64 4.55 0.00 3.77 3.79 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 0.00 0.00 0.00 0.00 122 L 7.72 4.09 0.00 1.53 1.52 0.88 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 123 L 7.87 4.76 0.00 1.64 1.56 0.91 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 124 P 0.00 4.27 0.00 2.19 2.28 0.00 3.66 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 2.05 1.94 0.00 125 G 7.94 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 Q 7.77 4.15 0.00 1.93 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.01 7.07 0.00 0.00 0.00 0.00 0.00 2.33 2.27 0.00 127 V 7.88 3.39 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 0.94 0.00 0.00 0.84 0.00 0.00 128 I 7.11 3.66 1.85 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.85 0.94 0.00 0.00 129 K 7.74 4.03 0.00 1.73 2.24 0.00 1.81 0.00 0.00 1.72 0.00 0.00 3.30 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.47 1.73 7.81 130 L 7.56 4.05 0.00 1.60 1.54 0.66 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 131 H 7.91 4.07 0.00 3.31 3.29 0.00 5.63 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 0.00 132 E 8.87 3.91 0.00 2.10 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 0.00 2.34 2.49 0.00 133 V 8.87 2.98 2.05 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 0.07 0.00 0.00 0.95 0.00 0.00 134 L 8.05 3.82 0.00 1.78 1.81 0.92 0.84 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 0.00 135 E 8.71 4.02 0.00 2.15 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 2.34 2.63 0.00 136 R 8.08 3.98 0.00 1.79 2.20 0.00 3.63 0.00 0.00 3.40 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.94 0.00 137 E 8.29 4.23 0.00 2.25 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.43 0.00 138 K 8.49 3.83 0.00 1.89 1.92 0.00 1.75 0.00 0.00 1.64 0.00 0.00 2.92 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.46 1.61 7.81 139 K 7.75 3.83 0.00 1.97 1.91 0.00 1.63 0.00 0.00 1.68 0.00 0.00 3.02 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.49 1.54 7.81 140 R 7.76 3.89 0.00 1.99 2.02 0.00 3.19 0.00 0.00 3.21 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.74 0.00 141 R 8.10 3.74 0.00 1.92 2.02 0.00 3.43 0.00 0.00 3.24 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.85 0.00 142 I 8.18 3.29 1.97 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.58 0.92 0.00 0.00 143 E 7.47 4.46 0.00 1.80 1.91 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 2.28 2.23 0.00 144 S 8.10 4.44 0.00 3.98 3.82 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 0.00 145 G 8.11 3.93 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 0.00 0.00 0.00 146 P 0.00 4.29 0.00 2.19 2.11 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 1.99 1.95 0.00 147 S 8.49 4.14 0.00 4.00 3.97 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 0.00 148 S 8.66 3.91 0.00 4.05 3.93 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 0.00 149 G 8.23 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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