NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.2881 8.3044 120.3479 55.2527 33.3004 175.1155 2 L 4.1170 8.0818 122.6921 52.7725 40.7692 174.1289 3 T 3.8866 8.6203 120.2475 64.2485 68.5621 173.8403 4 D 4.6103 7.6590 121.7035 50.7521 42.8218 173.2719 5 P 4.2171 0.0000 0.0000 65.5170 31.5160 178.3228 6 I 3.5422 7.7807 117.6399 64.3908 37.1907 178.2868 7 A 3.9579 9.1559 122.1708 54.9618 18.1014 179.1101 8 D 4.2296 8.3619 117.2394 57.6561 41.2585 178.2881 9 M 3.9410 7.8551 118.7113 58.5951 32.2854 178.2276 10 L 3.9097 7.7648 119.1191 57.8894 41.5240 179.8012 11 T 3.7950 7.7672 115.6195 66.5642 68.4401 176.8240 12 R 3.9872 7.9834 120.0780 59.5298 30.0843 179.1424 13 I 3.6032 7.6919 119.0766 64.3306 37.2126 178.4076 14 R 3.7557 8.1963 119.8480 59.4474 29.5715 178.2489 15 N 4.2448 9.0416 117.0562 56.2576 38.6067 177.2702 16 A 3.9609 8.3433 122.7277 55.4048 18.4727 179.7021 17 T 4.1779 7.9205 109.7172 64.6045 68.4827 176.7339 18 R 3.8622 7.6530 119.0328 57.8290 30.0461 177.7351 19 V 4.3148 6.6622 109.6306 60.5560 32.2281 174.9559 20 Y 3.0787 7.6395 116.6508 58.6827 35.3966 170.5052 21 K 4.2003 7.9640 117.9929 56.5890 33.0364 177.4682 22 E 4.2602 8.8518 122.9690 59.0235 30.4242 176.5192 23 S 5.0231 8.1045 113.6477 58.1484 64.4291 171.7463 24 T 4.5471 7.5771 122.4192 62.3507 69.2904 171.7353 25 D 5.4193 8.1557 128.9624 53.4197 43.0145 176.4251 26 V 4.5507 8.3302 114.1611 59.0598 36.3402 172.7606 27 P 3.4066 0.0000 0.0000 62.8755 31.5931 175.9652 28 A 4.3256 8.0012 126.5854 51.8904 19.3861 177.1513 29 S 4.5513 8.4167 114.3388 55.7664 66.2579 174.8057 30 R 3.9070 8.9664 123.7522 59.8187 29.8464 178.4882 31 F 4.4668 8.3693 119.2737 61.7849 39.3110 177.2869 32 K 3.6330 8.3966 118.1404 59.2499 31.7537 179.0044 33 E 3.5878 8.2397 119.6973 59.0508 29.0498 178.5871 34 E 3.9904 8.2127 118.7798 59.4562 29.5364 179.5329 35 I 3.4549 7.3290 119.5497 64.4217 37.1321 178.3058 36 L 3.8409 7.6182 119.7083 57.8444 41.2868 179.7010 37 R 4.1038 7.8610 117.8798 59.5901 29.9816 179.1453 38 I 3.7706 7.3264 118.8680 64.3940 37.1711 178.1859 39 L 4.0643 7.9948 119.6576 58.1508 41.2724 179.5728 40 A 4.2331 8.3488 121.8010 54.5586 18.2495 179.2665 41 R 4.0167 7.8690 116.4226 59.8328 30.0715 177.6151 42 E 4.0491 8.9592 113.8696 56.6535 29.2346 177.2364 43 G 3.8032 8.8741 108.0240 46.4824 0.0000 175.1380 44 F 4.6106 8.6066 120.4857 58.2521 39.2813 176.3721 45 I 4.7191 7.4451 113.2358 58.5316 40.3610 175.9334 46 K 3.8105 8.5175 123.3309 58.5423 32.3576 177.4406 47 G 4.1679 7.1601 104.1833 44.7427 0.0000 170.2736 48 Y 5.5532 7.5323 117.4865 56.4530 41.2575 173.8406 49 E 4.6453 9.2231 116.1189 54.8764 33.1496 175.0629 50 R 4.6460 8.6487 121.2169 57.2119 31.0384 175.8810 51 V 4.5066 8.7367 120.3101 62.2054 35.8570 172.0585 52 D 5.4514 8.7089 124.0578 52.6419 43.1604 175.8460 53 V 3.9385 8.8790 124.8380 61.8098 32.5007 174.9953 54 D 4.3930 9.8781 125.0809 55.1762 39.5630 173.7914 55 G 4.0959 8.5467 106.6055 44.7114 0.0000 174.3746 56 K 4.6210 7.9461 119.2154 53.8252 34.0695 173.9962 57 P 4.9761 0.0000 0.0000 63.6676 32.4794 174.7862 58 Y 5.0867 9.4610 120.0595 56.5762 43.4198 173.8156 59 L 5.2633 8.9741 120.2536 53.0045 44.8674 176.6359 60 R 4.1592 9.2312 124.9171 55.9943 31.5556 175.9663 61 V 4.5334 8.6998 124.3948 61.2673 33.9814 174.3143 62 Y 4.5874 9.0315 127.8802 57.1020 38.2996 175.5484 63 L 4.3970 8.7228 125.1601 54.4866 42.6784 176.8631 64 K 4.6218 7.8559 121.3441 55.0332 35.3282 174.5761 65 Y 4.8585 8.4380 122.4114 56.2594 43.1795 175.2889 66 G 4.0659 9.0161 110.1123 44.4971 0.0000 171.4646 67 P 4.6483 0.0000 0.0000 61.2408 32.8155 174.9639 68 R 4.1920 8.2726 118.7224 56.8888 30.7194 175.1870 69 R 4.7342 8.2707 122.1403 54.5973 33.5359 175.0087 70 Q 4.2872 8.5818 119.2773 55.3076 30.9193 177.1453 71 G 3.9191 8.5169 109.4047 44.2950 0.0000 171.6454 72 P 4.2662 0.0000 0.0000 63.6162 31.8246 174.8212 73 D 4.2528 8.4719 119.5713 54.6447 38.6097 171.3573 74 P 4.5063 0.0000 0.0000 62.5928 31.9437 177.0349 75 R 3.9774 7.7667 119.1733 56.1009 30.2073 175.0261 76 P 4.7936 0.0000 0.0000 62.1087 32.2743 175.8683 77 E 4.2913 8.8322 123.6736 56.2564 30.8654 176.4027 78 Q 4.6047 8.6289 124.5212 55.8735 29.7009 176.2764 79 V 3.9826 8.2130 119.4106 64.4954 32.1591 176.4884 80 I 4.3514 7.2495 120.9197 59.8647 35.7706 174.7266 81 H 4.3220 8.5611 121.5198 58.2287 29.5060 174.6617 82 H 4.2863 7.6033 117.9530 54.0627 33.7841 172.2052 83 I 4.7700 6.2758 125.4669 60.7517 39.4922 171.3739 84 R 4.4944 7.7373 128.5789 53.6007 32.7321 174.7076 85 R 3.7709 8.5655 126.4325 56.8970 30.4859 174.0361 86 I 4.4162 8.1152 122.2817 62.7640 39.3301 175.6234 87 S 4.2284 8.2083 118.5658 58.6064 63.0254 173.5462 88 K 4.6547 8.4248 124.5351 53.7894 36.2442 174.3462 89 P 4.1517 0.0000 0.0000 64.3601 31.9209 176.2707 90 G 3.8307 9.0931 107.2996 45.9459 0.0000 171.9911 91 R 3.7663 7.4399 118.4984 55.8077 31.0919 174.1510 92 R 4.0115 7.2893 118.5714 56.2843 31.3093 177.1198 93 V 4.1398 7.9339 120.4963 61.4609 34.2115 173.7696 94 Y 5.3976 8.4879 124.9792 56.3782 41.0537 175.6947 95 V 4.5844 8.3836 114.7736 59.4975 36.2753 175.9891 96 G 4.1449 9.2853 113.3332 44.6794 0.0000 175.2632 97 V 3.6498 8.2120 118.6784 63.7929 31.4330 177.3516 98 K 4.2393 7.9713 118.2590 57.3719 32.3818 176.8755 99 E 4.4741 8.0096 117.2596 55.7356 30.0324 175.8880 100 I 3.7656 7.6933 120.8446 60.4688 37.0079 174.1203 101 P 4.3519 0.0000 0.0000 63.2212 31.3356 176.6437 102 R 4.4225 8.0203 118.6458 53.9126 30.1014 175.3742 103 V 3.5645 8.0955 122.4393 64.1941 32.8570 176.3750 104 R 3.2125 9.1945 125.7296 58.4793 27.3840 175.9013 105 R 3.7923 8.9109 108.6666 57.0744 28.2286 176.2619 106 G 4.0686 8.5268 106.2946 45.1722 0.0000 176.0577 107 L 3.9528 7.9274 118.1633 55.8143 41.8535 176.4200 108 G 4.4870 7.4021 107.3116 43.5187 0.0000 171.0901 109 I 5.0218 9.1729 112.7423 59.1949 41.5619 174.0611 110 A 4.9563 8.4427 122.1782 51.1344 22.4906 175.3004 111 I 4.6163 8.4428 124.1336 60.2185 38.9894 175.4785 112 L 5.0757 8.9366 127.3366 53.0986 44.8167 175.6338 113 S 4.8874 9.0183 115.2518 57.1257 64.7076 173.0005 114 T 4.7581 8.7611 118.0622 59.4538 71.7123 175.4632 115 S 4.3062 8.7945 115.0246 59.7511 63.0117 174.6962 116 K 4.3161 7.9911 119.7132 56.2725 32.2546 175.8091 117 G 3.7696 8.4899 106.9130 44.0729 0.0000 172.5416 118 V 4.4509 8.0316 118.7307 62.3714 31.9495 175.2606 119 L 5.4423 8.8727 126.4625 51.9882 46.6711 175.9128 120 T 4.8559 8.4801 110.5848 60.7155 70.8132 175.5349 121 D 4.4106 8.7338 122.1746 56.9018 38.9822 179.2273 122 R 3.9028 7.9496 118.7951 58.9593 30.0844 178.4832 123 E 3.9453 8.0481 117.6262 59.4497 29.5040 179.3548 124 A 3.9769 8.3689 120.8834 55.2447 18.2817 179.4812 125 R 3.8419 7.8704 115.7692 60.1296 30.3349 177.7836 126 K 3.8484 8.4041 119.1139 59.7426 31.8481 177.7731 127 L 4.1755 8.3491 119.6546 54.8066 42.9301 177.3375 128 G 4.0391 8.0318 107.5456 46.4999 0.0000 172.5914 129 V 4.5697 7.9643 108.8610 59.6512 36.5144 175.3010 130 G 4.2248 9.3746 108.9001 44.9487 0.0000 171.7856 131 G 4.3145 8.1115 106.1818 43.6889 0.0000 171.3503 132 E 3.9614 8.6191 119.9075 57.0136 30.4751 176.6248 133 L 4.6807 9.1948 131.1111 53.3967 40.2620 176.2645 134 I 3.8162 7.8671 125.0061 63.4892 38.2382 175.4325 135 C 4.9809 7.8093 113.6094 57.9288 33.3466 171.0876 136 E 5.0064 8.4276 119.1308 55.2022 32.7898 174.9905 137 V 4.5485 8.4755 126.3074 60.7905 35.5770 175.2000 138 W 4.7587 7.7905 121.5368 57.3800 28.3096 174.0499 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 M 8.30 4.29 0.00 1.99 2.07 0.00 0.00 0.00 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.53 0.00 2 L 8.08 4.12 0.00 1.71 1.58 0.89 0.57 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 3 T 8.62 3.89 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 1.20 0.00 0.00 4 D 7.66 4.61 0.00 2.67 2.45 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.22 0.00 2.21 2.07 0.00 3.67 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.17 0.00 6 I 7.78 3.54 1.99 0.00 0.00 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.12 0.77 0.00 0.00 7 A 9.16 3.96 1.33 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 0.00 0.00 8 D 8.36 4.23 0.00 2.83 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 9 M 7.86 3.94 0.00 2.14 1.92 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 2.48 2.44 0.00 10 L 7.76 3.91 0.00 1.63 1.55 0.80 0.60 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 11 T 7.77 3.80 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 1.16 0.00 0.00 12 R 7.98 3.99 0.00 1.94 1.97 0.00 3.11 0.00 0.00 3.24 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.82 0.00 13 I 7.69 3.60 1.94 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.65 0.80 0.00 0.00 14 R 8.20 3.76 0.00 1.79 1.95 0.00 3.00 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 1.52 1.53 0.00 15 N 9.04 4.24 0.00 2.82 2.82 0.00 0.00 6.95 7.42 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 16 A 8.34 3.96 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 17 T 7.92 4.18 4.43 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 1.15 0.00 0.00 18 R 7.65 3.86 0.00 1.88 1.98 0.00 3.03 0.00 0.00 3.43 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.65 0.00 19 V 6.66 4.31 2.12 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 0.72 0.00 0.00 1.01 0.00 0.00 20 Y 7.64 3.08 0.00 2.95 2.63 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.96 4.20 0.00 1.94 1.79 0.00 1.75 0.00 0.00 1.65 0.00 0.00 2.93 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.69 1.54 7.81 22 E 8.85 4.26 0.00 2.10 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 0.00 2.57 2.44 0.00 23 S 8.10 5.02 0.00 3.84 3.72 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 24 T 7.58 4.55 4.22 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 1.24 0.00 0.00 25 D 8.16 5.42 0.00 2.59 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 26 V 8.33 4.55 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 0.73 0.00 0.00 0.83 0.00 0.00 27 P 0.00 3.41 0.00 1.69 1.58 0.00 3.56 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.74 0.00 28 A 8.00 4.33 1.16 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 0.00 0.00 0.00 0.00 0.00 0.00 29 S 8.42 4.55 0.00 3.98 3.88 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 30 R 8.97 3.91 0.00 1.89 2.11 0.00 3.35 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 1.76 1.69 0.00 31 F 8.37 4.47 0.00 2.96 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 32 K 8.40 3.63 0.00 1.83 1.67 0.00 1.59 0.00 0.00 1.60 0.00 0.00 2.86 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.25 1.29 7.81 33 E 8.24 3.59 0.00 1.99 2.14 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 2.38 2.32 0.00 34 E 8.21 3.99 0.00 2.35 2.06 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 2.59 2.63 0.00 35 I 7.33 3.45 1.71 0.00 0.00 0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.48 0.72 0.00 0.00 36 L 7.62 3.84 0.00 1.04 1.08 0.34 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 37 R 7.86 4.10 0.00 2.13 2.05 0.00 3.19 0.00 0.00 3.23 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.85 0.00 38 I 7.33 3.77 2.03 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 1.55 0.81 0.99 0.00 0.00 39 L 7.99 4.06 0.00 1.89 1.82 0.87 0.64 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 40 A 8.35 4.23 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.87 4.02 0.00 1.94 2.15 0.00 3.29 0.00 0.00 3.24 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.66 0.00 42 E 8.96 4.05 0.00 2.19 1.85 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 2.53 2.54 0.00 43 G 8.87 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 44 F 8.61 4.61 0.00 3.21 3.02 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 0.00 0.00 0.00 45 I 7.45 4.72 2.10 0.00 0.00 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 1.62 1.11 0.93 0.00 0.00 46 K 8.52 3.81 0.00 2.09 2.00 0.00 1.81 0.00 0.00 1.72 0.00 0.00 2.86 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.52 1.68 7.81 47 G 7.16 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 0.00 0.00 0.00 0.00 48 Y 7.53 5.55 0.00 3.18 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 49 E 9.22 4.65 0.00 2.05 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 2.62 2.45 0.00 50 R 8.65 4.65 0.00 1.78 1.98 0.00 3.29 0.00 0.00 3.21 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.76 0.00 51 V 8.74 4.51 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 0.93 0.00 0.00 1.04 0.00 0.00 52 D 8.71 5.45 0.00 2.57 2.59 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.88 3.94 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 0.00 0.00 0.55 0.00 0.00 0.61 0.00 0.00 54 D 9.88 4.39 0.00 2.77 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 0.00 55 G 8.55 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 0.00 0.00 0.00 56 K 7.95 4.62 0.00 2.14 1.86 0.00 1.62 0.00 0.00 1.77 0.00 0.00 3.14 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.46 1.46 7.81 57 P 0.00 4.98 0.00 2.11 2.22 0.00 3.70 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 2.03 2.01 0.00 58 Y 9.46 5.09 0.00 2.89 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 59 L 8.97 5.26 0.00 1.52 1.62 0.76 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 60 R 9.23 4.16 0.00 1.81 1.27 0.00 3.08 0.00 0.00 3.17 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.75 0.00 61 V 8.70 4.53 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 0.96 0.00 0.00 0.94 0.00 0.00 62 Y 9.03 4.59 0.00 3.19 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 63 L 8.72 4.40 0.00 1.94 1.31 0.95 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 64 K 7.86 4.62 0.00 1.73 1.51 0.00 1.72 0.00 0.00 1.70 0.00 0.00 2.89 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.28 1.44 7.81 65 Y 8.44 4.86 0.00 3.10 3.01 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 0.00 0.00 0.00 66 G 9.02 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 67 P 0.00 4.65 0.00 2.25 2.23 0.00 3.76 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 1.97 0.00 68 R 8.27 4.19 0.00 1.81 1.86 0.00 3.13 0.00 0.00 3.19 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.78 0.00 69 R 8.27 4.73 0.00 1.71 1.83 0.00 3.23 0.00 0.00 3.27 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.58 0.00 70 Q 8.58 4.29 0.00 1.93 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.07 0.00 0.00 0.00 0.00 0.00 2.30 2.30 0.00 71 G 8.52 3.92 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 0.00 0.00 0.00 72 P 0.00 4.27 0.00 2.19 2.07 0.00 3.93 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 1.99 1.96 0.00 73 D 8.47 4.25 0.00 2.81 2.70 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.51 0.00 2.20 2.22 0.00 3.72 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.93 0.00 75 R 7.77 3.98 0.00 1.96 1.89 0.00 3.43 0.00 0.00 3.24 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 1.45 0.00 76 P 0.00 4.79 0.00 2.15 2.28 0.00 2.87 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.80 0.00 77 E 8.83 4.29 0.00 2.13 1.90 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 2.41 2.42 0.00 78 Q 8.63 4.60 0.00 1.98 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.78 0.00 0.00 0.00 0.00 0.00 2.40 2.25 0.00 79 V 8.21 3.98 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 0.88 0.00 0.00 0.99 0.00 0.00 80 I 7.25 4.35 1.76 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.75 0.71 0.00 0.00 81 H 8.56 4.32 0.00 3.28 3.53 0.00 5.87 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 H 7.60 4.29 0.00 1.40 1.31 0.00 5.89 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 I 6.28 4.77 1.52 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.44 0.66 0.00 0.00 84 R 7.74 4.49 0.00 1.60 1.66 0.00 3.29 0.00 0.00 3.07 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.60 0.00 85 R 8.57 3.77 0.00 1.79 1.76 0.00 3.51 0.00 0.00 3.26 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.54 0.00 86 I 8.12 4.42 2.06 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 1.11 0.95 0.88 0.00 0.00 87 S 8.21 4.23 0.00 3.77 3.70 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.42 4.65 0.00 1.74 1.60 0.00 1.75 0.00 0.00 1.72 0.00 0.00 2.99 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.38 1.40 7.81 89 P 0.00 4.15 0.00 2.16 2.07 0.00 3.94 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.97 0.00 90 G 9.09 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 91 R 7.44 3.77 0.00 1.89 2.01 0.00 3.31 0.00 0.00 3.31 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.31 0.00 92 R 7.29 4.01 0.00 1.77 1.43 0.00 3.36 0.00 0.00 3.17 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.42 0.00 93 V 7.93 4.14 1.94 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 0.92 0.00 0.00 0.90 0.00 0.00 94 Y 8.49 5.40 0.00 2.88 2.80 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 95 V 8.38 4.58 2.12 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 0.80 0.00 0.00 1.04 0.00 0.00 96 G 9.29 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 0.00 0.00 0.00 97 V 8.21 3.65 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 1.00 0.00 0.00 98 K 7.97 4.24 0.00 1.78 1.90 0.00 1.72 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.42 1.46 7.81 99 E 8.01 4.47 0.00 2.05 1.97 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 2.27 2.26 0.00 100 I 7.69 3.77 1.89 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.74 0.94 0.00 0.00 101 P 0.00 4.35 0.00 2.20 2.10 0.00 3.74 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 2.03 2.04 0.00 102 R 8.02 4.42 0.00 1.78 1.90 0.00 3.21 0.00 0.00 3.15 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.58 0.00 103 V 8.10 3.56 2.28 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 1.25 0.00 0.00 1.08 0.00 0.00 104 R 9.19 3.21 0.00 1.60 1.60 0.00 3.06 0.00 0.00 2.70 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.50 0.00 105 R 8.91 3.79 0.00 1.74 1.86 0.00 3.21 0.00 0.00 3.15 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.62 0.00 106 G 8.53 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 L 7.93 3.95 0.00 1.63 1.74 0.88 0.67 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 0.00 108 G 7.40 4.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 9.17 5.02 2.00 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.89 1.15 0.00 0.00 110 A 8.44 4.96 1.27 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 0.00 0.00 0.00 0.00 0.00 111 I 8.44 4.62 1.85 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 1.25 1.40 0.91 0.00 0.00 112 L 8.94 5.08 0.00 1.61 1.61 0.96 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 113 S 9.02 4.89 0.00 4.06 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 0.00 114 T 8.76 4.76 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 1.27 0.00 0.00 115 S 8.79 4.31 0.00 3.99 4.01 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 0.00 0.00 0.00 116 K 7.99 4.32 0.00 1.80 1.86 0.00 1.67 0.00 0.00 1.72 0.00 0.00 2.98 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.39 1.36 7.81 117 G 8.49 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 V 8.03 4.45 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 0.86 0.00 0.00 1.18 0.00 0.00 119 L 8.87 5.44 0.00 1.65 1.77 0.97 0.48 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 0.00 120 T 8.48 4.86 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 1.34 0.00 0.00 121 D 8.73 4.41 0.00 2.96 3.02 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 0.00 0.00 0.00 122 R 7.95 3.90 0.00 1.90 2.04 0.00 3.16 0.00 0.00 3.35 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.75 0.00 123 E 8.05 3.95 0.00 2.32 2.04 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 2.36 2.37 0.00 124 A 8.37 3.98 1.46 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 0.00 0.00 125 R 7.87 3.84 0.00 2.02 2.00 0.00 3.30 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.66 0.00 126 K 8.40 3.85 0.00 1.86 1.96 0.00 1.71 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.45 1.51 7.81 127 L 8.35 4.18 0.00 1.81 1.73 0.93 1.00 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 0.00 128 G 8.03 4.04 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 0.00 0.00 0.00 129 V 7.96 4.57 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 0.79 0.00 0.00 0.95 0.00 0.00 130 G 9.37 4.22 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 0.00 0.00 0.00 131 G 8.11 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 0.00 132 E 8.62 3.96 0.00 2.36 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 2.37 2.23 0.00 133 L 9.19 4.68 0.00 1.82 1.51 0.93 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 134 I 7.87 3.82 2.16 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.36 0.85 0.00 0.00 135 C 7.81 4.98 0.00 2.98 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 136 E 8.43 5.01 0.00 2.02 1.79 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 2.35 2.47 0.00 137 V 8.48 4.55 1.67 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 -0.36 0.00 0.00 0.64 0.00 0.00 138 W 7.79 4.76 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