NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 S 4.4652 8.1776 115.2910 57.9336 63.7924 174.6704 3 V 3.4768 8.2676 127.7574 64.4423 30.8063 176.9371 4 Y 3.9873 8.5925 119.2829 61.0008 37.9808 178.9955 5 D 4.4617 8.1773 119.2799 57.1961 40.9911 178.4894 6 A 3.9701 7.9527 120.7856 55.0110 18.3798 179.5487 7 A 3.9218 7.9274 118.8016 54.8318 18.1643 179.4863 8 A 4.0862 7.4998 118.4071 54.7604 18.4863 179.3426 9 Q 4.1594 7.7546 115.8232 57.5567 30.0687 177.3260 10 L 4.2427 7.2575 121.5142 53.9287 39.8332 176.8747 11 T 4.1753 7.5359 113.7990 60.6861 71.6446 175.1002 12 A 3.9490 8.4900 122.4403 55.5573 18.1659 179.6581 13 D 4.2645 7.9442 116.7467 57.4825 41.0410 178.9415 14 V 3.5224 7.3771 117.5169 65.9880 31.5154 178.2858 15 K 3.9071 8.2186 118.3089 59.0113 31.7980 179.3655 16 K 3.9679 7.8079 119.6986 59.6998 32.2660 178.7504 17 D 4.6203 8.1394 119.1738 57.1433 40.5725 178.8776 18 L 3.7556 7.9789 119.7156 57.6946 41.5716 179.6617 19 R 4.0339 8.0896 117.9527 59.3967 28.5835 178.7491 20 D 4.5156 8.3530 118.8706 57.5894 40.9114 179.2222 21 S 3.2612 8.2038 114.4739 60.9305 62.9784 176.2917 22 W 4.3740 8.8756 132.5100 59.9552 30.2145 177.7393 23 K 3.7364 8.1875 119.0749 58.9661 31.7614 178.1943 24 V 3.8458 6.8824 116.5489 64.9672 31.6759 177.9973 25 I 3.5090 7.3588 111.5845 62.9981 37.5250 177.0180 26 G 2.2486 6.9268 108.8123 45.4279 0.0000 174.8686 27 S 4.0897 7.2833 114.3675 60.2265 63.6379 174.3303 28 D 4.6047 7.2204 120.1316 51.0660 41.2537 175.1478 29 K 3.8458 8.0429 123.3444 58.5558 32.3736 178.4014 30 K 4.0179 7.9610 119.5876 59.3513 32.2799 178.9239 31 G 4.0024 8.0120 106.7210 47.6784 0.0000 175.2929 32 N 4.4920 8.3774 119.8219 55.1269 38.3761 178.0164 33 G 3.5207 8.0982 107.6715 47.7775 0.0000 176.0641 34 V 3.5834 7.8104 120.6691 65.3400 31.5033 177.9783 35 A 3.9136 7.6627 120.3239 55.0224 18.2400 179.4957 36 L 3.7841 7.7562 117.3738 58.2234 41.7413 179.7668 37 M 3.4987 7.5461 118.6791 58.4591 31.8885 179.0554 38 T 4.0483 7.9336 109.9180 65.0627 68.7918 176.7620 39 T 3.8705 7.8493 118.7254 66.0697 68.4408 176.5221 40 L 3.8175 7.5453 122.3278 58.2655 41.9555 179.1655 41 F 4.6664 7.6941 117.4252 60.3530 38.5337 177.7010 42 A 4.0675 7.8491 119.8400 55.4060 18.3603 179.1128 43 D 4.6087 8.1945 116.1609 55.7384 42.5532 176.8311 44 N 5.1005 8.4763 117.3646 50.6105 38.6449 174.6342 45 Q 4.4361 8.4389 123.8819 58.0554 29.0517 176.7738 46 E 4.1812 8.2658 117.9840 58.6651 29.8325 178.2634 47 T 4.1679 8.1984 110.6329 63.7798 69.2937 176.5748 48 I 4.0476 7.9389 123.3842 64.4498 36.7964 178.1732 49 G 3.5880 7.4413 105.6567 48.0284 0.0000 175.0500 50 Y 4.2466 7.7437 117.9909 59.8918 37.9524 176.4548 51 F 4.9394 7.9351 118.2711 56.8266 39.8852 177.9209 52 K 3.8261 8.3303 123.2505 60.1214 32.2342 178.7010 53 R 3.9367 8.0415 118.3640 59.0718 30.0641 177.2751 54 L 4.1785 8.0039 116.6764 55.6352 42.6220 179.0190 55 G 3.8608 7.7571 105.9759 46.1082 0.0000 176.5102 56 N 4.5356 8.4160 117.7393 52.7804 38.1696 175.6833 57 V 3.8076 7.8509 119.8277 62.6205 31.6425 177.4108 58 S 4.2953 7.8943 113.4605 60.6589 63.1460 175.7229 59 Q 4.1616 8.1581 121.1540 55.9129 28.9313 177.2848 60 G 3.8757 8.4101 109.2988 46.2010 0.0000 175.2665 61 M 3.8488 9.1832 121.1979 58.5023 31.8707 177.1696 62 A 4.0056 7.6067 120.2385 54.8355 18.7955 177.4987 63 N 4.4089 8.2642 115.0643 53.6112 39.5123 175.1553 64 D 4.3780 8.7372 128.8621 57.5419 41.0972 178.9442 65 K 3.9969 8.0932 118.3638 59.3907 32.0542 179.0434 66 L 4.0492 8.4213 120.6762 58.1349 42.0366 178.9868 67 R 3.9986 8.4988 119.2590 59.2642 29.9988 178.7368 68 G 3.6497 8.3723 105.7634 48.1386 0.0000 175.2199 69 H 4.3021 8.4384 120.9207 59.0327 29.6199 177.5593 70 S 4.0671 8.4451 117.3388 61.6140 62.4206 176.7977 71 I 3.8189 7.7166 121.4999 64.7374 37.3050 178.3490 72 T 4.2056 8.0727 116.7113 66.3976 68.3330 176.3308 73 L 4.0280 8.3358 122.7995 58.7438 42.0848 179.1209 74 M 4.2186 7.8596 118.0240 58.5019 31.7323 178.0607 75 Y 4.0603 7.9927 115.6529 59.9003 38.0530 177.8095 76 A 3.7955 7.8879 122.3509 54.8031 18.5465 179.6148 77 L 3.4710 7.4220 116.9911 57.5812 41.6661 179.2669 78 Q 3.4698 7.7457 119.6361 58.7911 28.7068 177.9141 79 N 4.1788 7.2884 117.0144 56.6911 39.2936 176.4129 80 F 4.5090 7.5341 119.0519 60.8603 38.8819 177.7582 81 I 3.4803 7.6261 119.3647 64.4961 36.6240 178.2806 82 D 4.4569 7.8700 118.1471 56.4578 40.9204 177.6951 83 Q 4.4228 7.5631 116.9532 55.7235 28.8103 177.1188 84 L 3.9297 7.4159 121.5562 57.9201 41.7622 177.9505 85 D 4.5252 7.9165 115.6286 55.4111 41.4288 176.0987 86 N 4.8700 8.0669 118.3399 49.5477 39.2897 172.3182 87 P 4.2488 0.0000 0.0000 65.3795 30.9974 178.0634 88 D 4.5716 8.1100 119.9812 56.9384 40.8712 178.0247 89 D 4.3740 8.1474 119.3411 56.8196 40.9238 178.5098 90 L 3.8708 7.9635 120.9959 58.1460 42.0929 179.2781 91 V 3.3029 7.6269 118.2923 66.0073 31.3732 177.8022 92 C 4.1669 7.7050 114.1589 61.3513 29.4783 176.2370 93 V 3.7985 7.9458 114.8844 63.8661 31.1883 178.7498 94 V 3.5259 7.7502 118.3267 65.9772 30.9169 178.0135 95 E 3.9878 8.2289 118.4279 59.1398 29.0212 179.2513 96 K 4.0442 7.7887 118.6944 59.3820 32.3461 178.3475 97 F 4.3180 8.2476 119.8965 61.3387 39.5776 176.7468 98 A 3.9204 8.4250 120.4059 54.6627 18.0706 179.3212 99 V 3.4395 7.3696 115.7230 66.8969 31.3663 178.0661 100 N 4.2909 7.9708 115.1359 56.6480 38.4532 177.1107 101 H 4.0875 7.9545 117.0233 58.4416 28.7074 177.8518 102 I 3.7136 7.9843 122.5555 64.4984 36.7813 178.5086 103 T 3.8570 7.6508 109.2346 64.3522 68.5762 175.7545 104 R 4.1978 7.3683 118.6303 55.5105 30.3803 176.4041 105 K 3.8014 7.9616 117.5006 57.4418 29.7654 176.2644 106 I 3.9495 7.6490 121.3424 60.0541 36.5388 176.8828 107 S 4.4459 8.3363 121.0149 57.5592 65.4062 174.7099 108 A 3.9983 8.5019 123.2570 55.1553 17.8081 179.8356 109 A 4.0144 7.9094 118.2225 55.3262 19.0321 179.1953 110 E 4.1313 8.2384 117.1740 59.6701 29.7161 179.4081 111 F 4.2180 8.7518 121.0606 61.1543 39.4504 177.2198 112 G 3.8295 8.1798 104.6516 47.0156 0.0000 175.2496 113 K 4.2079 7.9635 119.9516 58.3137 32.0489 178.2263 114 I 3.7174 7.5156 118.5845 62.6805 37.9088 177.1806 115 N 4.4653 8.2298 117.8811 56.4319 38.3439 177.3038 116 G 3.5540 7.5812 107.1667 47.5123 0.0000 173.8901 117 P 4.2123 0.0000 0.0000 65.1369 31.3434 178.7581 118 I 3.5016 7.6146 118.5286 64.1325 36.8833 178.4088 119 K 3.9759 8.0313 120.5203 59.3320 32.0070 179.1117 120 K 3.9364 7.9738 118.8054 59.4408 31.7698 179.5098 121 V 3.5280 7.5598 117.3147 65.8325 31.6084 177.8197 122 L 4.0191 7.9350 118.4559 57.7360 41.4523 179.1362 123 A 4.1520 8.2321 121.1500 55.3528 18.1144 179.7252 124 S 4.2055 8.0127 110.9599 60.4068 63.0259 175.6927 125 K 4.4220 7.8950 120.4961 55.4780 32.5180 175.4687 126 N 4.1978 8.4822 115.8978 54.5789 35.8165 174.4649 127 F 4.3426 8.1698 117.2112 55.3562 40.6637 177.0760 128 G 4.0430 8.5783 114.8859 44.4153 0.0000 171.7236 129 D 4.5111 8.8995 118.6870 57.5853 40.6532 178.5600 130 K 3.9073 8.1936 119.4591 59.8620 32.0618 178.2302 131 Y 4.2009 8.1472 116.2295 60.8106 37.9292 177.7761 132 A 4.2258 8.1935 121.3664 55.3509 18.4700 179.2910 133 N 4.3640 8.8343 115.2638 56.2803 38.2159 177.4604 134 A 3.9577 7.8319 122.0525 55.1577 18.4288 179.8359 135 W 3.9348 8.5553 117.1532 59.6089 29.1437 178.6837 136 A 4.0905 8.2555 120.9511 55.0483 17.5236 179.8149 137 K 3.9962 7.6451 116.2407 59.2118 32.4061 179.0795 138 L 3.9420 7.5083 120.4651 58.0627 41.9646 179.1260 139 V 3.7647 8.2269 118.2540 66.0084 31.4264 177.8405 140 A 4.4974 7.9037 121.8025 54.4938 17.9021 179.7913 141 V 3.4271 7.3256 116.3864 66.0427 31.8063 178.1765 142 V 3.5196 7.3989 117.5848 65.9051 31.4398 177.8489 143 Q 3.8814 8.2898 117.7666 58.8487 28.3204 178.6238 144 A 4.0628 7.8616 120.3975 54.0380 18.4567 178.3707 145 A 4.3793 7.6518 117.2624 52.0630 19.5512 177.0513 146 L 4.1688 7.6211 122.8511 54.6408 41.9289 176.3497 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 S 8.18 4.47 0.00 3.90 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 3 V 8.27 3.48 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 0.57 0.00 0.00 0.76 0.00 0.00 4 Y 8.59 3.99 0.00 2.98 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 5 D 8.18 4.46 0.00 2.84 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 6 A 7.95 3.97 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 7 A 7.93 3.92 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 A 7.50 4.09 1.38 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 9 Q 7.75 4.16 0.00 2.13 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 7.37 0.00 0.00 0.00 0.00 0.00 2.60 2.52 0.00 10 L 7.26 4.24 0.00 1.71 1.54 0.77 0.77 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 11 T 7.54 4.18 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 12 A 8.49 3.95 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 13 D 7.94 4.26 0.00 2.66 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 14 V 7.38 3.52 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 0.92 0.00 0.00 0.88 0.00 0.00 15 K 8.22 3.91 0.00 1.79 1.78 0.00 1.66 0.00 0.00 1.58 0.00 0.00 2.99 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.36 1.55 7.81 16 K 7.81 3.97 0.00 1.97 2.03 0.00 1.58 0.00 0.00 1.68 0.00 0.00 3.07 0.00 0.00 3.27 0.00 0.00 0.00 0.00 1.46 1.66 7.81 17 D 8.14 4.62 0.00 2.84 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 18 L 7.98 3.76 0.00 1.64 1.24 0.55 -0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 19 R 8.09 4.03 0.00 2.05 2.05 0.00 3.17 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.89 0.00 20 D 8.35 4.52 0.00 3.02 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 21 S 8.20 3.26 0.00 3.70 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 22 W 8.88 4.37 0.00 3.72 3.38 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 23 K 8.19 3.74 0.00 1.90 2.08 0.00 1.89 0.00 0.00 1.65 0.00 0.00 3.00 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.44 1.44 7.81 24 V 6.88 3.85 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 1.02 0.00 0.00 1.11 0.00 0.00 25 I 7.36 3.51 1.58 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.29 0.62 0.00 0.00 26 G 6.93 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 S 7.28 4.09 0.00 3.89 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 28 D 7.22 4.60 0.00 2.61 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 0.00 0.00 0.00 0.00 29 K 8.04 3.85 0.00 1.75 1.72 0.00 1.17 0.00 0.00 0.76 0.00 0.00 2.17 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.26 1.37 7.81 30 K 7.96 4.02 0.00 1.83 1.78 0.00 1.73 0.00 0.00 1.83 0.00 0.00 2.95 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.49 1.51 7.81 31 G 8.01 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.38 4.49 0.00 2.68 2.72 0.00 0.00 7.01 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 33 G 8.10 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 34 V 7.81 3.58 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 1.07 0.00 0.00 0.95 0.00 0.00 35 A 7.66 3.91 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 36 L 7.76 3.78 0.00 1.77 1.58 0.79 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 37 M 7.55 3.50 0.00 1.59 1.95 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.70 0.00 38 T 7.93 4.05 4.27 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 1.29 0.00 0.00 39 T 7.85 3.87 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 1.21 0.00 0.00 40 L 7.55 3.82 0.00 1.59 1.30 0.88 0.74 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 41 F 7.69 4.67 0.00 3.12 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 42 A 7.85 4.07 1.41 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 0.00 0.00 0.00 43 D 8.19 4.61 0.00 2.66 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 44 N 8.48 5.10 0.00 2.92 2.98 0.00 0.00 6.62 7.46 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 45 Q 8.44 4.44 0.00 2.17 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.93 0.00 0.00 0.00 0.00 0.00 2.46 2.32 0.00 46 E 8.27 4.18 0.00 2.22 2.23 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 2.46 2.37 0.00 47 T 8.20 4.17 4.73 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 1.42 0.00 0.00 48 I 7.94 4.05 1.94 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 1.19 1.24 0.74 0.00 0.00 49 G 7.44 3.59 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 0.00 0.00 0.00 50 Y 7.74 4.25 0.00 2.62 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 51 F 7.94 4.94 0.00 3.15 3.10 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 52 K 8.33 3.83 0.00 1.92 2.08 0.00 1.49 0.00 0.00 1.91 0.00 0.00 2.83 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.50 1.45 7.81 53 R 8.04 3.94 0.00 1.81 2.05 0.00 3.26 0.00 0.00 3.25 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.68 0.00 54 L 8.00 4.18 0.00 1.84 1.76 1.03 1.11 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 55 G 7.76 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 0.00 0.00 0.00 56 N 8.42 4.54 0.00 2.82 2.72 0.00 0.00 6.94 7.71 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 57 V 7.85 3.81 1.63 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 0.61 0.00 0.00 0.40 0.00 0.00 58 S 7.89 4.30 0.00 4.05 3.98 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 59 Q 8.16 4.16 0.00 2.21 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 5.81 0.00 0.00 0.00 0.00 0.00 2.37 2.36 0.00 60 G 8.41 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 0.00 0.00 0.00 61 M 9.18 3.85 0.00 1.96 2.14 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 2.60 2.64 0.00 62 A 7.61 4.01 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 63 N 8.26 4.41 0.00 2.78 2.87 0.00 0.00 7.13 8.05 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 64 D 8.74 4.38 0.00 2.74 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 65 K 8.09 4.00 0.00 1.99 1.90 0.00 1.75 0.00 0.00 1.78 0.00 0.00 2.92 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.56 1.52 7.81 66 L 8.42 4.05 0.00 1.81 1.86 1.06 0.88 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 67 R 8.50 4.00 0.00 2.16 2.08 0.00 3.16 0.00 0.00 3.35 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.66 0.00 68 G 8.37 3.65 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 H 8.44 4.30 0.00 3.37 3.54 0.00 5.79 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 S 8.45 4.07 0.00 4.03 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 71 I 7.72 3.82 1.96 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.70 1.13 0.00 0.00 72 T 8.07 4.21 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 1.29 0.00 0.00 73 L 8.34 4.03 0.00 1.70 1.85 0.90 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 74 M 7.86 4.22 0.00 2.09 2.16 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.77 2.92 0.00 75 Y 7.99 4.06 0.00 3.26 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 76 A 7.89 3.80 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 77 L 7.42 3.47 0.00 1.50 1.21 0.97 1.19 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 78 Q 7.75 3.47 0.00 2.39 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.81 0.00 0.00 0.00 0.00 0.00 2.50 2.62 0.00 79 N 7.29 4.18 0.00 2.74 2.68 0.00 0.00 7.26 8.30 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 80 F 7.53 4.51 0.00 2.95 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 81 I 7.63 3.48 1.48 0.00 0.00 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.41 0.78 0.00 0.00 82 D 7.87 4.46 0.00 2.79 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 83 Q 7.56 4.42 0.00 2.01 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.74 0.00 0.00 0.00 0.00 0.00 2.72 2.55 0.00 84 L 7.42 3.93 0.00 1.50 1.67 0.78 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 85 D 7.92 4.53 0.00 2.66 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 86 N 8.07 4.87 0.00 2.68 2.63 0.00 0.00 6.80 7.48 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 87 P 0.00 4.25 0.00 2.41 2.33 0.00 3.76 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 2.15 2.11 0.00 88 D 8.11 4.57 0.00 3.02 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 89 D 8.15 4.37 0.00 2.74 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 90 L 7.96 3.87 0.00 1.88 1.68 0.76 0.59 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 91 V 7.63 3.30 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 0.48 0.00 0.00 0.16 0.00 0.00 92 C 7.70 4.17 0.00 3.17 3.16 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 93 V 7.95 3.80 2.23 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 0.94 0.00 0.00 1.13 0.00 0.00 94 V 7.75 3.53 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 0.77 0.00 0.00 0.32 0.00 0.00 95 E 8.23 3.99 0.00 2.05 1.96 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 2.26 2.51 0.00 96 K 7.79 4.04 0.00 1.77 2.17 0.00 1.73 0.00 0.00 1.66 0.00 0.00 3.10 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.52 1.58 7.81 97 F 8.25 4.32 0.00 3.37 3.39 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 0.00 98 A 8.42 3.92 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 99 V 7.37 3.44 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 1.00 0.00 0.00 1.03 0.00 0.00 100 N 7.97 4.29 0.00 2.61 2.72 0.00 0.00 6.98 8.16 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 0.00 101 H 7.95 4.09 0.00 3.15 3.27 0.00 5.81 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 I 7.98 3.71 2.00 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 1.53 0.87 0.88 0.00 0.00 103 T 7.65 3.86 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 1.26 0.00 0.00 104 R 7.37 4.20 0.00 1.80 1.91 0.00 3.13 0.00 0.00 3.06 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.69 0.00 105 K 7.96 3.80 0.00 1.99 2.01 0.00 1.73 0.00 0.00 1.71 0.00 0.00 3.01 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.38 1.58 7.81 106 I 7.65 3.95 1.95 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.60 0.95 0.00 0.00 107 S 8.34 4.45 0.00 4.08 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 0.00 108 A 8.50 4.00 1.41 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 0.00 0.00 0.00 109 A 7.91 4.01 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 0.00 110 E 8.24 4.13 0.00 2.31 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 2.43 2.58 0.00 111 F 8.75 4.22 0.00 3.26 3.25 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 0.00 112 G 8.18 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 0.00 113 K 7.96 4.21 0.00 1.97 1.89 0.00 1.86 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.50 1.57 7.81 114 I 7.52 3.72 1.55 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.08 0.68 0.00 0.00 115 N 8.23 4.47 0.00 2.98 2.88 0.00 0.00 6.72 7.30 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 0.00 116 G 7.58 3.55 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 0.00 0.00 0.00 117 P 0.00 4.21 0.00 2.04 2.13 0.00 3.63 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 2.01 2.11 0.00 118 I 7.61 3.50 1.94 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 1.15 1.00 0.53 0.00 0.00 119 K 8.03 3.98 0.00 1.86 1.97 0.00 1.67 0.00 0.00 1.69 0.00 0.00 2.96 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.46 1.53 7.81 120 K 7.97 3.94 0.00 1.97 1.81 0.00 1.69 0.00 0.00 1.55 0.00 0.00 2.90 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.44 1.61 7.81 121 V 7.56 3.53 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 0.68 0.00 0.00 0.91 0.00 0.00 122 L 7.93 4.02 0.00 1.92 1.92 0.90 0.19 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 0.00 123 A 8.23 4.15 1.40 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 0.00 0.00 124 S 8.01 4.21 0.00 4.03 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 0.00 125 K 7.90 4.42 0.00 2.15 2.05 0.00 1.77 0.00 0.00 1.66 0.00 0.00 2.99 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.64 1.55 7.81 126 N 8.48 4.20 0.00 2.64 2.80 0.00 0.00 6.74 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 0.00 127 F 8.17 4.34 0.00 2.97 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 0.00 128 G 8.58 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 D 8.90 4.51 0.00 2.82 2.79 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 0.00 130 K 8.19 3.91 0.00 1.75 1.56 0.00 1.62 0.00 0.00 1.61 0.00 0.00 2.87 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.35 1.43 7.81 131 Y 8.15 4.20 0.00 3.47 3.24 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 0.00 132 A 8.19 4.23 1.44 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 0.00 0.00 0.00 133 N 8.83 4.36 0.00 2.98 2.90 0.00 0.00 6.89 7.28 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 0.00 134 A 7.83 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 0.00 135 W 8.56 3.93 0.00 3.60 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 0.00 136 A 8.26 4.09 1.47 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 0.00 0.00 0.00 0.00 0.00 137 K 7.65 4.00 0.00 1.86 1.83 0.00 1.67 0.00 0.00 1.59 0.00 0.00 2.96 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.46 1.64 7.81 138 L 7.51 3.94 0.00 1.49 1.74 0.65 0.38 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 0.00 139 V 8.23 3.76 2.35 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 1.27 0.00 0.00 1.18 0.00 0.00 140 A 7.90 4.50 1.42 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 0.00 0.00 0.00 141 V 7.33 3.43 1.99 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 0.58 0.00 0.00 0.85 0.00 0.00 142 V 7.40 3.52 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 0.49 0.00 0.00 0.56 0.00 0.00 143 Q 8.29 3.88 0.00 2.30 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.58 0.00 0.00 0.00 0.00 0.00 2.66 2.73 0.00 144 A 7.86 4.06 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 0.00 145 A 7.65 4.38 1.22 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 0.00 146 L 7.62 4.17 0.00 1.69 1.50 0.63 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00