NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3674 8.3044 120.3254 55.8646 32.7087 174.9989 2 H 4.4623 8.1549 127.9600 53.8762 28.7804 173.3559 3 L 4.4639 7.1747 120.2853 53.4486 43.3472 177.1915 4 T 4.0573 9.2302 115.1817 60.4399 69.8681 173.7118 5 P 4.1770 0.0000 0.0000 66.0826 30.7683 178.8008 6 E 4.0269 8.0807 115.4103 59.2308 29.5562 178.8348 7 E 3.9685 8.2215 120.0135 58.9322 29.4070 178.9807 8 K 3.8970 7.8715 119.6362 59.2968 32.2957 178.9377 9 S 4.1184 8.1351 114.5954 61.2274 62.8823 176.4021 10 A 4.0068 7.6676 123.6173 54.6972 18.0476 179.7769 11 V 3.1477 7.6817 116.7544 66.3685 31.3601 178.4636 12 T 3.9364 7.4105 113.8208 66.5763 68.3492 176.2283 13 A 4.1825 8.4325 123.1290 55.1332 18.4256 179.5213 14 L 3.7992 7.8720 118.8917 57.9879 42.0358 178.8513 15 W 4.6456 8.8468 128.3884 60.2142 30.2939 178.0518 16 G 3.6771 7.7330 104.8808 47.2769 0.0000 175.0295 17 K 4.3360 8.2061 118.5906 56.0215 32.9145 177.2012 18 V 3.7455 6.7578 119.8676 62.3298 32.1322 176.1783 19 N 4.6371 8.1099 125.0176 51.8447 38.1402 175.3513 20 V 3.5689 7.9674 120.4562 64.0429 31.6651 177.3336 21 D 4.3544 8.1976 118.1387 57.4351 40.8380 178.2298 22 E 3.8748 8.0108 119.1468 59.5153 29.6785 179.1263 23 V 3.6057 8.1313 118.7373 65.6604 31.5021 178.1836 24 G 3.6997 8.3091 105.8306 47.7287 0.0000 175.8793 25 G 3.6130 7.7904 108.6121 47.4601 0.0000 175.6851 26 E 3.9129 8.0285 120.5471 58.9420 29.5515 179.3657 27 A 3.9111 8.1521 121.0123 55.0483 18.5772 179.4926 28 L 3.9621 7.9726 119.0462 58.0879 42.0513 179.1459 29 G 3.6473 8.1535 105.7619 48.1911 0.0000 175.7094 30 R 3.8859 8.0954 121.2143 58.6298 30.0142 179.0363 31 L 4.0426 7.7860 120.0625 58.1948 42.3087 179.0434 32 L 4.0821 7.8503 118.0818 56.8863 41.2132 179.4794 33 V 3.6309 7.1145 117.8393 65.5815 31.8852 177.9099 34 V 3.4539 7.7500 116.8838 64.4527 32.7530 175.6232 35 Y 3.8564 7.1812 115.8668 53.9181 37.8806 174.0815 36 P 4.7859 0.0000 0.0000 64.5814 31.5059 178.4493 37 W 4.3414 7.9709 116.4659 59.4737 28.0006 177.8513 38 T 4.2051 7.8713 110.4778 63.9148 68.2080 175.8604 39 Q 4.4183 7.9974 121.1239 57.6533 28.5118 177.9940 40 R 3.8045 7.5154 117.1076 58.5836 29.3691 177.9723 41 F 4.2816 6.9738 116.6596 57.5973 39.9446 175.5574 42 F 4.5696 7.4470 118.2792 56.5445 39.1867 176.4196 43 E 4.2146 8.1493 117.8818 57.9570 30.0954 177.4997 44 S 4.6895 7.9420 113.0373 58.5263 63.6569 174.6128 45 F 4.6154 8.2005 119.4931 58.4337 39.9256 176.9970 46 G 3.9336 8.1124 106.6615 44.5104 0.0000 174.1571 47 D 4.4451 8.6142 125.3781 54.6322 40.7586 175.6888 48 L 4.8725 8.3771 125.8640 54.3257 42.9908 178.8586 49 S 4.3060 8.2572 116.1382 60.9775 63.0781 174.4872 50 T 4.7306 7.3714 110.8460 58.3001 73.1035 172.9004 51 P 4.1954 0.0000 0.0000 65.9923 31.3137 178.7867 52 D 4.3622 8.0584 116.8970 57.2380 40.5773 178.4946 53 A 4.0254 7.7565 120.3968 54.9108 18.4676 179.6387 54 V 3.7210 7.7899 116.8567 66.3289 31.5936 178.1210 55 M 3.9747 8.3354 117.9483 57.9247 31.9776 177.8918 56 G 3.7801 7.8329 105.4927 45.9365 0.0000 173.8277 57 N 4.2091 7.7058 119.7453 53.4709 39.8239 173.2904 58 P 4.2178 0.0000 0.0000 66.1408 31.2320 178.6158 59 K 3.6573 8.1486 118.1254 58.9593 31.7147 179.5468 60 V 3.6855 7.6699 118.1595 65.7524 31.6065 178.1418 61 K 3.9185 7.9737 118.0328 59.4205 31.7705 179.2514 62 A 3.9912 7.7981 120.7340 55.3295 18.2382 179.2483 63 H 4.3104 8.3402 117.0101 59.2712 29.9213 177.5279 64 G 3.7346 8.4113 107.9952 47.9362 0.0000 175.4828 65 K 3.9704 7.9469 121.4683 58.9043 32.1812 178.8313 66 K 3.9074 7.8297 120.0353 59.4427 32.2479 178.7030 67 V 3.6633 8.0879 118.8163 66.4040 31.4899 178.1710 68 L 4.3441 8.4284 118.5851 57.2923 41.3680 179.8148 69 G 3.6759 8.1316 105.9046 47.8166 0.0000 175.6071 70 A 4.1126 8.2557 123.8534 54.7387 18.5558 179.4713 71 F 4.2421 8.5359 119.1452 61.6396 39.2828 177.3430 72 S 4.2343 8.7357 113.8998 62.0301 63.0236 176.2150 73 D 4.6051 8.3274 121.5166 57.3027 40.5295 179.0665 74 G 3.5564 7.9333 106.1651 47.6864 0.0000 175.4550 75 L 3.8528 7.3453 118.9724 56.1551 41.6220 178.1252 76 A 4.4559 7.4548 119.1781 51.9810 20.1073 176.2816 77 H 4.8832 7.9720 115.2788 54.7938 29.8539 175.3722 78 L 4.1171 8.0119 119.7317 57.2226 41.9292 178.6999 79 D 4.4938 7.8975 117.7682 56.2749 41.8035 176.3138 80 N 4.9790 8.3360 116.8505 51.2594 39.0502 174.4987 81 L 4.0355 7.8108 122.9111 57.5661 42.1929 179.0681 82 K 3.9356 8.0326 117.0958 59.3153 32.3983 179.2106 83 G 3.6583 8.0467 105.2591 48.1351 0.0000 175.3670 84 T 3.6556 7.6858 117.9967 66.0448 68.7294 175.7163 85 F 4.6548 8.6665 117.7140 57.3065 39.2156 177.5182 86 A 4.1563 7.8726 122.9304 55.6509 18.2262 180.3397 87 T 4.0456 7.8741 107.7803 64.7724 68.8460 176.4226 88 L 4.0268 7.9231 122.7897 57.8682 42.3562 178.4671 89 S 4.3959 8.4341 114.8937 61.0308 62.2475 176.1308 90 E 3.8944 8.1116 120.8479 59.1091 29.1038 179.1644 91 L 3.8832 7.9706 120.3464 58.6025 42.2129 178.6254 92 H 4.0897 8.6244 116.5555 59.6982 28.3596 176.6383 93 C 3.5657 7.7572 120.5573 62.0370 30.9651 175.2250 94 D 4.3189 8.4560 122.8665 56.3516 40.7433 177.5237 95 K 4.2891 8.0422 117.4282 57.8442 33.5574 177.7083 96 L 4.0434 7.7254 116.5618 55.4976 42.2428 176.4037 97 H 4.2148 7.6997 113.0571 55.7383 25.8742 175.3626 98 V 3.4844 7.8994 118.9382 61.1182 32.0882 174.8867 99 D 4.3250 8.6663 127.6277 53.6929 41.6918 175.1471 100 P 3.2583 0.0000 0.0000 65.0501 31.8146 177.9521 101 E 3.8306 8.0981 118.1191 59.1953 29.2405 178.6800 102 A 3.9484 7.7170 120.8374 55.1000 18.2778 179.5998 103 F 4.4180 7.4846 116.3176 60.7917 39.0447 178.1224 104 R 4.0442 7.8022 117.3609 58.8936 30.0169 178.7520 105 L 3.7957 7.8955 118.8689 57.7197 41.6142 179.2003 106 L 4.0915 8.1494 120.3797 58.1326 41.9331 179.1882 107 G 3.7137 7.9741 105.2439 48.0203 0.0000 175.4514 108 N 4.4294 8.1081 118.6498 55.8772 38.4850 177.7210 109 V 3.5976 7.8922 119.7024 65.9156 31.5897 177.7793 110 L 3.8560 8.3474 120.4528 58.1713 41.9063 179.0093 111 V 3.5366 7.9584 118.1489 66.3628 31.3679 177.8380 112 C 4.1557 8.3147 116.6313 62.6031 27.9185 176.2596 113 V 3.5149 7.9481 120.3754 65.9930 31.0299 178.1736 114 L 3.8897 8.0083 118.8912 57.3557 41.2822 179.4091 115 A 3.7332 7.3393 120.8254 55.2686 18.1322 179.0108 116 H 4.0620 8.1321 115.7923 59.8366 29.9643 176.8991 117 H 4.0648 8.0479 116.5749 58.4733 29.0084 177.1443 118 F 4.4355 8.6127 117.9180 56.7206 39.5466 177.3939 119 G 3.7246 8.6842 108.9610 45.9749 0.0000 177.1418 120 K 3.9406 8.9492 124.1171 58.9207 32.0168 177.3040 121 E 4.1310 8.3424 118.8185 58.5462 29.9483 177.0379 122 F 4.5679 8.1027 123.0565 56.8303 37.8671 175.5111 123 T 4.1432 7.4485 115.4279 60.1845 71.2762 173.3288 124 P 4.1945 0.0000 0.0000 65.7976 31.2707 177.2486 125 P 4.2597 0.0000 0.0000 65.3414 31.2257 178.8916 126 V 3.5361 7.1066 117.0978 65.5248 31.3679 177.8618 127 Q 3.5303 7.9349 119.5864 59.0640 29.0534 178.1387 128 A 4.0841 7.8830 121.3387 55.0277 18.3283 179.5526 129 A 3.8592 7.7343 119.3445 55.6725 18.5139 179.5401 130 Y 4.0016 8.1718 115.2433 61.1696 37.9639 178.8593 131 Q 4.1353 8.7722 119.5466 59.0200 28.8162 179.0205 132 K 3.9939 7.9898 119.1076 59.3238 31.9701 179.5726 133 V 3.4674 7.7834 118.4099 66.2417 31.5329 178.5504 134 V 3.8077 8.4512 112.3178 64.3010 31.2599 178.5812 135 A 4.1004 8.0535 120.2774 55.1073 18.2066 179.8334 136 G 3.5363 8.2061 104.3894 47.9793 0.0000 176.0799 137 V 3.3205 8.0145 120.6682 65.5144 31.3009 177.9825 138 A 3.8869 7.8550 119.4553 55.2004 18.3966 179.0446 139 N 4.4239 8.4737 115.0418 56.4247 38.0934 177.5311 140 A 4.0254 8.1667 122.3499 55.1441 18.0830 179.5308 141 L 3.9296 8.0765 116.8732 56.4649 41.6075 178.2786 142 A 4.8655 7.6352 119.6418 52.2988 19.4439 178.1060 143 H 4.2524 7.8851 113.1001 58.2690 28.4874 176.2999 144 K 4.3328 7.8400 118.1889 56.1711 32.0445 176.4650 145 Y 4.2569 7.9789 117.7522 58.4017 38.4883 175.5337 146 H 4.4322 8.4044 117.1336 56.2872 28.1252 173.4368 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 4.37 0.00 1.98 2.09 0.00 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.45 0.00 2 H 8.15 4.46 0.00 3.16 3.22 0.00 5.72 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 L 7.17 4.46 0.00 1.56 1.51 0.83 0.82 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 4 T 9.23 4.06 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 5 P 0.00 4.18 0.00 2.14 2.13 0.00 3.55 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 2.09 2.13 0.00 6 E 8.08 4.03 0.00 2.13 2.19 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 2.32 2.32 0.00 7 E 8.22 3.97 0.00 2.19 1.93 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 2.27 2.25 0.00 8 K 7.87 3.90 0.00 1.84 1.96 0.00 1.64 0.00 0.00 1.77 0.00 0.00 2.91 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.44 1.40 7.81 9 S 8.14 4.12 0.00 4.09 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 10 A 7.67 4.01 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 11 V 7.68 3.15 1.82 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 0.68 0.00 0.00 0.37 0.00 0.00 12 T 7.41 3.94 4.46 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 1.23 0.00 0.00 13 A 8.43 4.18 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 14 L 7.87 3.80 0.00 1.77 1.95 0.12 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 15 W 8.85 4.65 0.00 3.82 3.22 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 16 G 7.73 3.68 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 0.00 17 K 8.21 4.34 0.00 2.12 2.14 0.00 1.79 0.00 0.00 1.90 0.00 0.00 3.05 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.53 1.77 7.81 18 V 6.76 3.75 1.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.12 0.00 0.00 0.69 0.00 0.00 19 N 8.11 4.64 0.00 2.72 2.61 0.00 0.00 7.17 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 20 V 7.97 3.57 2.18 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 0.80 0.00 0.00 1.05 0.00 0.00 21 D 8.20 4.35 0.00 2.89 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 22 E 8.01 3.87 0.00 1.98 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 0.00 2.29 2.30 0.00 23 V 8.13 3.61 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 0.91 0.00 0.00 0.74 0.00 0.00 24 G 8.31 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 0.00 0.00 0.00 25 G 7.79 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.03 3.91 0.00 2.20 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 2.31 2.48 0.00 27 A 8.15 3.91 1.28 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 0.00 0.00 0.00 28 L 7.97 3.96 0.00 1.82 1.69 0.94 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 29 G 8.15 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 30 R 8.10 3.89 0.00 1.99 1.95 0.00 3.07 0.00 0.00 3.02 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.67 0.00 31 L 7.79 4.04 0.00 1.89 1.85 1.03 0.74 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 32 L 7.85 4.08 0.00 1.84 1.71 0.68 0.92 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 33 V 7.11 3.63 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 0.73 0.00 0.00 0.91 0.00 0.00 34 V 7.75 3.45 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 0.07 0.00 0.00 0.79 0.00 0.00 35 Y 7.18 3.86 0.00 2.39 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 36 P 0.00 4.79 0.00 2.31 2.32 0.00 3.74 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 1.92 0.00 37 W 7.97 4.34 0.00 3.54 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 T 7.87 4.21 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 1.06 0.00 0.00 39 Q 8.00 4.42 0.00 2.28 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.83 0.00 0.00 0.00 0.00 0.00 2.44 2.53 0.00 40 R 7.52 3.80 0.00 1.59 1.86 0.00 2.92 0.00 0.00 2.67 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.50 0.00 41 F 6.97 4.28 0.00 1.68 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 42 F 7.45 4.57 0.00 2.86 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 43 E 8.15 4.21 0.00 2.08 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 2.25 2.30 0.00 44 S 7.94 4.69 0.00 4.13 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 45 F 8.20 4.62 0.00 3.15 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 46 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 47 D 8.61 4.45 0.00 2.67 2.64 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 0.00 0.00 0.00 0.00 48 L 8.38 4.87 0.00 1.73 1.61 1.01 0.92 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 49 S 8.26 4.31 0.00 4.01 4.06 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 50 T 7.37 4.73 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 1.21 0.00 0.00 51 P 0.00 4.20 0.00 2.15 2.11 0.00 3.58 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 2.09 2.15 0.00 52 D 8.06 4.36 0.00 2.67 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 53 A 7.76 4.03 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 0.00 0.00 54 V 7.79 3.72 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 1.03 0.00 0.00 1.03 0.00 0.00 55 M 8.34 3.97 0.00 1.98 2.15 0.00 0.00 0.00 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.79 0.00 56 G 7.83 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 57 N 7.71 4.21 0.00 3.05 2.88 0.00 0.00 6.76 7.55 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 58 P 0.00 4.22 0.00 2.23 2.26 0.00 3.71 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.03 0.00 59 K 8.15 3.66 0.00 1.43 0.74 0.00 1.71 0.00 0.00 1.21 0.00 0.00 2.84 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.17 1.24 7.81 60 V 7.67 3.69 2.30 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 1.17 0.00 0.00 1.05 0.00 0.00 61 K 7.97 3.92 0.00 1.98 1.81 0.00 1.69 0.00 0.00 1.62 0.00 0.00 3.21 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.43 1.62 7.81 62 A 7.80 3.99 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 63 H 8.34 4.31 0.00 3.52 3.49 0.00 5.80 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 64 G 8.41 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 K 7.95 3.97 0.00 1.86 2.09 0.00 1.64 0.00 0.00 1.58 0.00 0.00 2.92 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.46 1.59 7.81 66 K 7.83 3.91 0.00 2.04 1.96 0.00 1.81 0.00 0.00 1.69 0.00 0.00 2.96 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.49 1.50 7.81 67 V 8.09 3.66 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 1.03 0.00 0.00 0.96 0.00 0.00 68 L 8.43 4.34 0.00 1.98 1.87 1.09 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 69 G 8.13 3.68 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 0.00 70 A 8.26 4.11 1.57 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 0.00 0.00 71 F 8.54 4.24 0.00 3.31 3.32 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 72 S 8.74 4.23 0.00 4.32 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 73 D 8.33 4.61 0.00 2.93 2.66 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 0.00 0.00 0.00 0.00 74 G 7.93 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 L 7.35 3.85 0.00 1.63 1.42 0.16 -0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.54 0.00 0.00 0.00 0.00 0.00 0.00 76 A 7.45 4.46 1.14 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 77 H 7.97 4.88 0.00 3.08 3.14 0.00 5.83 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 L 8.01 4.12 0.00 1.50 1.64 0.76 0.96 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 79 D 7.90 4.49 0.00 2.62 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 80 N 8.34 4.98 0.00 2.65 2.58 0.00 0.00 7.16 6.44 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 81 L 7.81 4.04 0.00 1.76 1.84 0.87 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 82 K 8.03 3.94 0.00 1.61 1.52 0.00 1.70 0.00 0.00 1.59 0.00 0.00 3.01 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.38 1.46 7.81 83 G 8.05 3.66 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 T 7.69 3.66 3.95 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 0.37 0.00 0.00 85 F 8.67 4.65 0.00 3.20 2.99 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 86 A 7.87 4.16 1.48 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 87 T 7.87 4.05 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 1.21 0.00 0.00 88 L 7.92 4.03 0.00 1.92 1.96 1.03 1.07 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 89 S 8.43 4.40 0.00 4.18 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 90 E 8.11 3.89 0.00 2.26 1.95 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 2.30 2.48 0.00 91 L 7.97 3.88 0.00 1.89 1.85 0.92 1.11 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 92 H 8.62 4.09 0.00 3.55 3.78 0.00 5.87 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 C 7.76 3.57 0.00 1.23 2.44 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 94 D 8.46 4.32 0.00 2.75 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 95 K 8.04 4.29 0.00 1.77 1.78 0.00 1.54 0.00 0.00 1.68 0.00 0.00 3.05 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.36 1.39 7.81 96 L 7.73 4.04 0.00 1.70 1.61 0.66 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 97 H 7.70 4.21 0.00 3.40 3.44 0.00 5.74 0.00 0.00 0.00 0.00 8.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 7.90 3.48 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 0.04 0.00 0.00 0.36 0.00 0.00 99 D 8.67 4.32 0.00 2.84 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 0.00 100 P 0.00 3.26 0.00 1.90 1.81 0.00 3.35 0.00 0.00 3.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.52 0.00 101 E 8.10 3.83 0.00 2.04 1.92 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 2.33 2.39 0.00 102 A 7.72 3.95 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 0.00 103 F 7.48 4.42 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 0.00 104 R 7.80 4.04 0.00 1.84 1.98 0.00 3.13 0.00 0.00 3.35 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.91 0.00 105 L 7.90 3.80 0.00 1.65 1.24 0.52 -0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 106 L 8.15 4.09 0.00 1.82 1.75 0.93 0.97 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 0.00 107 G 7.97 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 0.00 0.00 0.00 108 N 8.11 4.43 0.00 2.95 2.95 0.00 0.00 6.69 7.05 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 0.00 109 V 7.89 3.60 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 1.15 0.00 0.00 1.17 0.00 0.00 110 L 8.35 3.86 0.00 1.64 1.80 0.87 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 111 V 7.96 3.54 2.32 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 1.31 0.00 0.00 1.19 0.00 0.00 112 C 8.31 4.16 0.00 3.14 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 0.00 113 V 7.95 3.51 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 0.82 0.00 0.00 0.95 0.00 0.00 114 L 8.01 3.89 0.00 0.66 1.04 0.62 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 115 A 7.34 3.73 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 0.00 116 H 8.13 4.06 0.00 3.20 3.55 0.00 5.77 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 H 8.05 4.06 0.00 2.88 2.76 0.00 5.72 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 F 8.61 4.44 0.00 3.37 3.20 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 0.00 119 G 8.68 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 0.00 0.00 0.00 120 K 8.95 3.94 0.00 1.77 1.92 0.00 1.84 0.00 0.00 1.69 0.00 0.00 3.03 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.47 1.42 7.81 121 E 8.34 4.13 0.00 2.32 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 2.41 2.35 0.00 122 F 8.10 4.57 0.00 3.09 3.15 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 0.00 0.00 0.00 0.00 123 T 7.45 4.14 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 1.28 0.00 0.00 124 P 0.00 4.19 0.00 2.16 2.17 0.00 3.59 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 2.22 0.00 125 P 0.00 4.26 0.00 2.11 2.06 0.00 3.47 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.11 0.00 126 V 7.11 3.54 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 0.76 0.00 0.00 0.88 0.00 0.00 127 Q 7.93 3.53 0.00 1.92 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.56 0.00 0.00 0.00 0.00 0.00 2.45 2.64 0.00 128 A 7.88 4.08 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.73 3.86 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 0.00 130 Y 8.17 4.00 0.00 3.44 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 Q 8.77 4.14 0.00 2.22 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.80 0.00 0.00 0.00 0.00 0.00 2.77 2.62 0.00 132 K 7.99 3.99 0.00 1.99 1.83 0.00 1.65 0.00 0.00 1.54 0.00 0.00 2.93 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.58 7.81 133 V 7.78 3.47 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 0.89 0.00 0.00 0.74 0.00 0.00 134 V 8.45 3.81 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 1.10 0.00 0.00 1.12 0.00 0.00 135 A 8.05 4.10 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 0.00 136 G 8.21 3.54 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 0.00 0.00 0.00 137 V 8.01 3.32 1.78 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 0.72 0.00 0.00 0.58 0.00 0.00 138 A 7.86 3.89 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 0.00 0.00 139 N 8.47 4.42 0.00 2.92 2.88 0.00 0.00 6.92 8.18 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 0.00 140 A 8.17 4.03 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 0.00 141 L 8.08 3.93 0.00 1.06 0.51 0.04 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 142 A 7.64 4.87 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 0.00 143 H 7.89 4.25 0.00 3.38 3.68 0.00 5.75 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 K 7.84 4.33 0.00 1.73 1.81 0.00 1.62 0.00 0.00 1.42 0.00 0.00 2.98 0.00 0.00 2.98 0.00 0.00 0.00 0.00 0.93 1.65 7.81 145 Y 7.98 4.26 0.00 3.12 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 0.00 146 H 8.40 4.43 0.00 3.22 3.23 0.00 5.75 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00