NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 M 4.5215 8.3044 120.2865 55.2895 33.8659 174.1564 3 V 4.0861 8.0733 121.7203 59.6215 32.8129 173.3145 4 W 4.4944 9.0830 135.0000 57.4350 31.9391 174.7964 5 T 4.0281 8.1133 122.1947 61.3985 67.2031 172.3887 6 P 4.5624 0.0000 0.0000 63.2054 32.2342 175.6522 7 V 4.0465 7.4147 119.5662 62.9193 32.8285 175.3497 8 N 4.1846 8.5954 124.6810 54.8903 36.0600 173.3874 9 N 5.0447 7.5598 108.8006 53.0159 40.1274 174.1843 10 K 4.1812 8.3587 116.0194 56.4547 32.8007 176.3950 11 M 5.0898 8.3182 120.1685 53.9818 35.6050 175.3937 12 F 4.6624 8.3367 116.2847 57.2807 41.1551 176.3903 13 E 3.4719 8.3178 123.2112 57.2960 28.0207 175.9494 14 T 3.8175 8.3625 122.9915 66.2502 68.7128 174.1943 15 F 4.4091 8.9344 123.4270 57.8870 36.4165 176.3796 16 S 4.5155 8.2450 115.0290 60.1262 63.1397 174.4254 17 Y 4.4536 8.2716 117.4314 58.1110 38.2778 175.1418 18 L 4.7199 7.4817 120.1487 52.1078 43.6653 174.5708 19 P 4.4156 0.0000 0.0000 62.0576 31.8025 174.9764 20 P 4.3539 0.0000 0.0000 62.6263 31.8223 176.4689 21 L 3.9871 8.2891 122.4374 54.7600 42.1398 178.0425 22 T 4.2725 8.1739 114.1990 61.1085 71.2471 175.4032 23 D 4.3242 8.4474 120.3312 57.4105 40.7708 178.5932 24 E 3.9257 8.1167 119.4533 59.2635 29.7911 178.8101 25 Q 3.9129 7.8624 117.8093 58.8142 28.7195 178.5397 26 I 3.7433 8.0644 120.9521 64.2893 37.1207 178.1736 27 A 4.0098 8.2630 121.4940 55.2593 18.2143 179.5139 28 A 3.9636 8.0323 119.1221 55.5118 18.4406 179.9474 29 Q 4.1200 8.0552 116.1935 59.0544 28.7744 179.0449 30 V 3.7500 8.2495 119.5220 66.1073 31.5766 177.7976 31 D 4.3875 8.4218 118.7394 57.5141 40.4444 177.9823 32 Y 4.2100 8.2247 119.9473 60.8502 38.8305 178.2366 33 I 3.9780 8.0076 120.5493 64.6998 37.3498 178.6661 34 V 3.5591 7.8768 118.6688 65.8937 31.1490 177.8643 35 A 3.9354 8.2855 119.9092 54.5939 18.2584 178.3698 36 N 4.0857 7.1008 112.2294 52.2167 38.7413 175.7431 37 G 3.7399 7.2593 108.2758 46.0506 0.0000 173.9900 38 W 4.9957 7.4644 118.6393 55.9654 30.7577 176.3259 39 I 4.3963 8.8047 123.1348 59.4082 37.9145 174.0391 40 P 4.8484 0.0000 0.0000 62.9464 32.8631 175.2045 41 C 4.9873 8.8194 120.9941 58.4824 35.6819 172.4430 42 L 5.3343 8.7348 124.6217 53.2704 44.2181 175.1876 43 E 5.6052 9.1686 121.2638 54.9383 34.1959 174.5540 44 F 5.5931 9.0506 116.0104 55.8717 42.1021 173.0646 45 A 4.4937 8.3971 120.8474 50.0307 22.6123 176.2223 46 E 4.2314 8.7408 119.3492 55.8550 30.6094 177.6383 47 A 4.3071 8.9177 123.1012 55.9261 18.3951 179.9227 48 D 4.4849 8.1468 113.3480 56.5067 41.1004 177.2616 49 K 4.5951 7.8983 117.0316 56.0891 32.3884 176.9430 50 A 3.9760 7.6880 124.5744 53.9651 19.0590 178.3369 51 Y 4.6134 7.4619 111.4270 55.7065 39.9159 175.7668 52 V 3.8237 8.3173 122.5174 63.8896 31.9732 175.2430 53 S 4.7352 8.8462 119.5491 57.7118 66.2037 173.7591 54 N 5.1807 8.5821 114.2983 52.5229 39.2829 176.2979 55 E 3.9434 8.2881 118.9386 59.7103 29.4029 179.0745 56 S 4.0875 8.9414 115.6567 60.5720 62.8440 175.9317 57 A 2.5800 7.7446 123.4058 53.5047 17.7724 179.0190 58 I 3.5311 6.8967 115.8145 63.6217 38.0105 177.0639 59 R 4.3006 7.4131 116.3229 55.6065 30.5529 176.2164 60 F 5.0851 7.2103 118.1198 55.9581 41.3179 177.3598 61 G 4.0298 8.2460 116.9947 46.3500 0.0000 175.7412 62 S 4.6140 8.4399 114.3559 58.5092 62.0337 174.4358 63 V 4.4338 7.2504 107.2265 61.1539 33.0851 177.6791 64 S 4.4935 8.2078 115.0357 59.5400 63.5770 173.4990 65 C 3.9840 8.1105 119.0990 61.6349 27.9733 173.1553 66 L 3.6950 8.4647 123.1826 55.6410 39.0423 173.1785 67 Y 4.4557 7.6129 118.9876 55.9467 40.1956 174.6151 68 Y 4.8133 6.9945 123.0759 56.4167 42.3566 174.6894 69 D 4.4364 8.9378 124.1374 55.5823 41.5685 176.8309 70 N 4.4249 8.9106 117.0458 54.1916 35.9839 176.0274 71 R 3.9284 7.9618 118.6834 59.3520 30.3460 177.1845 72 Y 4.3782 7.6134 114.5785 57.9640 38.3440 175.2596 73 W 5.0488 8.6959 124.1229 55.4344 32.6917 174.4771 74 T 4.3168 8.0506 117.1316 62.4013 69.4616 174.6492 75 M 4.5975 8.5590 126.9757 55.3953 33.1318 175.1791 76 W 4.8106 9.6592 135.0000 56.3162 31.3993 177.0352 77 K 3.4173 8.4968 128.6952 57.4959 30.9342 178.1322 78 L 4.9394 8.3035 124.3351 52.6683 45.1692 174.0180 79 P 4.3769 0.0000 0.0000 63.3110 32.1620 177.5399 80 M 4.3049 8.5225 123.1970 53.7162 30.4345 175.4898 81 F 4.4394 7.5606 119.1540 58.6074 40.0464 176.2346 82 G 3.9314 9.1008 111.9826 45.8498 0.0000 172.9534 83 C 4.2933 7.9447 120.3398 59.5163 31.5667 173.3926 84 R 4.5907 8.6013 125.8746 55.6209 30.5574 175.0381 85 D 4.6202 7.8368 117.6154 51.1658 43.3264 173.9529 86 P 4.3133 0.0000 0.0000 65.9503 31.2645 178.4793 87 M 4.0869 8.2493 117.1285 58.3664 32.0042 178.1781 88 Q 4.0028 7.8634 119.5080 59.2752 29.1601 178.8479 89 V 3.6336 7.7428 118.5997 66.0342 31.8135 177.8348 90 L 4.0249 7.9668 118.7801 57.8719 41.3849 179.6900 91 R 3.9599 8.4474 118.4411 59.4110 29.9272 179.0203 92 E 4.1010 8.2324 118.0246 59.2274 29.4167 179.2724 93 I 3.5230 7.8503 120.0371 64.3183 37.1657 178.5462 94 V 3.4546 7.6388 118.3725 65.9428 31.4204 177.8342 95 A 3.9283 8.0297 120.5529 55.2552 18.2117 179.2310 96 C 2.0000 7.6581 117.5888 62.1013 31.3583 175.9813 97 T 3.7800 7.6236 111.2301 64.1790 68.0100 176.5841 98 K 3.8146 7.5803 121.9395 59.3986 32.3663 178.4122 99 A 3.9546 7.6129 119.6547 53.6388 19.6626 177.6417 100 F 4.6868 7.6712 115.6269 55.0021 39.1911 173.8402 101 P 4.4518 0.0000 0.0000 64.1432 31.9030 177.9196 102 D 4.6939 8.0777 116.8632 53.8660 41.2064 175.3725 103 A 4.7420 7.2671 121.2550 50.3638 21.3401 177.0714 104 Y 4.2294 8.5876 118.1986 57.8241 39.3180 175.1664 105 V 5.1889 8.9614 123.8530 61.0801 35.0345 174.3483 106 R 5.0285 9.3890 123.5680 54.2922 33.0941 173.7056 107 L 4.8451 8.1048 123.3411 53.8663 43.9423 175.6755 108 V 4.8967 8.7195 118.2680 59.6216 36.5985 174.0710 109 A 4.8369 7.9906 121.5684 50.5387 22.8638 175.1917 110 F 5.2535 8.8650 119.2062 55.7092 42.6728 174.1302 111 D 5.3460 8.7600 122.7376 52.7827 42.2139 176.6614 112 N 4.7174 9.1504 123.3346 54.4758 38.4180 176.5443 113 Q 4.1643 8.5891 118.5484 58.9868 28.8729 177.6207 114 K 4.0543 8.3178 114.6433 56.8700 32.9925 176.5638 115 Q 3.3924 7.9941 117.8936 55.8988 27.0652 172.6499 116 V 4.4881 7.8039 117.2682 59.9781 34.9941 174.1237 117 Q 4.4514 8.7604 123.4371 56.5615 29.2648 175.5193 118 I 4.1724 8.1797 125.3143 61.4433 39.5688 174.4077 119 M 4.5677 6.6546 117.5158 54.2452 34.3919 173.6829 120 G 4.8092 8.2677 107.6059 47.2628 0.0000 172.2430 121 F 5.0016 7.0031 115.6026 55.2989 41.0939 172.7640 122 L 4.5354 8.8443 122.9570 55.5887 41.9140 176.7672 123 V 4.5088 8.9204 118.6757 61.5289 34.1392 175.7488 124 Q 4.6151 7.8553 121.1211 54.3125 32.4814 173.3897 125 R 4.3805 8.1486 121.5968 52.9353 32.6249 173.5984 126 P 4.1925 0.0000 0.0000 62.7458 31.7368 177.6477 127 K 4.0598 8.4630 119.8573 59.3365 32.1332 178.1052 128 T 4.1679 7.7590 106.5163 61.9357 69.4010 174.7042 129 A 4.2395 7.7580 126.5046 52.8951 18.5937 177.4305 130 R 4.6297 8.8399 120.9478 56.0740 31.2597 175.6280 131 D 4.9411 8.4367 116.6453 52.7708 39.7133 175.4728 132 F 5.3438 7.8210 112.9063 55.5160 41.0368 173.7060 133 Q 4.3902 8.3655 120.0944 52.9996 31.4790 174.1799 134 P 4.4799 0.0000 0.0000 62.3139 32.6435 176.9722 135 A 3.9574 8.8958 123.6331 55.6761 18.1496 179.6329 136 N 4.5640 8.0886 109.5916 54.4192 37.7659 175.6072 137 K 4.3903 7.7548 117.8679 56.3027 32.5639 177.5424 138 R 3.5719 7.7411 121.3022 57.8013 30.1117 176.7890 139 S 5.1026 7.5063 110.0917 56.2783 65.9117 174.2265 140 V 3.9806 8.5446 114.8553 61.6955 31.9074 175.6434 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 M 8.30 4.52 0.00 1.98 2.15 0.00 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.58 0.00 3 V 8.07 4.09 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 1.10 0.00 0.00 0.97 0.00 0.00 4 W 9.08 4.49 0.00 3.43 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 5 T 8.11 4.03 4.09 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 0.00 0.00 0.00 0.99 0.00 0.00 6 P 0.00 4.56 0.00 2.23 2.19 0.00 3.79 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 1.96 1.96 0.00 7 V 7.41 4.05 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 0.77 0.00 0.00 0.91 0.00 0.00 8 N 8.60 4.18 0.00 2.89 2.88 0.00 0.00 6.77 8.00 0.00 0.00 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 N 7.56 5.04 0.00 2.66 2.68 0.00 0.00 7.30 6.68 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 10 K 8.36 4.18 0.00 1.93 1.54 0.00 0.61 0.00 0.00 1.11 0.00 0.00 2.52 0.00 0.00 2.56 0.00 0.00 0.00 0.00 1.32 1.37 7.81 11 M 8.32 5.09 0.00 2.12 2.11 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.67 0.00 12 F 8.34 4.66 0.00 3.13 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 13 E 8.32 3.47 0.00 2.13 1.64 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 2.21 2.14 0.00 14 T 8.36 3.82 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 15 F 8.93 4.41 0.00 3.30 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 16 S 8.25 4.52 0.00 4.17 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 0.00 17 Y 8.27 4.45 0.00 3.01 3.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 L 7.48 4.72 0.00 1.76 1.61 0.91 1.38 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 19 P 0.00 4.42 0.00 2.03 2.01 0.00 3.70 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.14 0.00 20 P 0.00 4.35 0.00 2.04 2.01 0.00 3.70 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.17 0.00 21 L 8.29 3.99 0.00 1.59 1.50 0.27 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 22 T 8.17 4.27 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 1.18 0.00 0.00 23 D 8.45 4.32 0.00 2.70 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 E 8.12 3.93 0.00 2.02 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 2.35 2.39 0.00 25 Q 7.86 3.91 0.00 2.32 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.58 0.00 0.00 0.00 0.00 0.00 2.25 2.32 0.00 26 I 8.06 3.74 2.05 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 1.65 0.72 1.09 0.00 0.00 27 A 8.26 4.01 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 28 A 8.03 3.96 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 29 Q 8.06 4.12 0.00 2.48 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.75 0.00 0.00 0.00 0.00 0.00 2.38 1.95 0.00 30 V 8.25 3.75 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 1.15 0.00 0.00 1.07 0.00 0.00 31 D 8.42 4.39 0.00 3.08 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 Y 8.22 4.21 0.00 3.18 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 33 I 8.01 3.98 2.16 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.31 1.09 0.00 0.00 34 V 7.88 3.56 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 1.00 0.00 0.00 1.01 0.00 0.00 35 A 8.29 3.94 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 N 7.10 4.09 0.00 1.44 1.42 0.00 0.00 7.04 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 37 G 7.26 3.74 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 0.00 0.00 0.00 38 W 7.46 5.00 0.00 3.38 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 39 I 8.80 4.40 2.10 0.00 0.00 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 1.46 0.98 0.71 0.00 0.00 40 P 0.00 4.85 0.00 2.09 1.98 0.00 3.81 0.00 0.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.13 0.00 41 C 8.82 4.99 0.00 3.07 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 42 L 8.73 5.33 0.00 1.87 1.64 0.91 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 43 E 9.17 5.61 0.00 2.11 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 2.33 0.00 44 F 9.05 5.59 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 45 A 8.40 4.49 -0.27 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 46 E 8.74 4.23 0.00 2.18 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 0.00 2.31 2.29 0.00 47 A 8.92 4.31 1.50 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 0.00 0.00 48 D 8.15 4.48 0.00 2.71 2.78 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 49 K 7.90 4.60 0.00 1.54 1.71 0.00 1.71 0.00 0.00 1.84 0.00 0.00 2.99 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.35 1.44 7.81 50 A 7.69 3.98 0.66 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 51 Y 7.46 4.61 0.00 2.93 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 V 8.32 3.82 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 0.64 0.00 0.00 0.76 0.00 0.00 53 S 8.85 4.74 0.00 4.06 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 54 N 8.58 5.18 0.00 2.76 2.85 0.00 0.00 6.57 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 55 E 8.29 3.94 0.00 2.15 2.24 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 2.39 2.38 0.00 56 S 8.94 4.09 0.00 4.03 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 57 A 7.74 2.58 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 58 I 6.90 3.53 1.78 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.81 0.84 0.00 0.00 59 R 7.41 4.30 0.00 1.89 1.99 0.00 3.19 0.00 0.00 3.21 7.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.57 0.00 60 F 7.21 5.09 0.00 2.99 2.78 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 61 G 8.25 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 62 S 8.44 4.61 0.00 3.86 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 63 V 7.25 4.43 1.83 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 0.66 0.00 0.00 0.48 0.00 0.00 64 S 8.21 4.49 0.00 4.10 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 0.00 65 C 8.11 3.98 0.00 2.96 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 66 L 8.46 3.69 0.00 1.78 1.77 0.94 0.96 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 67 Y 7.61 4.46 0.00 2.92 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 68 Y 6.99 4.81 0.00 2.79 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 69 D 8.94 4.44 0.00 2.88 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 70 N 8.91 4.42 0.00 3.06 3.25 0.00 0.00 6.99 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 71 R 7.96 3.93 0.00 1.49 1.69 0.00 3.08 0.00 0.00 3.26 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.56 0.00 72 Y 7.61 4.38 0.00 3.06 2.87 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 73 W 8.70 5.05 0.00 3.07 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 74 T 8.05 4.32 2.87 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 0.93 0.00 0.00 75 M 8.56 4.60 0.00 2.07 2.03 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.79 0.00 76 W 9.66 4.81 0.00 3.69 3.31 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 77 K 8.50 3.42 0.00 1.64 0.74 0.00 1.40 0.00 0.00 1.56 0.00 0.00 2.79 0.00 0.00 2.47 0.00 0.00 0.00 0.00 0.95 0.33 7.81 78 L 8.30 4.94 0.00 1.61 1.61 1.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 79 P 0.00 4.38 0.00 0.65 1.84 0.00 3.68 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.14 0.00 80 M 8.52 4.30 0.00 2.05 2.01 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.54 0.00 81 F 7.56 4.44 0.00 3.10 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 82 G 9.10 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 83 C 7.94 4.29 0.00 3.00 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 84 R 8.60 4.59 0.00 1.81 1.87 0.00 3.22 0.00 0.00 3.16 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.79 0.00 85 D 7.84 4.62 0.00 2.70 2.50 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 86 P 0.00 4.31 0.00 2.22 2.12 0.00 3.67 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.20 0.00 87 M 8.25 4.09 0.00 2.04 2.26 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.56 0.00 88 Q 7.86 4.00 0.00 2.23 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.82 0.00 0.00 0.00 0.00 0.00 2.40 2.41 0.00 89 V 7.74 3.63 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 1.04 0.00 0.00 0.97 0.00 0.00 90 L 7.97 4.02 0.00 1.91 1.72 0.95 1.04 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 91 R 8.45 3.96 0.00 2.01 2.02 0.00 3.15 0.00 0.00 3.18 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.84 0.00 92 E 8.23 4.10 0.00 2.24 2.17 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 2.62 2.65 0.00 93 I 7.85 3.52 1.98 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 1.34 0.74 0.85 0.00 0.00 94 V 7.64 3.45 2.20 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 0.97 0.00 0.00 0.97 0.00 0.00 95 A 8.03 3.93 1.52 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 96 C 7.66 2.00 0.00 1.23 2.37 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 97 T 7.62 3.78 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 1.15 0.00 0.00 98 K 7.58 3.81 0.00 1.83 1.96 0.00 1.76 0.00 0.00 1.67 0.00 0.00 2.99 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.38 1.38 7.81 99 A 7.61 3.95 1.10 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 0.00 100 F 7.67 4.69 0.00 2.81 2.78 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 0.00 101 P 0.00 4.45 0.00 2.12 2.11 0.00 3.25 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.87 0.00 102 D 8.08 4.69 0.00 2.68 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 0.00 103 A 7.27 4.74 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 Y 8.59 4.23 0.00 2.55 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 V 8.96 5.19 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 1.01 0.00 0.00 0.88 0.00 0.00 106 R 9.39 5.03 0.00 1.85 1.93 0.00 2.31 0.00 0.00 2.25 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.34 0.00 107 L 8.10 4.85 0.00 1.50 0.75 0.90 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 108 V 8.72 4.90 1.65 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 0.48 0.00 0.00 0.54 0.00 0.00 109 A 7.99 4.84 1.15 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 0.00 0.00 110 F 8.86 5.25 0.00 3.02 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 0.00 111 D 8.76 5.35 0.00 2.41 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 0.00 112 N 9.15 4.72 0.00 2.94 3.06 0.00 0.00 6.33 7.39 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 0.00 113 Q 8.59 4.16 0.00 2.33 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 7.01 0.00 0.00 0.00 0.00 0.00 2.47 2.54 0.00 114 K 8.32 4.05 0.00 1.76 1.87 0.00 2.14 0.00 0.00 1.62 0.00 0.00 2.94 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.45 1.46 7.81 115 Q 7.99 3.39 0.00 2.11 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.70 0.00 0.00 0.00 0.00 0.00 2.25 2.31 0.00 116 V 7.80 4.49 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 0.57 0.00 0.00 0.92 0.00 0.00 117 Q 8.76 4.45 0.00 2.19 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.90 0.00 0.00 0.00 0.00 0.00 2.20 2.00 0.00 118 I 8.18 4.17 1.20 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 -0.30 0.29 -0.51 0.00 0.00 119 M 6.65 4.57 0.00 2.15 2.25 0.00 0.00 0.00 0.00 0.00 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.73 0.00 120 G 8.27 4.81 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 0.00 0.00 0.00 121 F 7.00 5.00 0.00 3.22 3.29 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 0.00 122 L 8.84 4.54 0.00 1.61 1.62 0.76 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 123 V 8.92 4.51 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 0.70 0.00 0.00 0.92 0.00 0.00 124 Q 7.86 4.62 0.00 1.99 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.83 0.00 0.00 0.00 0.00 0.00 2.25 2.23 0.00 125 R 8.15 4.38 0.00 1.28 1.52 0.00 2.21 0.00 0.00 2.90 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 1.26 0.00 126 P 0.00 4.19 0.00 2.10 2.16 0.00 2.20 0.00 0.00 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.58 0.00 127 K 8.46 4.06 0.00 1.74 1.92 0.00 1.72 0.00 0.00 1.74 0.00 0.00 3.00 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.44 1.39 7.81 128 T 7.76 4.17 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 1.22 0.00 0.00 129 A 7.76 4.24 1.54 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 0.00 130 R 8.84 4.63 0.00 1.81 1.90 0.00 3.18 0.00 0.00 3.28 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.80 0.00 131 D 8.44 4.94 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 0.00 132 F 7.82 5.34 0.00 3.22 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 0.00 133 Q 8.37 4.39 0.00 1.85 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 7.05 0.00 0.00 0.00 0.00 0.00 2.34 2.03 0.00 134 P 0.00 4.48 0.00 2.20 2.18 0.00 3.54 0.00 0.00 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.87 0.00 135 A 8.90 3.96 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 0.00 136 N 8.09 4.56 0.00 2.83 2.95 0.00 0.00 5.92 7.13 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 0.00 137 K 7.75 4.39 0.00 1.63 1.72 0.00 1.61 0.00 0.00 1.64 0.00 0.00 2.90 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.32 1.30 7.81 138 R 7.74 3.57 0.00 1.74 0.66 0.00 3.08 0.00 0.00 3.14 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 1.17 0.00 139 S 7.51 5.10 0.00 4.01 3.94 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 0.00 140 V 8.54 3.98 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 0.61 0.00 0.00 0.95 0.00 0.00