NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 V 4.0943 8.0549 120.3910 62.4234 32.6610 175.1740 2 L 3.9720 8.2655 127.2845 52.5170 42.2366 176.0027 3 S 4.5241 9.7923 119.3439 57.7037 66.1915 175.1026 4 E 4.2719 8.8258 121.5136 59.6855 29.1946 179.8589 5 G 3.6458 8.1224 105.1744 47.7937 0.0000 175.4008 6 E 3.8919 8.2204 120.8889 59.0366 29.4088 179.4112 7 W 4.4497 8.2424 119.1579 59.9723 29.1163 178.3336 8 Q 4.1017 8.6441 119.7214 59.1525 28.5183 178.3292 9 L 4.0798 8.0216 120.0844 57.6773 41.6346 179.5941 10 V 3.7562 8.0117 118.0956 66.2885 31.6328 178.0706 11 L 4.3371 8.5728 118.3946 57.2277 41.2887 178.9723 12 H 4.2277 8.3137 118.4624 59.2301 30.2552 177.3257 13 V 3.7394 7.8821 120.6487 64.5497 31.2873 178.1149 14 W 3.8100 8.6422 128.8773 60.0233 30.0267 177.7953 15 A 4.0251 8.2805 120.8060 54.9078 17.5886 179.7554 16 K 3.5912 7.6904 117.0985 59.3490 31.9610 179.7388 17 V 3.0112 7.0104 118.7143 65.4218 31.0492 177.2965 18 E 3.9941 6.9325 115.1719 57.3474 29.3817 178.2063 19 A 4.1654 7.4324 121.0443 53.7925 20.0823 177.7206 20 D 4.6447 7.9518 116.0971 52.2418 43.0188 175.6089 21 V 3.3927 7.8259 123.9338 66.0425 32.0591 176.7979 22 A 4.0551 7.9990 120.0494 55.0364 18.2546 179.7258 23 G 3.6766 8.4721 104.3324 46.0160 0.0000 175.6898 24 H 4.1309 8.2393 118.8464 58.5680 28.6607 178.1432 25 G 3.5595 8.3019 107.6507 47.7612 0.0000 175.7107 26 Q 3.8653 8.1716 120.5598 58.8791 28.7519 178.7603 27 D 4.2836 7.9723 119.7457 57.2887 40.7489 179.0436 28 I 3.6357 7.9467 120.5503 64.4155 37.0959 178.5081 29 L 3.3980 7.7862 119.8678 57.5521 41.2178 179.7187 30 I 3.5531 7.6425 119.8978 64.1932 36.9659 178.3758 31 R 3.7688 7.9303 119.5727 59.2118 29.9075 178.0942 32 L 3.9438 7.8432 120.1483 58.5005 41.7803 179.1405 33 F 4.5852 8.0916 117.7465 60.4548 38.5519 178.0234 34 K 4.0196 8.1735 117.6707 59.6650 32.0334 179.4439 35 S 4.2949 8.2136 114.3735 60.3151 64.0411 174.6064 36 H 4.6662 8.0395 118.4016 52.2403 29.5867 171.9463 37 P 4.5102 0.0000 0.0000 64.3035 31.6386 177.4547 38 E 4.0803 8.2292 116.5314 59.4113 29.2938 179.1724 39 T 4.1173 8.2369 111.5600 64.6383 68.8642 176.4572 40 L 3.6266 7.8950 123.3339 57.7039 41.8052 178.5131 41 E 3.9994 7.7248 117.2205 58.7384 29.6271 178.3540 42 K 4.4574 8.0696 117.0417 56.9918 32.6353 177.3308 43 F 4.6549 8.2655 119.4264 55.5088 39.6289 175.6114 44 D 4.4028 8.6345 124.6000 57.1296 40.9931 178.6377 45 R 3.8106 7.9297 118.1245 58.2635 30.2332 176.6747 46 F 5.0542 8.0695 114.2058 56.8047 40.8716 176.5505 47 K 4.1637 8.1225 118.7379 58.3236 32.5521 177.5364 48 H 4.3730 8.0536 114.9351 57.5447 28.9456 175.4905 49 L 4.1600 7.6466 121.7609 54.4886 41.7178 176.7581 50 K 4.5427 9.5045 122.2409 55.8619 34.4352 176.5648 51 T 4.7450 7.5183 108.5517 58.8732 73.1628 174.1527 52 E 3.9112 8.6713 121.7380 59.4016 29.6749 178.8696 53 A 3.9990 7.9582 120.3831 55.1978 18.2617 179.2973 54 E 3.9347 8.1615 116.1985 59.7026 29.9467 179.1078 55 M 4.1873 8.1346 118.6913 58.5463 31.8724 179.0967 56 K 3.9956 8.2593 117.1769 58.9426 32.2665 178.5351 57 A 4.4341 7.6911 119.0381 51.9595 19.1200 177.1045 58 S 4.3517 7.5352 113.4371 57.2124 62.5724 174.3941 59 E 4.0048 8.8517 129.5409 59.3157 29.4098 177.9695 60 D 4.4199 8.1910 117.8643 57.1571 41.2765 177.8221 61 L 3.4414 8.1566 121.0915 57.7232 42.1540 178.8086 62 K 3.8606 7.9600 119.3708 59.4084 32.1343 178.8732 63 K 4.0020 8.3760 118.9909 59.8965 31.9366 178.8661 64 H 4.4468 8.7546 118.7048 59.0507 29.7270 177.3848 65 G 3.6079 8.4162 108.1352 47.8320 0.0000 175.8351 66 V 3.6083 7.7533 120.1197 65.9157 31.5654 178.1004 67 T 3.8809 7.8725 115.5607 66.7290 68.3618 176.6187 68 V 3.5854 7.9373 120.0364 66.2135 31.6013 178.1651 69 L 4.2700 8.2166 118.6472 57.8203 41.4285 179.6804 70 T 3.9686 8.3970 116.2080 66.5770 68.3956 176.5309 71 A 4.0160 8.0099 122.7046 55.0216 18.3659 179.4889 72 L 3.7245 8.1213 119.0307 58.0885 42.1478 179.3533 73 G 3.2231 8.4630 105.9094 47.6177 0.0000 175.4797 74 A 3.9895 7.8006 122.1510 54.8249 18.6644 179.5669 75 I 3.7792 7.6142 118.2824 64.6071 37.1521 178.6516 76 L 3.9949 7.9308 120.1523 57.6945 41.1954 179.5094 77 K 3.9638 7.7694 116.5596 58.1322 32.2195 178.5917 78 K 3.9845 7.8862 118.3965 55.7877 32.5895 176.5432 79 K 2.0000 8.4055 118.4464 56.3407 29.8020 175.7656 80 G 3.9158 7.9746 106.3449 45.7235 0.0000 173.9843 81 H 4.5590 7.4937 119.2706 55.3907 27.6095 174.9291 82 H 5.2472 7.3516 110.6101 54.4106 29.8702 176.1387 83 E 3.9279 8.6413 122.4672 60.3192 29.0115 178.7087 84 A 4.0601 7.9469 118.4730 55.0734 18.4827 178.9076 85 E 4.1336 8.1104 116.7949 59.2971 29.7338 179.0286 86 L 4.1792 8.2077 118.9752 57.0793 41.6158 178.9968 87 K 3.8579 7.9576 118.8415 59.4886 31.9997 177.3042 88 P 4.2407 0.0000 0.0000 65.6004 31.3226 178.1980 89 L 3.9672 7.5357 120.0879 57.9611 42.0416 178.7771 90 A 4.1262 8.6408 121.0534 55.2379 18.2750 179.5133 91 Q 3.7811 8.2638 116.9134 59.2186 28.8241 179.4602 92 S 3.9733 8.2532 115.3057 61.7030 62.9979 176.2216 93 H 4.1640 8.6423 119.9106 58.2650 28.2300 177.7430 94 A 2.9759 7.7628 122.3587 54.7271 18.1810 179.1074 95 T 3.7466 7.2031 105.8654 62.1669 69.6034 175.4465 96 K 4.1917 7.4264 120.4265 58.3224 33.2986 176.9151 97 H 4.3274 8.1150 114.1218 56.0988 29.3767 175.3875 98 K 3.7773 7.6663 117.2225 57.3917 28.8523 176.2123 99 I 4.2078 7.9107 119.2579 58.8169 38.3767 175.0690 100 P 4.4309 0.0000 0.0000 62.2484 32.0417 177.5668 101 I 3.3640 8.3710 122.0222 64.5680 36.8793 178.4992 102 K 3.6741 7.9062 119.7401 59.7297 31.9314 178.2118 103 Y 4.1042 8.0618 116.8041 60.6069 37.7346 178.1786 104 L 4.1826 7.8976 120.4527 57.4380 41.6596 178.9186 105 E 3.9559 7.9064 119.0269 59.2445 29.6454 178.6432 106 F 4.4788 7.7312 117.7798 60.8925 38.9479 177.6058 107 I 3.8862 8.1852 118.0243 63.9793 37.7433 178.0576 108 S 4.1976 8.3149 116.4179 61.5751 62.6084 176.4509 109 E 4.0634 8.5746 121.1461 59.2964 29.1730 179.2122 110 A 4.0239 8.1522 120.8370 55.1406 18.3817 179.6217 111 I 3.6759 8.1391 118.6385 64.7459 37.2660 178.7048 112 I 3.8565 7.9742 120.4677 64.6131 36.9192 177.9866 113 H 4.1455 8.4720 119.0650 59.4390 29.6847 177.5512 114 V 3.5803 8.0395 120.0924 65.9201 31.3322 177.9563 115 L 3.7610 8.0376 119.0147 57.7598 41.0442 178.9847 116 H 4.4168 8.0087 117.4038 59.4158 29.9521 177.2393 117 S 4.1736 7.9262 115.8209 61.6547 62.7925 176.5210 118 R 4.0576 7.8770 118.9075 57.5674 31.1019 176.4036 119 H 5.0352 8.1457 116.1576 53.9335 30.0036 173.0570 120 P 4.2983 0.0000 0.0000 65.8404 31.6699 179.2577 121 G 3.6911 8.1445 106.5194 47.5088 0.0000 173.6205 122 D 5.0609 8.1205 117.8690 53.9984 41.4774 176.3172 123 F 5.0096 8.0188 121.2196 56.2890 39.7056 174.9006 124 G 3.8719 8.0290 107.3534 44.0861 0.0000 172.9786 125 A 3.9367 8.4093 120.8839 54.8459 18.2546 179.4267 126 D 4.1984 8.0076 117.0880 56.8568 39.3619 178.7802 127 A 3.9835 7.7591 122.0636 54.3899 18.3558 179.4169 128 Q 3.1665 7.8770 117.2901 58.7975 28.6751 179.3092 129 G 3.4698 8.2926 106.9076 47.5360 0.0000 175.7303 130 A 3.8530 7.9973 123.1358 55.1718 18.3402 179.4573 131 M 4.0076 8.4582 117.2155 58.6818 32.2553 177.9190 132 N 4.3223 8.5240 117.7043 56.5737 39.0138 177.0258 133 K 3.9057 8.2128 119.7747 59.3410 32.1246 179.2060 134 A 3.8397 8.1078 121.3055 55.1448 18.2467 179.7349 135 L 4.1182 8.3309 117.7688 57.6818 41.6855 179.5057 136 E 3.9818 8.6312 119.2961 59.2568 29.3511 179.0248 137 L 3.9836 8.2557 120.6418 58.0216 42.0911 178.5272 138 F 4.1247 8.3614 120.5916 61.7037 39.2623 177.4302 139 R 3.5429 8.2861 117.4717 58.8056 29.8024 178.8882 140 K 3.8147 8.4732 119.8220 59.8118 31.8600 178.6486 141 D 4.3657 8.2227 119.0957 57.2627 40.6587 178.8713 142 I 3.5725 7.7088 120.4216 64.1266 36.9135 178.2827 143 A 3.7234 8.2221 121.8948 54.9510 18.1575 179.5156 144 A 3.9557 7.9644 119.3654 55.2586 18.4552 180.0925 145 K 4.0122 7.8618 116.6765 59.6898 32.0821 179.1096 146 Y 4.0611 8.5774 117.5369 61.0417 37.8043 178.7525 147 K 3.9850 8.5695 120.8128 59.3483 32.0842 178.0395 148 E 3.9178 7.9904 118.5561 59.6267 29.6422 178.5350 149 L 4.4165 7.7559 115.0313 55.0711 41.9225 177.5098 150 G 3.7994 8.2247 107.2228 46.3284 0.0000 173.6748 151 Y 4.6260 8.2679 114.0443 57.1604 39.2229 176.7558 152 Q 4.1515 8.2648 122.6878 57.6671 29.5769 175.9958 153 G 4.0494 8.2492 110.3407 45.6460 0.0000 173.0080 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 V 8.05 4.09 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 1.06 0.00 0.00 0.95 0.00 0.00 2 L 8.27 3.97 0.00 0.68 0.64 0.55 -0.62 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 3 S 9.79 4.52 0.00 4.02 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 4 E 8.83 4.27 0.00 2.07 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 0.00 2.50 2.39 0.00 5 G 8.12 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 6 E 8.22 3.89 0.00 1.94 1.72 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 2.21 2.27 0.00 7 W 8.24 4.45 0.00 3.57 3.17 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 8 Q 8.64 4.10 0.00 2.29 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.81 0.00 0.00 0.00 0.00 0.00 2.42 2.48 0.00 9 L 8.02 4.08 0.00 1.96 1.75 0.92 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 10 V 8.01 3.76 2.49 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 1.24 0.00 0.00 0.90 0.00 0.00 11 L 8.57 4.34 0.00 1.85 1.82 0.93 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 12 H 8.31 4.23 0.00 3.33 3.57 0.00 5.95 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 V 7.88 3.74 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 0.99 0.00 0.00 0.80 0.00 0.00 14 W 8.64 3.81 0.00 3.69 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 15 A 8.28 4.03 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 K 7.69 3.59 0.00 1.41 1.54 0.00 1.60 0.00 0.00 1.45 0.00 0.00 2.70 0.00 0.00 3.22 0.00 0.00 0.00 0.00 1.46 1.43 7.81 17 V 7.01 3.01 0.78 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 -0.17 0.00 0.00 0.20 0.00 0.00 18 E 6.93 3.99 0.00 1.68 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 2.19 1.97 0.00 19 A 7.43 4.17 1.26 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 0.00 0.00 20 D 7.95 4.64 0.00 2.65 2.52 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 21 V 7.83 3.39 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 1.06 0.00 0.00 0.84 0.00 0.00 22 A 8.00 4.06 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 G 8.47 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 24 H 8.24 4.13 0.00 3.29 3.24 0.00 5.82 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 25 G 8.30 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 26 Q 8.17 3.87 0.00 2.20 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.75 0.00 0.00 0.00 0.00 0.00 2.30 2.47 0.00 27 D 7.97 4.28 0.00 2.74 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 28 I 7.95 3.64 1.87 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 1.51 0.64 0.88 0.00 0.00 29 L 7.79 3.40 0.00 1.22 0.69 0.73 0.55 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 30 I 7.64 3.55 1.84 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.61 0.87 0.00 0.00 31 R 7.93 3.77 0.00 1.89 2.03 0.00 3.06 0.00 0.00 2.98 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.62 0.00 32 L 7.84 3.94 0.00 1.79 1.53 1.10 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 33 F 8.09 4.59 0.00 3.13 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 34 K 8.17 4.02 0.00 1.74 1.83 0.00 1.69 0.00 0.00 1.67 0.00 0.00 3.00 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.48 1.66 7.81 35 S 8.21 4.29 0.00 3.73 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 36 H 8.04 4.67 0.00 3.03 2.74 0.00 5.62 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 P 0.00 4.51 0.00 2.14 2.09 0.00 3.81 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 2.08 1.97 0.00 38 E 8.23 4.08 0.00 2.29 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 2.31 0.00 39 T 8.24 4.12 4.57 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 1.04 0.00 0.00 40 L 7.89 3.63 0.00 1.25 1.72 -0.08 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 41 E 7.72 4.00 0.00 2.12 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.45 0.00 42 K 8.07 4.46 0.00 1.97 1.72 0.00 1.84 0.00 0.00 1.76 0.00 0.00 3.17 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.75 1.93 7.81 43 F 8.27 4.65 0.00 3.19 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 44 D 8.63 4.40 0.00 2.64 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 45 R 7.93 3.81 0.00 1.49 1.25 0.00 2.98 0.00 0.00 2.88 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.25 0.00 46 F 8.07 5.05 0.00 2.87 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 47 K 8.12 4.16 0.00 1.86 2.21 0.00 1.60 0.00 0.00 1.79 0.00 0.00 3.15 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.52 1.45 7.81 48 H 8.05 4.37 0.00 3.31 3.49 0.00 5.52 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 L 7.65 4.16 0.00 1.61 1.59 0.96 0.86 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 50 K 9.50 4.54 0.00 1.73 1.79 0.00 1.65 0.00 0.00 1.73 0.00 0.00 3.23 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.51 1.47 7.81 51 T 7.52 4.74 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 52 E 8.67 3.91 0.00 2.04 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 2.36 2.36 0.00 53 A 7.96 4.00 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 54 E 8.16 3.93 0.00 2.12 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 2.36 2.35 0.00 55 M 8.13 4.19 0.00 2.07 2.27 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.82 2.62 0.00 56 K 8.26 4.00 0.00 1.82 1.85 0.00 1.67 0.00 0.00 1.68 0.00 0.00 3.09 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.43 1.54 7.81 57 A 7.69 4.43 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 S 7.54 4.35 0.00 3.97 3.90 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 59 E 8.85 4.00 0.00 2.14 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 2.40 2.46 0.00 60 D 8.19 4.42 0.00 2.91 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 61 L 8.16 3.44 0.00 1.46 1.65 -0.17 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 62 K 7.96 3.86 0.00 1.88 1.99 0.00 1.67 0.00 0.00 1.64 0.00 0.00 2.92 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.43 1.46 7.81 63 K 8.38 4.00 0.00 2.14 1.94 0.00 1.77 0.00 0.00 1.62 0.00 0.00 2.98 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.50 1.59 7.81 64 H 8.75 4.45 0.00 3.62 3.50 0.00 5.79 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 65 G 8.42 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 66 V 7.75 3.61 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 1.14 0.00 0.00 0.99 0.00 0.00 67 T 7.87 3.88 4.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 68 V 7.94 3.59 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 1.09 0.00 0.00 0.96 0.00 0.00 69 L 8.22 4.27 0.00 1.81 1.94 0.88 0.80 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 70 T 8.40 3.97 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 1.25 0.00 0.00 71 A 8.01 4.02 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 72 L 8.12 3.72 0.00 1.58 1.67 0.26 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 73 G 8.46 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 0.00 0.00 0.00 74 A 7.80 3.99 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 75 I 7.61 3.78 1.89 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 1.55 0.76 0.95 0.00 0.00 76 L 7.93 3.99 0.00 1.18 1.58 -0.04 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 77 K 7.77 3.96 0.00 1.65 1.80 0.00 1.70 0.00 0.00 1.72 0.00 0.00 3.17 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.46 1.50 7.81 78 K 7.89 3.98 0.00 1.81 1.81 0.00 1.76 0.00 0.00 1.57 0.00 0.00 2.90 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.63 1.77 7.81 79 K 8.41 2.00 0.00 1.20 0.74 0.00 1.47 0.00 0.00 1.41 0.00 0.00 2.67 0.00 0.00 3.00 0.00 0.00 0.00 0.00 0.30 0.69 7.81 80 G 7.97 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 81 H 7.49 4.56 0.00 3.15 3.24 0.00 5.80 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 H 7.35 5.25 0.00 3.26 3.45 0.00 5.66 0.00 0.00 0.00 0.00 6.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 E 8.64 3.93 0.00 2.12 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 2.40 2.48 0.00 84 A 7.95 4.06 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 85 E 8.11 4.13 0.00 2.28 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 2.40 2.46 0.00 86 L 8.21 4.18 0.00 1.73 1.67 0.95 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 87 K 7.96 3.86 0.00 1.84 1.89 0.00 1.67 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.47 1.67 7.81 88 P 0.00 4.24 0.00 2.28 2.31 0.00 3.73 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 2.09 2.03 0.00 89 L 7.54 3.97 0.00 1.85 1.85 0.97 1.21 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 90 A 8.64 4.13 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 91 Q 8.26 3.78 0.00 2.23 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.76 0.00 0.00 0.00 0.00 0.00 2.32 2.53 0.00 92 S 8.25 3.97 0.00 3.85 4.08 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 93 H 8.64 4.16 0.00 3.49 3.58 0.00 5.81 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 94 A 7.76 2.98 -0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 T 7.20 3.75 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 96 K 7.43 4.19 0.00 1.55 1.70 0.00 1.68 0.00 0.00 1.63 0.00 0.00 2.99 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.16 1.34 7.81 97 H 8.11 4.33 0.00 2.99 3.14 0.00 5.86 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 K 7.67 3.78 0.00 1.88 1.86 0.00 1.80 0.00 0.00 1.66 0.00 0.00 3.05 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.49 1.38 7.81 99 I 7.91 4.21 2.03 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 1.31 0.90 1.08 0.00 0.00 100 P 0.00 4.43 0.00 1.63 1.76 0.00 2.26 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 1.80 0.00 101 I 8.37 3.36 1.70 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.50 0.70 0.00 0.00 102 K 7.91 3.67 0.00 1.75 1.72 0.00 1.54 0.00 0.00 1.74 0.00 0.00 3.16 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.41 0.64 7.81 103 Y 8.06 4.10 0.00 3.11 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 0.00 104 L 7.90 4.18 0.00 1.81 1.82 0.63 0.95 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 0.00 105 E 7.91 3.96 0.00 1.94 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 2.44 2.42 0.00 106 F 7.73 4.48 0.00 3.28 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 0.00 107 I 8.19 3.89 2.03 0.00 0.00 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 1.58 1.66 1.10 0.00 0.00 108 S 8.31 4.20 0.00 4.18 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 E 8.57 4.06 0.00 2.30 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 2.66 2.61 0.00 110 A 8.15 4.02 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 0.00 111 I 8.14 3.68 2.09 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 1.60 0.73 1.05 0.00 0.00 112 I 7.97 3.86 2.14 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.12 1.18 0.00 0.00 113 H 8.47 4.15 0.00 3.34 3.47 0.00 5.59 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 V 8.04 3.58 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 0.97 0.00 0.00 0.98 0.00 0.00 115 L 8.04 3.76 0.00 1.03 0.44 0.81 0.76 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 0.00 116 H 8.01 4.42 0.00 3.55 3.61 0.00 5.95 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 S 7.93 4.17 0.00 3.96 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 R 7.88 4.06 0.00 1.44 1.48 0.00 2.68 0.00 0.00 2.66 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.45 0.00 119 H 8.15 5.04 0.00 3.18 3.17 0.00 5.63 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 P 0.00 4.30 0.00 2.20 2.23 0.00 3.66 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 1.93 0.00 121 G 8.14 3.69 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 0.00 0.00 0.00 122 D 8.12 5.06 0.00 2.75 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 0.00 123 F 8.02 5.01 0.00 2.99 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 G 8.03 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 0.00 0.00 0.00 125 A 8.41 3.94 1.26 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 0.00 0.00 126 D 8.01 4.20 0.00 2.87 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 0.00 127 A 7.76 3.98 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 0.00 128 Q 7.88 3.17 0.00 1.93 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.75 0.00 0.00 0.00 0.00 0.00 1.85 1.61 0.00 129 G 8.29 3.47 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 0.00 130 A 8.00 3.85 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 M 8.46 4.01 0.00 2.42 2.44 0.00 0.00 0.00 0.00 0.00 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.78 2.90 0.00 132 N 8.52 4.32 0.00 2.85 2.95 0.00 0.00 7.17 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 K 8.21 3.91 0.00 1.83 1.66 0.00 1.63 0.00 0.00 1.56 0.00 0.00 2.80 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.38 1.52 7.81 134 A 8.11 3.84 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 0.00 135 L 8.33 4.12 0.00 1.74 1.80 0.98 1.01 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 0.00 136 E 8.63 3.98 0.00 2.20 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 2.34 2.53 0.00 137 L 8.26 3.98 0.00 1.86 1.97 1.04 1.41 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 0.00 138 F 8.36 4.12 0.00 3.05 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 0.00 139 R 8.29 3.54 0.00 2.03 1.86 0.00 3.14 0.00 0.00 3.26 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.99 0.00 140 K 8.47 3.81 0.00 1.78 2.01 0.00 1.62 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.42 1.47 7.81 141 D 8.22 4.37 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 0.00 142 I 7.71 3.57 1.32 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 0.96 -0.20 0.48 0.00 0.00 143 A 8.22 3.72 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 A 7.96 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 0.00 145 K 7.86 4.01 0.00 2.04 1.90 0.00 1.67 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.64 7.81 146 Y 8.58 4.06 0.00 3.05 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 0.00 147 K 8.57 3.98 0.00 2.08 2.01 0.00 1.67 0.00 0.00 1.58 0.00 0.00 2.91 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.47 7.81 148 E 7.99 3.92 0.00 2.04 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 2.36 2.40 0.00 149 L 7.76 4.42 0.00 1.96 1.93 0.78 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 150 G 8.22 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 0.00 151 Y 8.27 4.63 0.00 2.63 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 0.00 152 Q 8.26 4.15 0.00 2.19 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.70 0.00 0.00 0.00 0.00 0.00 2.36 2.36 0.00 153 G 8.25 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00