NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 S 4.4533 8.3349 116.7914 58.6241 63.6726 173.4455 5 E 4.6437 8.4658 127.8859 54.6009 32.9176 173.6518 6 I 4.1459 8.3925 121.7925 61.4436 39.0797 174.9547 7 F 4.7669 9.0797 129.0120 56.7767 41.4535 174.3230 8 T 4.8617 7.9030 123.1075 62.9209 69.4665 174.5276 9 V 4.5034 9.0758 119.8134 59.5604 35.1158 174.3171 10 N 5.4991 8.8409 121.7742 51.7517 40.8470 174.3098 11 G 4.2973 9.5424 108.8661 44.7798 0.0000 171.0336 12 I 4.9676 8.0521 120.8792 59.0936 39.6343 175.2020 13 L 4.0400 8.3781 126.4260 56.1551 41.9160 178.1941 14 G 4.0467 9.0604 111.6844 45.5032 0.0000 173.0104 15 E 4.8673 8.1437 120.3781 55.2253 32.9752 174.8157 16 S 5.4364 8.6097 115.6250 57.6269 66.5444 173.7330 17 V 4.5963 8.4156 121.4550 60.1846 34.8112 174.3290 18 T 4.9976 8.2518 118.1279 61.8930 71.1819 173.3145 19 F 4.5679 9.0939 125.3431 55.0420 40.9981 173.5208 20 P 4.6397 0.0000 0.0000 62.5720 31.9049 175.3810 21 V 4.2417 9.4284 123.0388 63.6400 33.4240 175.7387 22 N 4.1484 8.5579 113.6689 54.2797 35.7037 175.3878 23 I 3.9137 8.1642 118.2081 61.7623 37.3904 176.7592 24 Q 4.6222 8.1880 128.2974 55.5354 29.7790 175.4900 25 E 4.9372 7.7013 109.7309 54.4137 31.3904 173.4433 26 P 4.4526 0.0000 0.0000 65.9861 31.7705 179.3382 27 R 4.0728 8.0048 117.3517 57.3305 30.1706 176.1575 28 Q 4.3370 7.7995 116.5891 57.1998 30.1410 174.8015 29 V 4.0309 7.8269 119.4629 63.3091 31.5647 175.5051 30 K 4.2135 9.0674 130.6883 58.6734 32.6872 176.6005 31 I 4.6378 7.2952 117.8407 59.9416 41.5972 172.4167 32 I 4.9312 8.9599 129.4101 59.3952 40.2979 174.1720 33 A 5.0432 8.7156 128.9536 50.1484 21.1647 175.0466 34 W 5.2006 8.9076 123.4410 55.6958 31.1990 175.9371 35 T 4.7197 9.1694 114.3912 59.6970 71.9125 172.5514 36 S 4.5373 8.8721 118.9856 55.6704 62.9284 175.3160 37 K 3.9044 8.8635 115.4960 58.8688 32.0496 176.1422 38 T 4.6695 7.4154 106.1686 58.8968 71.7397 173.0795 39 S 4.3801 8.5230 117.4264 59.4360 62.9558 172.8259 40 V 4.1468 7.2760 118.2389 62.5604 33.4570 175.1947 41 A 4.5842 7.2361 118.0970 51.6874 22.9612 173.5561 42 Y 5.4128 8.5033 116.8897 56.6160 41.0336 175.5539 43 V 5.2579 9.0909 121.7104 61.6134 35.0160 174.4869 44 T 5.1829 8.9595 116.7544 58.8760 72.8097 171.3013 45 P 4.8232 0.0000 0.0000 61.9916 31.8799 177.0616 46 G 3.6988 8.6796 110.6039 45.6271 0.0000 172.6042 47 D 4.4972 8.9733 121.1847 56.9370 41.5865 176.7388 48 S 4.7466 7.3154 113.3587 56.8785 66.3616 173.4429 49 E 4.7264 8.1033 122.0774 56.5600 33.3292 175.6941 50 T 3.8759 9.0562 116.4213 66.8034 68.5573 174.6608 51 A 4.6319 7.6206 122.7177 49.7724 21.0953 174.5724 52 P 4.8684 0.0000 0.0000 62.1693 33.1687 175.7503 53 V 4.4268 8.6680 114.8897 59.9018 33.8393 175.2960 54 V 4.8491 8.3746 124.3447 61.7026 33.6215 175.1441 55 T 4.5928 8.7091 123.0192 61.6908 71.4085 173.5494 56 V 4.3076 8.5118 127.0934 62.6274 32.4755 175.7210 57 T 4.7916 8.6616 114.6563 61.2295 69.8717 173.0392 58 H 4.8085 7.9747 120.8926 54.8142 33.2395 174.3892 59 R 2.0000 7.9277 121.7441 58.0316 29.5954 178.2732 60 N 4.1181 8.2289 115.3347 55.6951 38.6435 174.8185 61 Y 4.7775 7.8457 113.0613 57.1894 39.3471 174.9962 62 Y 4.5323 7.6703 117.6747 60.0805 38.3011 176.5308 63 E 3.7870 9.0153 120.5764 57.3465 27.8249 174.8561 64 R 4.8185 7.9757 116.3567 54.8888 31.9883 174.8659 65 I 4.8070 7.6279 120.0413 59.7520 39.6007 174.6779 66 H 5.0401 9.3902 123.4249 53.8678 32.7294 172.4366 67 A 5.2941 8.6655 122.2879 50.1538 22.3103 175.2986 68 L 4.6699 8.4434 118.9243 52.8534 44.6997 176.4777 69 G 4.0469 8.6160 112.1278 43.9110 0.0000 171.6104 70 P 4.5853 0.0000 0.0000 62.2083 31.8595 175.7208 71 N 4.7505 7.9114 116.3366 53.2964 37.6766 175.3974 72 Y 3.8254 7.8348 116.1841 59.0005 36.4199 169.0992 73 N 4.7242 8.1705 116.9442 53.5593 40.0774 173.6795 74 L 4.8785 8.3557 124.3304 53.4041 44.6152 175.0646 75 V 5.3260 8.9115 126.0149 60.5275 34.1188 174.1326 76 I 4.8986 8.3440 129.1582 60.0942 38.6704 175.6036 77 S 4.8522 9.0707 122.8555 55.4446 65.8184 173.4253 78 D 4.5270 8.5289 117.0357 54.6238 38.3268 174.6013 79 L 4.2372 8.1129 118.3341 55.5506 42.7303 177.5187 80 R 4.9354 9.0400 120.3022 54.2730 33.2456 176.7848 81 M 4.1790 8.3530 118.2958 58.2117 32.5662 177.9724 82 E 3.9877 8.0838 118.6708 58.7223 30.0473 177.1301 83 D 4.6632 7.6337 116.6038 56.9589 41.1161 177.1277 84 A 4.3870 7.3780 121.0884 52.5716 19.2605 175.9854 85 G 3.8972 8.9240 104.6224 44.0418 0.0000 172.0504 86 D 5.3492 8.8207 118.7000 54.3006 42.1691 175.4943 87 Y 5.0079 9.5583 120.7959 56.2634 42.0549 174.6339 88 K 5.1900 9.3934 122.0083 54.9597 36.5136 174.5448 89 A 4.2185 8.7447 128.6246 49.9958 21.5362 174.9699 90 D 4.9296 8.9372 124.0998 53.1973 41.9611 175.6035 91 I 4.3832 8.6967 126.3010 59.9350 38.8434 174.7301 92 N 5.3694 9.1615 126.3032 51.7992 40.5188 174.4805 93 T 5.1044 8.4151 113.5033 59.7132 71.8028 173.9996 94 Q 4.4476 9.2599 119.5362 57.4539 29.2720 176.4221 95 A 4.0879 7.4496 120.1161 49.3432 22.4281 174.2730 96 D 4.1840 7.5420 117.7895 53.6103 41.7588 175.0906 97 P 4.5215 0.0000 0.0000 62.8148 31.8251 176.7727 98 Y 3.9461 7.8431 121.7651 59.1338 37.5937 169.5016 99 T 5.1537 7.6584 114.4734 62.0996 72.0717 173.5094 100 T 4.6801 8.9382 121.2054 60.4121 70.8085 172.6089 101 T 5.0686 8.3830 122.6744 61.6825 71.5560 173.3352 102 K 4.5081 8.6625 125.2026 54.5783 35.1413 175.2864 103 R 5.1475 8.1333 122.2737 54.7208 33.0304 174.5529 104 Y 5.5934 9.4937 120.1921 56.3560 43.1105 174.0463 105 N 5.4333 9.4820 119.7150 52.0386 42.0400 173.0951 106 L 5.0110 9.3161 130.4745 54.1127 43.5771 175.0978 107 Q 4.7282 9.0078 127.0668 54.8216 30.2754 175.0174 108 I 4.9584 8.1400 124.6240 59.8200 39.7203 174.4462 109 Y 4.8397 8.6412 122.5776 55.5535 42.1675 175.2836 110 R 4.4229 8.6487 117.2259 55.8332 30.7724 176.7388 111 R 4.0723 8.3952 118.8764 56.7616 30.1428 176.2101 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 4 S 8.33 4.45 0.00 3.84 3.58 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.47 4.64 0.00 2.02 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.36 0.00 6 I 8.39 4.15 1.91 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.49 1.00 0.00 0.00 7 F 9.08 4.77 0.00 3.02 2.92 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 8 T 7.90 4.86 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 1.19 0.00 0.00 9 V 9.08 4.50 1.80 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 0.93 0.00 0.00 0.80 0.00 0.00 10 N 8.84 5.50 0.00 2.59 2.84 0.00 0.00 6.72 7.65 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 11 G 9.54 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 0.00 0.00 0.00 0.00 12 I 8.05 4.97 1.88 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.98 0.99 0.00 0.00 13 L 8.38 4.04 0.00 1.67 1.65 0.93 0.75 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 14 G 9.06 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 15 E 8.14 4.87 0.00 2.12 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 2.23 2.30 0.00 16 S 8.61 5.44 0.00 3.71 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 17 V 8.42 4.60 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 0.47 0.00 0.00 0.66 0.00 0.00 18 T 8.25 5.00 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 1.25 0.00 0.00 19 F 9.09 4.57 0.00 2.47 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 20 P 0.00 4.64 0.00 2.05 2.00 0.00 4.00 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 1.82 1.38 0.00 21 V 9.43 4.24 2.41 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 1.04 0.00 0.00 1.39 0.00 0.00 22 N 8.56 4.15 0.00 2.90 2.86 0.00 0.00 6.92 7.45 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 23 I 8.16 3.91 2.21 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 1.40 0.72 0.99 0.00 0.00 24 Q 8.19 4.62 0.00 1.99 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 7.40 0.00 0.00 0.00 0.00 0.00 2.26 2.39 0.00 25 E 7.70 4.94 0.00 1.98 1.75 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 2.20 2.20 0.00 26 P 0.00 4.45 0.00 2.36 2.68 0.00 3.80 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 2.12 2.01 0.00 27 R 8.00 4.07 0.00 1.83 2.03 0.00 3.25 0.00 0.00 3.17 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.67 0.00 28 Q 7.80 4.34 0.00 2.22 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.74 0.00 0.00 0.00 0.00 0.00 2.38 2.28 0.00 29 V 7.83 4.03 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 0.15 0.00 0.00 0.64 0.00 0.00 30 K 9.07 4.21 0.00 1.80 1.91 0.00 1.90 0.00 0.00 1.61 0.00 0.00 2.87 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.41 1.38 7.81 31 I 7.30 4.64 1.84 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.10 0.86 0.00 0.00 32 I 8.96 4.93 1.93 0.00 0.00 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 0.95 0.38 0.45 0.00 0.00 33 A 8.72 5.04 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 34 W 8.91 5.20 0.00 3.34 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 35 T 9.17 4.72 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 1.22 0.00 0.00 36 S 8.87 4.54 0.00 2.72 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 37 K 8.86 3.90 0.00 1.72 1.85 0.00 1.70 0.00 0.00 1.73 0.00 0.00 2.88 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.43 1.42 7.81 38 T 7.42 4.67 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 39 S 8.52 4.38 0.00 3.94 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 40 V 7.28 4.15 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 0.32 0.00 0.00 0.69 0.00 0.00 41 A 7.24 4.58 1.13 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 0.00 0.00 0.00 0.00 0.00 42 Y 8.50 5.41 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 43 V 9.09 5.26 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 1.44 0.00 0.00 1.19 0.00 0.00 44 T 8.96 5.18 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 45 P 0.00 4.82 0.00 2.03 2.14 0.00 3.80 0.00 0.00 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.20 0.00 46 G 8.68 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 47 D 8.97 4.50 0.00 2.65 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 48 S 7.32 4.75 0.00 3.84 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 49 E 8.10 4.73 0.00 1.88 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 2.13 2.17 0.00 50 T 9.06 3.88 4.20 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 1.14 0.00 0.00 51 A 7.62 4.63 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 P 0.00 4.87 0.00 1.98 2.05 0.00 3.54 0.00 0.00 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.38 0.00 53 V 8.67 4.43 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 0.74 0.00 0.00 1.04 0.00 0.00 54 V 8.37 4.85 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 0.83 0.00 0.00 0.93 0.00 0.00 55 T 8.71 4.59 4.45 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 1.32 0.00 0.00 56 V 8.51 4.31 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 1.24 0.00 0.00 0.97 0.00 0.00 57 T 8.66 4.79 4.25 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 1.12 0.00 0.00 58 H 7.97 4.81 0.00 3.28 3.24 0.00 5.67 0.00 0.00 0.00 0.00 6.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 R 7.93 2.00 0.00 1.34 1.04 0.00 2.87 0.00 0.00 3.17 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.32 0.00 60 N 8.23 4.12 0.00 2.24 2.36 0.00 0.00 6.71 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 61 Y 7.85 4.78 0.00 3.24 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 Y 7.67 4.53 0.00 3.07 2.86 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 E 9.02 3.79 0.00 2.17 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 0.00 2.22 2.27 0.00 64 R 7.98 4.82 0.00 1.98 2.16 0.00 3.32 0.00 0.00 3.31 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.79 0.00 65 I 7.63 4.81 1.77 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.77 0.66 0.00 0.00 66 H 9.39 5.04 0.00 2.96 3.13 0.00 5.56 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 67 A 8.67 5.29 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 68 L 8.44 4.67 0.00 1.79 1.64 0.90 0.86 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 69 G 8.62 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 70 P 0.00 4.59 0.00 2.17 2.11 0.00 3.75 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 1.91 1.91 0.00 71 N 7.91 4.75 0.00 3.03 3.13 0.00 0.00 6.20 7.57 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 72 Y 7.83 3.83 0.00 3.42 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 73 N 8.17 4.72 0.00 2.68 2.85 0.00 0.00 6.56 7.52 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 74 L 8.36 4.88 0.00 1.03 0.87 0.56 -0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 75 V 8.91 5.33 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 0.83 0.00 0.00 0.91 0.00 0.00 76 I 8.34 4.90 1.91 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.37 1.06 0.00 0.00 77 S 9.07 4.85 0.00 3.90 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 78 D 8.53 4.53 0.00 2.82 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 79 L 8.11 4.24 0.00 1.83 1.63 0.96 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 80 R 9.04 4.94 0.00 1.93 1.77 0.00 3.03 0.00 0.00 3.04 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.51 0.00 81 M 8.35 4.18 0.00 2.07 2.04 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.56 0.00 82 E 8.08 3.99 0.00 1.90 1.88 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 2.20 2.32 0.00 83 D 7.63 4.66 0.00 3.06 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 84 A 7.38 4.39 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 85 G 8.92 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 0.00 0.00 0.00 86 D 8.82 5.35 0.00 2.70 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 87 Y 9.56 5.01 0.00 3.11 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 88 K 9.39 5.19 0.00 1.84 1.61 0.00 1.57 0.00 0.00 1.67 0.00 0.00 2.87 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.30 1.38 7.81 89 A 8.74 4.22 -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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 D 8.94 4.93 0.00 2.52 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 I 8.70 4.38 1.85 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.43 0.77 0.00 0.00 92 N 9.16 5.37 0.00 2.71 2.72 0.00 0.00 6.09 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 T 8.42 5.10 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 1.13 0.00 0.00 94 Q 9.26 4.45 0.00 1.92 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.75 0.00 0.00 0.00 0.00 0.00 2.44 2.37 0.00 95 A 7.45 4.09 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 96 D 7.54 4.18 0.00 2.48 2.47 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 97 P 0.00 4.52 0.00 2.22 2.11 0.00 3.81 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.94 0.00 98 Y 7.84 3.95 0.00 3.33 3.11 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 0.00 99 T 7.66 5.15 4.25 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 1.18 0.00 0.00 100 T 8.94 4.68 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 1.14 0.00 0.00 101 T 8.38 5.07 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 1.20 0.00 0.00 102 K 8.66 4.51 0.00 1.65 1.30 0.00 1.61 0.00 0.00 1.73 0.00 0.00 2.88 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.25 1.30 7.81 103 R 8.13 5.15 0.00 1.68 1.82 0.00 3.05 0.00 0.00 3.33 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.59 0.00 104 Y 9.49 5.59 0.00 3.29 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 0.00 105 N 9.48 5.43 0.00 2.92 2.76 0.00 0.00 7.08 6.65 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 0.00 106 L 9.32 5.01 0.00 1.91 1.94 0.79 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 107 Q 9.01 4.73 0.00 2.36 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.68 6.55 0.00 0.00 0.00 0.00 0.00 2.29 2.35 0.00 108 I 8.14 4.96 1.82 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 1.36 1.01 0.91 0.00 0.00 109 Y 8.64 4.84 0.00 2.89 2.86 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 0.00 110 R 8.65 4.42 0.00 1.84 1.99 0.00 3.06 0.00 0.00 3.21 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.66 0.00 111 R 8.40 4.07 0.00 1.81 1.86 0.00 3.27 0.00 0.00 3.27 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.84 0.00