NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1B H 4.5474 8.3033 117.8326 55.1470 30.4291 172.9522 1C H 3.6547 8.7374 114.1100 57.0876 26.1200 172.8038 1D H 4.1813 9.0947 113.1678 57.0460 27.2915 174.2524 1E H 5.0730 8.1124 113.7188 53.8134 32.6058 173.1395 1F H 4.6236 8.9832 117.1383 56.0605 28.9008 174.3717 1G F 4.8338 8.4613 119.6378 57.8211 40.0712 174.3329 2 N 4.6043 8.4483 116.9898 52.5002 39.0459 174.5632 3 L 4.8954 8.1028 122.7782 51.9375 44.6569 174.3923 4 P 4.5256 0.0000 0.0000 61.5179 32.3357 174.3382 5 P 4.3592 0.0000 0.0000 62.4324 32.3669 174.8353 6 G 3.7041 9.0480 104.1829 44.4380 0.0000 171.0717 7 N 4.5362 7.9014 114.5364 51.9189 40.2085 173.6348 8 Y 4.8461 8.0323 113.7586 58.0237 38.4202 177.0381 9 K 4.0718 8.3000 121.2199 59.2558 32.2565 177.2726 10 K 4.5731 7.6697 116.3860 53.7572 34.0131 174.6575 11 P 4.6496 0.0000 0.0000 63.3288 32.7469 174.8008 12 K 5.1599 9.5994 119.9414 55.1430 37.4817 174.9236 13 L 5.1180 9.1376 121.0519 53.1605 44.5415 176.0715 14 L 5.0089 8.7127 123.7147 53.6580 43.4413 174.7097 15 Y 4.8585 9.2541 127.3818 56.4157 40.4045 173.8435 16 C 3.9579 8.8744 129.1727 58.2029 32.2358 174.2549 17 S 4.1305 8.3541 121.6767 60.4648 62.6140 175.1456 18 N 4.1516 8.1732 119.5165 55.8410 38.9509 175.1668 19 G 3.8835 7.5742 104.3459 44.7245 0.0000 173.0583 20 G 3.1270 7.6215 106.6972 43.9668 0.0000 173.6856 21 H 4.5497 7.2456 115.6694 54.2933 31.2303 174.0616 22 F 5.2660 8.6980 120.1461 55.9460 40.7051 175.3822 23 L 4.4704 9.1837 126.4296 55.5761 43.2517 175.6928 24 R 4.8994 9.4391 125.6662 54.6559 33.7971 173.7048 25 I 4.7314 8.2199 126.7042 59.5141 38.7937 175.6894 26 L 4.1616 9.4495 129.0718 53.3148 42.3840 176.6384 27 P 4.3721 0.0000 0.0000 65.8334 31.2963 177.0808 28 D 4.5394 8.0013 114.5791 53.5068 39.6769 177.0772 29 G 4.0647 8.7567 110.0078 45.4034 0.0000 173.8668 30 T 4.4302 8.4104 117.5621 63.0498 69.2322 173.7673 31 V 4.8966 8.0766 124.1482 61.2184 34.5503 174.4807 32 D 4.6093 8.6964 125.1139 52.8839 42.4711 173.8860 33 G 4.5201 8.4369 104.5566 45.3389 0.0000 172.3743 34 T 4.9724 8.7800 116.0973 60.3190 70.8240 174.8856 35 R 3.9519 8.8273 124.8857 57.4886 30.8437 176.2492 36 D 4.5492 8.2587 119.1138 53.7772 40.9261 176.7594 37 R 3.8202 8.7399 127.8829 58.5062 30.3672 177.1829 38 S 4.3137 8.7837 111.3230 59.2597 63.5854 174.1310 39 D 4.3717 7.5037 121.5705 55.2456 41.2190 175.7881 40 Q 4.4535 8.5654 123.3021 56.3727 29.2505 175.6302 41 H 4.8936 9.4726 116.0430 55.4860 29.2298 175.0826 42 I 4.5605 7.3693 110.4942 59.7633 38.4164 175.2846 43 Q 4.2650 7.8207 121.8643 55.5904 29.6581 174.5800 44 L 5.1172 9.0042 125.0544 52.7912 45.2155 175.3855 45 Q 4.7657 9.5640 125.9879 54.6715 30.5675 174.1582 46 L 5.2305 8.5583 126.5925 53.5109 43.8367 176.0247 47 S 4.5570 8.5539 115.2624 56.8107 66.9571 172.3603 48 A 4.6348 8.3188 123.1278 50.5648 19.9797 176.1335 49 E 4.1027 9.2017 125.8682 57.0560 30.4944 177.2863 50 S 4.8415 7.4048 111.7902 55.7213 66.7385 173.7184 51 V 3.8112 8.3010 121.0962 64.9338 31.4705 176.3189 52 G 3.9593 9.1853 114.9599 45.1318 0.0000 172.0130 53 E 5.0305 8.3828 120.4238 54.7972 31.6842 175.7261 54 V 4.8663 8.9520 117.1115 59.8205 36.7302 174.0332 55 Y 5.3133 9.0699 119.3234 56.5110 41.4716 175.3903 56 I 4.5505 8.5446 121.5063 59.6248 40.6883 174.0768 57 K 4.6292 8.7552 129.1294 54.0458 35.1429 175.0855 58 S 4.7928 8.7195 123.0978 58.5208 62.7715 174.9636 59 T 3.9148 8.6217 117.9510 64.5043 68.9253 176.0872 60 E 3.9804 8.4114 122.8171 59.0224 29.8316 177.3512 61 T 4.2449 7.9645 106.1604 61.0303 69.8807 175.6936 62 G 3.8119 8.0757 110.0618 45.3865 0.0000 173.5760 63 Q 4.4579 7.6266 118.7685 55.8793 30.2303 174.5679 64 Y 4.7686 9.1290 120.3071 56.0677 40.6714 175.0970 65 L 4.3881 9.2053 126.1638 55.3679 43.5017 175.5867 66 A 5.2741 8.7062 126.0199 50.8715 23.2681 174.3330 67 M 5.4580 8.5758 119.1137 53.9023 35.0376 175.5645 68 D 5.4010 9.6134 125.7278 51.7044 41.2449 176.9383 69 T 3.9940 8.5932 112.8960 64.8288 67.2120 173.9955 70 D 4.7550 8.7873 119.6480 53.9320 41.0555 177.1671 71 G 3.3594 8.6578 108.1632 45.1008 0.0000 173.0245 72 L 4.7362 7.7842 119.7986 53.5914 43.2571 176.1156 73 L 5.1126 8.5706 123.4505 55.0318 42.9633 175.4189 74 Y 4.9114 9.0337 119.5556 56.2393 42.0589 173.3221 75 G 4.2757 8.9551 108.5095 45.2173 0.0000 173.1654 76 S 5.0202 9.2282 121.8179 56.7493 63.7373 175.3314 77 Q 4.0757 9.0964 126.0814 58.1977 28.9460 176.3937 78 T 4.5619 7.5991 111.1233 58.9016 70.0655 171.2367 79 P 3.9212 0.0000 0.0000 62.5071 31.9258 175.0296 80 N 4.9187 8.1630 121.3964 51.5254 39.9841 174.5520 81 S 4.1415 8.6367 110.5796 61.5048 63.1510 175.2285 82 E 4.2557 8.9910 120.0289 57.3937 29.4783 177.2495 83 C 5.0505 7.5483 115.1968 59.0664 29.0196 173.2935 84 L 4.4579 6.9777 120.0344 53.4124 43.0769 175.7507 85 F 5.1196 8.7592 121.0789 55.6011 43.5817 174.3117 86 L 4.8204 9.3220 123.7106 53.8219 42.4440 175.6431 87 E 4.3143 8.8868 127.0792 55.5135 30.1361 175.9413 88 R 4.8138 8.5628 125.4904 54.0683 34.7002 174.7637 89 L 4.7100 8.5195 123.6722 55.1641 43.1851 175.7622 90 E 4.7120 9.0503 124.2568 55.2561 33.5668 174.9331 91 E 4.0159 9.8308 123.3523 57.4599 27.3671 174.4188 92 N 4.3248 8.5830 110.9227 54.2823 36.4931 174.0794 93 H 4.7147 8.7461 116.2762 57.4780 35.3494 173.0833 94 Y 4.8656 7.7958 115.5911 56.7488 40.9390 173.9156 95 N 5.4741 9.4824 118.6181 52.0747 40.9795 174.6544 96 T 5.3232 9.0037 112.7424 60.2103 73.1730 172.7696 97 Y 5.0272 8.6494 118.7468 56.6312 41.5608 174.1325 98 I 4.6212 8.4607 126.3524 59.5377 39.1064 175.6988 99 S 3.9826 8.7994 122.6911 58.5264 62.0718 174.0711 100 K 4.0000 8.5162 129.3713 59.4462 31.9133 178.1896 101 A 3.9825 7.9026 121.4924 54.5388 18.2641 176.7843 102 H 4.5891 7.6642 113.4502 55.2084 29.9707 175.8948 103 A 4.0006 7.9417 124.2672 55.1756 18.7474 180.5443 104 E 3.9706 8.0451 114.4598 59.1235 29.5826 177.8827 105 K 4.2033 7.3293 114.4495 55.4571 32.7399 176.0284 106 N 3.8012 7.5711 115.6627 53.9219 36.4636 174.9665 107 W 5.0136 7.6055 117.7340 56.1141 30.7971 177.6675 108 F 5.3835 9.3862 124.4174 55.8374 41.1949 175.8158 109 V 4.0482 8.8204 121.2624 62.9094 32.6088 175.1887 110 G 4.5688 8.4868 112.1908 45.3629 0.0000 171.5970 111 L 5.3038 8.5497 121.7494 52.4194 45.0729 177.1077 112 K 4.1098 9.0396 123.4855 55.5797 32.8427 178.3128 113 K 3.8558 8.4739 119.9915 59.5333 31.9556 177.9384 114 N 4.5105 8.0446 113.5281 52.8479 37.6803 175.9115 115 G 3.5191 8.3504 108.7181 45.4407 0.0000 173.6931 116 S 4.7576 8.7103 115.1366 57.0306 64.5460 173.3547 117 C 4.7847 8.2705 119.5933 59.8793 28.5505 173.7021 118 K 4.3316 8.8124 122.7342 55.9013 33.1435 176.3972 119 R 4.1310 8.5099 122.8351 55.7066 31.4593 177.3454 120 G 3.3878 9.2801 116.6475 48.1917 0.0000 174.0982 121 P 4.1407 0.0000 0.0000 64.5078 31.4083 177.6523 122 R 4.2599 7.8980 115.3563 56.5755 30.4711 176.5882 123 T 5.0376 7.3722 108.0961 60.6863 70.4224 173.8697 124 H 5.0021 8.2307 117.9582 54.6171 32.8229 172.9463 125 Y 4.0574 8.5593 120.2338 59.9182 38.1313 177.0831 126 G 4.0395 9.0979 111.5975 45.2651 0.0000 173.4807 127 Q 4.4721 7.5595 118.4688 54.4073 30.4581 176.9465 128 K 3.6028 8.2782 119.2579 58.5021 32.8338 179.2904 129 A 4.0171 8.1518 121.4301 53.8893 18.3003 178.4365 130 I 4.5688 6.8029 105.9518 60.0735 38.2556 175.1434 131 L 4.5773 7.4813 123.0220 53.7401 42.9540 175.6692 132 F 5.3933 9.4310 122.3042 55.5939 43.3681 174.4973 133 L 5.3144 9.3662 121.2262 52.3472 44.4763 174.2586 134 P 5.0925 0.0000 0.0000 62.6190 32.6234 175.6911 135 L 4.9883 9.3184 123.0829 52.0541 44.9497 174.1346 136 P 4.6451 0.0000 0.0000 62.5810 32.2999 176.7232 137 V 3.8642 8.2768 115.6398 61.6983 31.0773 176.0657 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 1B H 8.30 4.55 0.00 3.14 3.51 0.00 5.75 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 1C H 8.74 3.65 0.00 3.43 3.38 0.00 5.85 0.00 0.00 0.00 0.00 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1D H 9.09 4.18 0.00 3.25 3.32 0.00 5.64 0.00 0.00 0.00 0.00 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1E H 8.11 5.07 0.00 3.32 3.27 0.00 5.86 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1F H 8.98 4.62 0.00 3.34 3.41 0.00 5.66 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1G F 8.46 4.83 0.00 2.95 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2 N 8.45 4.60 0.00 2.96 2.79 0.00 0.00 6.82 6.74 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 3 L 8.10 4.90 0.00 1.46 1.38 0.65 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 4 P 0.00 4.53 0.00 2.18 2.12 0.00 3.67 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.91 0.00 5 P 0.00 4.36 0.00 2.17 2.08 0.00 3.72 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.94 0.00 6 G 9.05 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 7 N 7.90 4.54 0.00 2.63 2.66 0.00 0.00 5.81 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 8 Y 8.03 4.85 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 9 K 8.30 4.07 0.00 1.89 1.91 0.00 1.70 0.00 0.00 1.71 0.00 0.00 3.16 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.51 1.53 7.81 10 K 7.67 4.57 0.00 1.76 1.73 0.00 1.76 0.00 0.00 1.76 0.00 0.00 3.05 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.38 1.42 7.81 11 P 0.00 4.65 0.00 2.09 2.17 0.00 3.64 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 1.99 0.00 12 K 9.60 5.16 0.00 1.66 1.87 0.00 1.75 0.00 0.00 1.75 0.00 0.00 3.02 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.42 1.56 7.81 13 L 9.14 5.12 0.00 1.62 1.54 0.56 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 14 L 8.71 5.01 0.00 1.63 1.70 0.34 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 15 Y 9.25 4.86 0.00 3.29 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 16 C 8.87 3.96 0.00 2.35 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 17 S 8.35 4.13 0.00 3.95 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 18 N 8.17 4.15 0.00 2.54 2.69 0.00 0.00 6.78 7.98 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 19 G 7.57 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 G 7.62 3.13 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 0.00 21 H 7.25 4.55 0.00 2.98 3.13 0.00 5.80 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 F 8.70 5.27 0.00 3.14 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 23 L 9.18 4.47 0.00 1.84 1.54 0.95 0.26 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 24 R 9.44 4.90 0.00 1.89 2.04 0.00 3.19 0.00 0.00 3.33 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.81 0.00 25 I 8.22 4.73 1.84 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 1.17 0.71 0.89 0.00 0.00 26 L 9.45 4.16 0.00 1.83 1.51 0.91 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 27 P 0.00 4.37 0.00 2.01 2.14 0.00 3.53 0.00 0.00 3.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 2.06 0.00 28 D 8.00 4.54 0.00 2.79 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 G 8.76 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 0.00 0.00 0.00 30 T 8.41 4.43 4.32 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 1.22 0.00 0.00 31 V 8.08 4.90 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 0.89 0.00 0.00 0.96 0.00 0.00 32 D 8.70 4.61 0.00 2.93 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 G 8.44 4.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 T 8.78 4.97 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 1.40 0.00 0.00 35 R 8.83 3.95 0.00 1.83 1.94 0.00 3.16 0.00 0.00 3.04 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.31 0.00 36 D 8.26 4.55 0.00 2.83 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 37 R 8.74 3.82 0.00 1.96 1.97 0.00 3.30 0.00 0.00 3.26 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.30 0.00 38 S 8.78 4.31 0.00 3.96 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 39 D 7.50 4.37 0.00 2.73 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 40 Q 8.57 4.45 0.00 1.90 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 7.17 0.00 0.00 0.00 0.00 0.00 2.26 2.26 0.00 41 H 9.47 4.89 0.00 3.31 3.44 0.00 5.76 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 42 I 7.37 4.56 1.86 0.00 0.00 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.89 1.01 0.00 0.00 43 Q 7.82 4.27 0.00 2.02 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.96 6.89 0.00 0.00 0.00 0.00 0.00 2.37 2.37 0.00 44 L 9.00 5.12 0.00 1.46 1.42 0.81 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 45 Q 9.56 4.77 0.00 2.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.78 0.00 0.00 0.00 0.00 0.00 2.26 2.36 0.00 46 L 8.56 5.23 0.00 1.65 1.28 0.92 1.07 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 47 S 8.55 4.56 0.00 3.95 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 48 A 8.32 4.63 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 49 E 9.20 4.10 0.00 1.71 1.87 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 2.31 2.34 0.00 50 S 7.40 4.84 0.00 3.92 3.76 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 51 V 8.30 3.81 2.29 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 0.97 0.00 0.00 1.03 0.00 0.00 52 G 9.19 3.96 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 0.00 0.00 0.00 53 E 8.38 5.03 0.00 2.00 1.73 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 2.25 2.31 0.00 54 V 8.95 4.87 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.00 0.00 1.17 0.00 0.00 55 Y 9.07 5.31 0.00 2.97 3.13 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 56 I 8.54 4.55 1.72 0.00 0.00 0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.77 0.68 0.00 0.00 57 K 8.76 4.63 0.00 1.19 1.29 0.00 1.29 0.00 0.00 1.05 0.00 0.00 2.59 0.00 0.00 2.70 0.00 0.00 0.00 0.00 0.84 0.21 7.81 58 S 8.72 4.79 0.00 3.87 3.63 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 59 T 8.62 3.91 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 1.16 0.00 0.00 60 E 8.41 3.98 0.00 1.95 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 2.14 2.31 0.00 61 T 7.96 4.24 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 1.26 0.00 0.00 62 G 8.08 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 0.00 0.00 0.00 63 Q 7.63 4.46 0.00 1.97 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.68 6.74 0.00 0.00 0.00 0.00 0.00 2.40 2.34 0.00 64 Y 9.13 4.77 0.00 2.93 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 65 L 9.21 4.39 0.00 1.59 1.46 0.79 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 66 A 8.71 5.27 0.56 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 67 M 8.58 5.46 0.00 2.24 2.23 0.00 0.00 0.00 0.00 0.00 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.69 0.00 68 D 9.61 5.40 0.00 2.94 2.84 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 69 T 8.59 3.99 4.34 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 1.27 0.00 0.00 70 D 8.79 4.75 0.00 2.77 2.62 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.66 3.36 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 0.00 72 L 7.78 4.74 0.00 1.96 1.63 0.89 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 73 L 8.57 5.11 0.00 1.57 1.61 0.90 0.94 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 74 Y 9.03 4.91 0.00 3.09 3.03 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 75 G 8.96 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 0.00 0.00 0.00 76 S 9.23 5.02 0.00 3.76 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 Q 9.10 4.08 0.00 2.14 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.46 0.00 0.00 0.00 0.00 0.00 2.44 2.34 0.00 78 T 7.60 4.56 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 1.22 0.00 0.00 79 P 0.00 3.92 0.00 1.39 0.49 0.00 3.57 0.00 0.00 3.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.45 0.00 80 N 8.16 4.92 0.00 2.89 2.92 0.00 0.00 5.99 7.51 0.00 0.00 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 S 8.64 4.14 0.00 3.95 4.13 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 82 E 8.99 4.26 0.00 2.22 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 2.37 2.33 0.00 83 C 7.55 5.05 0.00 3.29 3.21 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 84 L 6.98 4.46 0.00 1.35 1.27 0.77 -0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 85 F 8.76 5.12 0.00 3.05 3.07 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 86 L 9.32 4.82 0.00 1.52 1.61 0.88 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 87 E 8.89 4.31 0.00 2.07 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 1.75 0.00 88 R 8.56 4.81 0.00 1.78 1.79 0.00 3.14 0.00 0.00 2.86 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.63 0.00 89 L 8.52 4.71 0.00 1.74 1.60 0.97 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 90 E 9.05 4.71 0.00 2.26 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 2.31 2.47 0.00 91 E 9.83 4.02 0.00 2.39 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.40 0.00 92 N 8.58 4.32 0.00 2.84 2.88 0.00 0.00 6.83 8.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 H 8.75 4.71 0.00 2.90 2.87 0.00 5.75 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 Y 7.80 4.87 0.00 3.04 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 95 N 9.48 5.47 0.00 3.05 2.63 0.00 0.00 6.93 7.01 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 96 T 9.00 5.32 4.58 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 1.40 0.00 0.00 97 Y 8.65 5.03 0.00 2.73 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 I 8.46 4.62 1.71 0.00 0.00 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.07 0.69 0.64 0.00 0.00 99 S 8.80 3.98 0.00 4.03 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 0.00 100 K 8.52 4.00 0.00 1.59 1.63 0.00 1.77 0.00 0.00 1.53 0.00 0.00 2.77 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.24 1.12 7.81 101 A 7.90 3.98 1.05 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 0.00 102 H 7.66 4.59 0.00 2.98 2.14 0.00 5.62 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 A 7.94 4.00 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 0.00 104 E 8.05 3.97 0.00 1.85 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 2.30 2.29 0.00 105 K 7.33 4.20 0.00 0.91 1.69 0.00 1.76 0.00 0.00 1.60 0.00 0.00 2.51 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.33 1.13 7.81 106 N 7.57 3.80 0.00 2.99 2.86 0.00 0.00 6.90 7.63 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 0.00 107 W 7.61 5.01 0.00 3.22 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 0.00 108 F 9.39 5.38 0.00 2.82 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 0.00 109 V 8.82 4.05 2.01 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 0.62 0.00 0.00 0.47 0.00 0.00 110 G 8.49 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 0.00 0.00 0.00 0.00 111 L 8.55 5.30 0.00 1.45 1.43 0.99 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 112 K 9.04 4.11 0.00 1.90 1.67 0.00 1.63 0.00 0.00 1.60 0.00 0.00 2.89 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.41 1.36 7.81 113 K 8.47 3.86 0.00 1.70 1.85 0.00 1.70 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.38 1.46 7.81 114 N 8.04 4.51 0.00 2.78 2.89 0.00 0.00 6.13 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 G 8.35 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 S 8.71 4.76 0.00 3.94 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 0.00 117 C 8.27 4.78 0.00 2.88 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 0.00 118 K 8.81 4.33 0.00 1.61 1.69 0.00 1.64 0.00 0.00 1.59 0.00 0.00 2.92 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.41 1.35 7.81 119 R 8.51 4.13 0.00 1.78 1.62 0.00 3.18 0.00 0.00 3.24 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.54 0.00 120 G 9.28 3.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 P 0.00 4.14 0.00 1.85 2.12 0.00 2.96 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.30 0.00 122 R 7.90 4.26 0.00 1.78 1.93 0.00 3.30 0.00 0.00 3.25 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.64 0.00 123 T 7.37 5.04 4.34 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 1.28 0.00 0.00 124 H 8.23 5.00 0.00 3.20 3.25 0.00 5.63 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 Y 8.56 4.06 0.00 3.11 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 0.00 126 G 9.10 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 Q 7.56 4.47 0.00 1.98 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.81 6.77 0.00 0.00 0.00 0.00 0.00 2.29 2.44 0.00 128 K 8.28 3.60 0.00 1.78 1.65 0.00 1.59 0.00 0.00 1.71 0.00 0.00 2.81 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.31 1.30 7.81 129 A 8.15 4.02 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 I 6.80 4.57 1.69 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.84 0.64 0.00 0.00 131 L 7.48 4.58 0.00 1.17 0.87 0.09 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 132 F 9.43 5.39 0.00 3.39 3.14 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 0.00 133 L 9.37 5.31 0.00 1.74 1.67 1.11 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 134 P 0.00 5.09 0.00 2.20 2.23 0.00 3.85 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.14 0.00 135 L 9.32 4.99 0.00 1.62 1.62 1.08 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 136 P 0.00 4.65 0.00 2.08 2.07 0.00 3.79 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 1.99 2.01 0.00 137 V 8.28 3.86 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 0.58 0.00 0.00 0.99 0.00 0.00