NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.2942 8.1733 122.0454 56.2922 34.1964 174.1917 2 F 4.9384 8.7149 124.7655 55.4842 39.9425 175.1075 3 F 4.4959 10.0798 124.7277 57.3999 40.3537 174.9135 4 E 4.3170 9.1312 120.6760 55.4513 31.0325 176.8007 5 R 3.3830 9.0390 121.0381 61.0154 30.0387 179.3598 6 C 4.3399 8.0433 115.3436 59.7317 40.2536 175.6863 7 E 3.9129 8.1552 120.7213 59.2707 29.2434 178.5553 8 L 3.7028 8.1066 120.1186 57.8089 42.0137 178.5631 9 A 3.9555 7.8836 120.7865 55.4928 18.2397 179.9192 10 R 3.9142 8.1277 116.3351 59.3944 29.9836 179.3865 11 T 3.8696 7.8881 115.7527 66.5882 68.5645 176.6901 12 L 3.8387 8.2024 121.3104 57.4866 41.6382 179.4152 13 K 3.9217 8.1856 119.6813 59.7274 31.9546 179.0903 14 R 3.9831 8.0742 117.2440 58.9063 30.0183 178.1292 15 L 4.3220 7.3340 116.3450 54.4865 41.7665 177.1613 16 G 3.8641 7.9482 107.0720 46.7047 0.0000 174.8545 17 M 4.0026 7.7391 120.5037 56.1565 32.4624 175.6283 18 D 4.4068 8.0254 117.6302 56.0003 40.8534 175.7165 19 G 3.9345 9.3588 115.5844 45.3679 0.0000 171.2029 20 Y 4.1290 8.2874 121.9428 58.8159 38.9182 176.4730 21 R 3.5879 8.9758 126.9201 57.2758 27.8207 177.2354 22 G 3.8063 8.3335 103.2983 45.7489 0.0000 174.0284 23 I 4.0402 7.6083 122.1143 59.1762 37.7704 175.9670 24 S 4.6315 8.3089 120.2944 57.7321 63.8548 174.9630 25 L 4.2356 8.7351 122.7697 58.5177 41.7078 179.1366 26 A 4.1277 7.7028 121.1166 55.1787 18.2625 179.4508 27 N 4.4344 8.0757 115.0585 56.3744 38.5599 177.7174 28 W 4.2351 7.9721 119.8836 59.8754 29.1087 178.3814 29 M 4.1113 8.4950 118.9737 58.5917 31.4846 177.8452 30 C 3.1803 8.1409 118.8640 59.1818 44.5201 175.3473 31 L 3.9959 8.1336 121.5456 58.3547 41.7780 178.9314 32 A 4.2525 8.3800 122.1835 54.2718 18.1847 179.4589 33 K 2.9113 8.3182 118.5879 59.4495 32.0743 179.2237 34 W 4.2358 7.8278 117.4675 59.3705 29.0247 178.3054 35 E 4.3651 8.3921 118.7626 58.7822 29.2131 177.9569 36 S 4.4674 7.9322 108.7023 57.1187 65.3268 174.6608 37 G 3.6563 8.5426 108.8515 46.9270 0.0000 173.5205 38 Y 3.6039 7.7030 114.0690 58.6393 35.1115 168.2780 39 N 4.5985 7.3401 119.7904 51.6716 39.5643 175.7280 40 T 3.9878 8.5740 117.4592 64.0278 69.0588 175.9347 41 R 4.3925 7.9363 119.1897 55.7210 30.8017 176.3103 42 A 4.2722 7.5430 121.5199 52.6990 19.3290 176.9608 43 T 5.0251 8.2770 110.5521 60.2091 72.4041 173.1239 44 N 4.8418 8.7123 122.1677 52.4170 42.2678 172.4586 45 Y 4.6266 8.7525 128.2355 57.4063 40.7583 173.9331 46 N 4.8181 8.5567 124.7615 51.0967 38.5911 175.2875 47 A 3.6066 8.1671 127.3491 54.6142 19.0077 179.3272 48 G 3.7194 8.0639 104.4359 48.1371 0.0000 173.9784 49 D 4.7660 7.5855 116.4258 51.9269 40.0225 175.9606 50 R 3.9778 8.0423 116.1508 56.9627 28.2372 175.8419 51 S 4.9851 7.2321 108.1892 56.9941 66.6070 172.6581 52 T 5.1065 8.8243 115.6458 61.9819 72.8142 172.9298 53 D 5.3082 8.9207 125.6726 53.3780 43.0007 175.0676 54 Y 4.8429 9.1302 121.1749 57.4132 41.5141 177.4977 55 G 4.3297 8.9226 111.6277 46.0388 0.0000 173.6136 56 I 3.9368 7.9917 116.4470 62.8086 37.9973 178.0116 57 F 4.8394 7.8562 115.7547 56.3972 40.0486 175.0787 58 Q 3.6130 7.8585 119.2548 57.0990 26.5493 174.1459 59 I 4.3744 8.1806 118.9750 61.0793 39.1658 176.9834 60 N 5.3547 9.2167 126.2009 53.4662 39.7266 175.7786 61 S 4.6498 9.1952 120.6139 60.4141 63.3452 175.4902 62 R 3.7501 8.9699 122.6505 58.9102 30.2897 177.8103 63 Y 3.7330 7.7802 114.2325 57.6351 40.6699 177.3460 64 W 4.7775 8.0642 118.9535 57.8259 30.3608 173.6808 65 C 5.6131 7.9638 110.5774 53.4475 45.7982 171.7724 66 N 4.8555 8.9807 119.5742 52.0460 39.6452 174.6588 67 D 4.8269 8.6703 123.4337 52.2875 40.1952 177.4791 68 G 3.9752 8.4020 107.3756 46.2216 0.0000 174.6011 69 K 4.4652 8.0786 116.6159 56.5866 33.0990 175.7422 70 T 4.5875 7.7090 117.3704 61.3451 69.2883 172.3448 71 P 4.2566 0.0000 0.0000 64.0940 31.7078 176.2002 72 G 3.9416 8.7995 109.7517 46.2922 0.0000 173.0695 73 A 4.2828 7.4621 119.6875 51.4694 19.4972 177.9312 74 V 4.2994 8.6766 113.7976 59.4104 35.3529 176.1895 75 N 4.9305 8.0430 116.8802 52.1857 37.9360 174.5603 76 A 3.9852 9.2056 125.4987 54.8867 19.0844 178.5739 77 C 4.5496 8.6940 111.2569 57.4810 41.1694 173.1000 78 H 4.0982 7.7726 116.3703 56.3996 26.1922 174.2426 79 L 4.7683 8.4798 118.4489 52.8546 46.5711 176.6434 80 S 4.6021 8.4262 116.1928 58.1143 63.2428 175.9818 81 C 4.0487 8.6920 124.3104 59.7001 40.8209 176.3476 82 S 3.8594 7.8251 114.6245 61.2929 61.6258 175.9962 83 A 4.0673 7.8634 122.5146 54.3392 17.9118 177.9071 84 L 4.4519 7.7775 116.5751 54.9833 41.7403 177.5803 85 L 5.0022 7.8321 117.1630 54.5297 42.3577 176.7077 86 Q 4.3635 7.7756 117.6397 55.2779 29.6081 175.9594 87 D 4.3829 8.5614 120.3543 57.2102 41.1125 176.7467 88 N 4.5437 8.0244 118.2192 53.2865 39.1389 174.5972 89 I 4.2027 8.4534 118.9927 60.9998 37.9724 177.0013 90 A 3.9259 8.6072 125.0892 56.0243 18.1997 180.0992 91 D 4.2824 8.0776 116.4543 57.4201 40.8557 178.7585 92 A 4.0937 7.9466 120.9321 55.0338 18.3538 179.7488 93 V 3.3766 8.2931 117.1722 65.9334 31.6345 178.0906 94 A 3.8128 8.0394 120.6452 55.2813 18.1428 178.8660 95 C 4.2041 8.3802 116.7624 59.7042 38.8809 175.5596 96 A 3.9254 8.2157 122.7607 55.1025 17.5719 179.8061 97 K 3.7422 7.7163 116.4238 59.3696 32.1764 179.1776 98 R 4.0705 7.7380 118.9544 59.3160 30.1143 178.6087 99 V 2.5361 7.4706 117.9749 65.8499 31.3158 178.2132 100 V 3.8648 7.7180 110.3722 63.1369 31.2371 178.1898 101 R 4.1330 7.6675 117.5882 57.3695 30.4227 176.5373 102 D 4.6996 7.5006 119.1203 52.7255 41.7085 175.2019 103 P 4.2261 0.0000 0.0000 66.4081 30.9950 177.8835 104 Q 4.0201 8.1290 117.2171 56.3645 30.0684 177.1266 105 G 3.7664 7.9040 107.1149 46.9072 0.0000 176.2554 106 I 3.5455 7.7638 120.5582 63.3996 37.9281 177.7720 107 R 4.2580 7.2513 117.6008 57.6656 30.0165 177.3271 108 A 3.9048 7.6828 121.3879 54.3644 18.6374 177.8707 109 W 4.6701 8.1127 116.9588 55.4494 29.9020 177.6019 110 V 3.7412 8.7386 123.5606 66.0224 30.9055 177.7104 111 A 4.0181 8.2768 120.1754 54.6250 18.1407 179.2891 112 W 3.9651 8.3369 127.0917 60.6760 30.6000 178.4236 113 R 3.7705 8.2198 116.3103 59.4186 29.6672 178.3868 114 N 4.4226 8.1983 115.1702 55.3945 38.6428 176.2044 115 R 4.2621 7.8406 115.3624 55.7295 31.6363 175.4394 116 C 4.5595 7.2553 114.1405 57.5169 43.2141 174.2889 117 Q 3.2509 6.8653 120.7472 56.9486 28.7157 175.4720 118 N 4.1695 8.5397 122.1696 54.6245 36.3124 173.9475 119 R 4.5436 7.3543 113.9332 54.1961 33.2735 176.2158 120 D 4.5799 8.4191 119.5979 53.8694 40.0836 175.9939 121 V 4.5106 8.1052 117.9159 61.1987 32.4805 178.2857 122 R 4.0128 8.0859 122.2224 59.5727 29.6194 178.4683 123 Q 3.9234 8.2015 115.7482 59.9053 28.1043 178.5889 124 Y 4.3588 8.0302 117.4805 59.8359 38.3622 176.6946 125 V 4.3902 7.9646 110.8753 60.7399 33.0525 175.5208 126 Q 4.1975 8.0116 120.2825 57.2141 28.8392 176.6504 127 G 3.9325 8.9105 110.1802 46.2143 0.0000 174.5316 128 C 4.4648 8.0759 115.6467 56.4400 40.6989 174.2651 129 G 3.8768 8.1697 107.1840 46.5668 0.0000 174.1235 130 V 4.0054 7.8491 118.1038 61.0797 31.9926 175.8310 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 K 8.17 4.29 0.00 1.75 1.83 0.00 1.30 0.00 0.00 1.17 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.02 1.18 7.81 2 F 8.71 4.94 0.00 3.03 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 3 F 10.08 4.50 0.00 2.80 2.88 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 4 E 9.13 4.32 0.00 1.94 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 2.32 2.41 0.00 5 R 9.04 3.38 0.00 1.99 1.94 0.00 3.39 0.00 0.00 3.46 7.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.88 0.00 6 C 8.04 4.34 0.00 3.01 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 7 E 8.16 3.91 0.00 2.07 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 2.62 2.43 0.00 8 L 8.11 3.70 0.00 1.42 1.41 -0.15 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 9 A 7.88 3.96 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 10 R 8.13 3.91 0.00 1.89 1.99 0.00 3.14 0.00 0.00 3.32 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.80 0.00 11 T 7.89 3.87 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 1.25 0.00 0.00 12 L 8.20 3.84 0.00 1.75 1.58 0.92 0.31 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 13 K 8.19 3.92 0.00 1.92 1.92 0.00 1.66 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.45 1.50 7.81 14 R 8.07 3.98 0.00 1.94 1.97 0.00 3.21 0.00 0.00 3.23 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.83 0.00 15 L 7.33 4.32 0.00 1.56 1.57 0.87 0.97 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 16 G 7.95 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 0.00 0.00 0.00 17 M 7.74 4.00 0.00 1.40 1.99 0.00 0.00 0.00 0.00 0.00 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.20 0.00 18 D 8.03 4.41 0.00 2.69 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 19 G 9.36 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 20 Y 8.29 4.13 0.00 3.37 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 21 R 8.98 3.59 0.00 1.87 1.83 0.00 3.33 0.00 0.00 2.95 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.38 0.00 22 G 8.33 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 23 I 7.61 4.04 1.81 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.65 -0.28 0.00 0.00 24 S 8.31 4.63 0.00 4.05 4.02 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 25 L 8.74 4.24 0.00 1.89 1.81 1.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 26 A 7.70 4.13 1.59 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 0.00 0.00 27 N 8.08 4.43 0.00 2.76 2.70 0.00 0.00 6.95 8.78 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 28 W 7.97 4.24 0.00 3.55 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 29 M 8.50 4.11 0.00 2.10 2.31 0.00 0.00 0.00 0.00 0.00 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.94 0.00 30 C 8.14 3.18 0.00 2.71 3.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 L 8.13 4.00 0.00 1.89 1.88 0.62 -0.38 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 32 A 8.38 4.25 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 K 8.32 2.91 0.00 1.69 1.60 0.00 0.61 0.00 0.00 0.67 0.00 0.00 2.79 0.00 0.00 2.48 0.00 0.00 0.00 0.00 1.24 0.56 7.81 34 W 7.83 4.24 0.00 3.35 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 35 E 8.39 4.37 0.00 2.03 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 2.56 2.52 0.00 36 S 7.93 4.47 0.00 3.98 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 G 8.54 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 Y 7.70 3.60 0.00 3.36 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 39 N 7.34 4.60 0.00 1.44 2.39 0.00 0.00 7.00 7.29 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 40 T 8.57 3.99 4.42 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 1.48 0.00 0.00 41 R 7.94 4.39 0.00 1.93 2.00 0.00 3.19 0.00 0.00 3.24 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.54 0.00 42 A 7.54 4.27 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 43 T 8.28 5.03 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 44 N 8.71 4.84 0.00 2.86 2.76 0.00 0.00 6.82 7.56 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 45 Y 8.75 4.63 0.00 3.00 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 46 N 8.56 4.82 0.00 2.60 2.58 0.00 0.00 6.61 7.87 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 47 A 8.17 3.61 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 48 G 8.06 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 D 7.59 4.77 0.00 2.74 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 R 8.04 3.98 0.00 2.04 2.17 0.00 3.12 0.00 0.00 3.20 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.54 0.00 51 S 7.23 4.99 0.00 4.01 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 T 8.82 5.11 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 0.61 0.00 0.00 53 D 8.92 5.31 0.00 2.71 2.81 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 54 Y 9.13 4.84 0.00 2.92 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 55 G 8.92 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 I 7.99 3.94 1.57 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 2.25 -0.14 0.00 0.00 57 F 7.86 4.84 0.00 3.20 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 Q 7.86 3.61 0.00 2.55 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.91 6.84 0.00 0.00 0.00 0.00 0.00 2.49 2.70 0.00 59 I 8.18 4.37 2.14 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.11 1.12 0.00 0.00 60 N 9.22 5.35 0.00 3.09 3.04 0.00 0.00 6.97 7.21 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 61 S 9.20 4.65 0.00 4.07 4.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 R 8.97 3.75 0.00 1.57 1.32 0.00 2.65 0.00 0.00 2.81 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.91 0.00 63 Y 7.78 3.73 0.00 1.54 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 0.00 0.00 0.00 64 W 8.06 4.78 0.00 3.65 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 C 7.96 5.61 0.00 3.23 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 66 N 8.98 4.86 0.00 2.76 2.68 0.00 0.00 7.13 8.28 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 67 D 8.67 4.83 0.00 2.85 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 G 8.40 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 0.00 0.00 0.00 69 K 8.08 4.47 0.00 1.85 1.89 0.00 1.59 0.00 0.00 1.73 0.00 0.00 3.16 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.51 1.44 7.81 70 T 7.71 4.59 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 1.16 0.00 0.00 71 P 0.00 4.26 0.00 2.01 1.99 0.00 3.82 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.10 0.00 72 G 8.80 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 0.00 0.00 0.00 73 A 7.46 4.28 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 74 V 8.68 4.30 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 0.62 0.00 0.00 0.88 0.00 0.00 75 N 8.04 4.93 0.00 2.74 2.55 0.00 0.00 6.78 8.64 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 76 A 9.21 3.99 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 77 C 8.69 4.55 0.00 3.27 3.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 H 7.77 4.10 0.00 3.31 3.36 0.00 5.82 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 L 8.48 4.77 0.00 1.67 1.49 1.00 0.71 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 80 S 8.43 4.60 0.00 3.82 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 81 C 8.69 4.05 0.00 2.21 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 82 S 7.83 3.86 0.00 3.88 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 A 7.86 4.07 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 84 L 7.78 4.45 0.00 1.90 1.79 1.07 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 85 L 7.83 5.00 0.00 1.77 1.68 1.10 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 86 Q 7.78 4.36 0.00 2.20 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.49 7.08 0.00 0.00 0.00 0.00 0.00 2.36 2.46 0.00 87 D 8.56 4.38 0.00 2.62 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 88 N 8.02 4.54 0.00 2.69 2.75 0.00 0.00 6.95 7.94 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 89 I 8.45 4.20 1.72 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 1.57 0.96 0.92 0.00 0.00 90 A 8.61 3.93 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 91 D 8.08 4.28 0.00 2.74 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 92 A 7.95 4.09 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 93 V 8.29 3.38 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.00 0.00 0.83 0.00 0.00 94 A 8.04 3.81 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 95 C 8.38 4.20 0.00 3.14 3.28 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 96 A 8.22 3.93 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 K 7.72 3.74 0.00 1.60 1.38 0.00 1.30 0.00 0.00 0.86 0.00 0.00 2.34 0.00 0.00 2.53 0.00 0.00 0.00 0.00 0.30 0.92 7.81 98 R 7.74 4.07 0.00 1.99 2.14 0.00 3.29 0.00 0.00 3.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.99 0.00 99 V 7.47 2.54 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.28 0.00 0.00 -0.58 0.00 0.00 100 V 7.72 3.86 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 1.09 0.00 0.00 1.45 0.00 0.00 101 R 7.67 4.13 0.00 1.98 2.05 0.00 3.24 0.00 0.00 3.39 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 2.13 0.00 102 D 7.50 4.70 0.00 3.08 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 P 0.00 4.23 0.00 2.15 2.20 0.00 3.78 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.01 0.00 104 Q 8.13 4.02 0.00 2.07 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.83 0.00 0.00 0.00 0.00 0.00 2.42 2.32 0.00 105 G 7.90 3.77 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 0.00 0.00 0.00 106 I 7.76 3.55 0.99 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.34 -0.74 0.00 0.00 107 R 7.25 4.26 0.00 2.00 2.03 0.00 3.23 0.00 0.00 3.28 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.52 0.00 108 A 7.68 3.90 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 W 8.11 4.67 0.00 3.52 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 V 8.74 3.74 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 1.00 0.00 0.00 111 A 8.28 4.02 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 0.00 112 W 8.34 3.97 0.00 3.51 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 R 8.22 3.77 0.00 2.05 2.01 0.00 3.34 0.00 0.00 3.33 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 2.01 0.00 114 N 8.20 4.42 0.00 2.66 2.72 0.00 0.00 6.88 7.85 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 0.00 115 R 7.84 4.26 0.00 1.15 0.76 0.00 2.46 0.00 0.00 2.25 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 1.05 0.00 116 C 7.26 4.56 0.00 1.70 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 0.00 117 Q 6.87 3.25 0.00 0.93 1.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.77 0.00 0.00 0.00 0.00 0.00 2.18 2.17 0.00 118 N 8.54 4.17 0.00 2.79 2.81 0.00 0.00 6.90 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 0.00 119 R 7.35 4.54 0.00 1.79 1.79 0.00 3.25 0.00 0.00 3.06 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.55 0.00 120 D 8.42 4.58 0.00 2.64 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 V 8.11 4.51 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 0.91 0.00 0.00 1.05 0.00 0.00 122 R 8.09 4.01 0.00 1.95 2.03 0.00 3.18 0.00 0.00 3.24 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.70 0.00 123 Q 8.20 3.92 0.00 1.97 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 7.12 0.00 0.00 0.00 0.00 0.00 2.07 1.51 0.00 124 Y 8.03 4.36 0.00 3.25 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 0.00 125 V 7.96 4.39 2.14 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 0.97 0.00 0.00 1.06 0.00 0.00 126 Q 8.01 4.20 0.00 2.04 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.08 0.00 0.00 0.00 0.00 0.00 2.49 2.31 0.00 127 G 8.91 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 0.00 128 C 8.08 4.46 0.00 3.10 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 0.00 129 G 8.17 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 0.00 130 V 7.85 4.01 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 0.79 0.00 0.00 0.97 0.00 0.00