NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 V 4.0829 8.0544 120.3142 62.2921 32.1609 174.5737 2 H 4.0056 8.3954 126.4738 59.3954 30.9132 173.8867 3 L 4.2519 8.0358 114.8766 54.6857 39.5927 173.0862 4 T 3.6413 7.7245 107.4326 61.3260 69.6838 176.3981 5 A 3.7854 8.2915 128.0688 54.6891 19.5440 179.1060 6 E 3.9643 8.2131 117.0168 59.2647 29.9294 178.5064 7 E 3.9394 8.6935 119.0063 59.2761 29.6089 179.3712 8 K 3.8495 7.9688 118.0180 59.7644 32.1804 179.3092 9 S 4.2499 7.5600 114.7483 60.9273 62.4821 176.3186 10 L 4.0556 8.2605 123.5463 57.2549 41.6786 178.8788 11 V 3.8111 7.4201 118.0527 65.4490 31.7946 178.0829 12 S 4.4214 8.0957 113.7417 60.9759 62.7067 176.0860 13 G 3.9369 7.8657 108.8391 48.2584 0.0000 174.9580 14 L 3.9012 7.6594 123.2779 57.1186 42.1423 178.6972 15 W 4.4291 8.7063 127.5408 59.2737 30.4586 178.1922 16 G 3.7837 8.3815 105.7307 47.0517 0.0000 174.4288 17 K 4.6252 7.4548 117.8144 56.2236 33.1239 176.6949 18 V 3.8174 7.1375 118.8727 63.6887 32.0658 175.9274 19 N 4.5970 8.0983 124.4861 51.5786 37.4351 175.2552 20 V 3.5483 8.0731 116.8038 64.4350 31.8408 177.1503 21 D 4.4761 7.9431 117.3507 56.7380 40.7345 177.6501 22 E 4.4390 8.3595 117.9233 57.3122 30.7211 178.6881 23 V 3.5175 7.5809 118.2366 65.7811 31.7601 178.1332 24 G 3.6988 8.0110 105.1272 47.9015 0.0000 175.8162 25 G 3.6730 8.0069 107.8335 47.0151 0.0000 175.3796 26 E 3.9107 7.8022 121.4393 59.1136 29.6593 178.7467 27 A 3.9492 8.0336 120.9020 55.0508 18.2319 179.3942 28 L 4.0204 7.9542 118.8532 58.1193 41.7832 179.4346 29 G 3.5400 8.0527 105.8534 47.4704 0.0000 175.9363 30 R 3.9865 7.8831 119.6410 58.2630 30.0743 178.7267 31 L 4.0010 7.8366 120.5095 58.3005 42.2816 178.9955 32 L 4.0522 7.3860 119.9513 57.2004 41.2477 179.7892 33 I 3.6396 7.0459 118.5922 64.4177 37.2120 178.3518 34 V 3.5204 7.9482 117.7818 64.2154 32.9008 175.6605 35 Y 4.2420 8.0473 115.8667 54.1819 38.0909 174.1378 36 P 4.7739 0.0000 0.0000 64.8018 31.6642 177.8808 37 W 4.5283 8.2810 115.1265 58.2732 28.1815 176.8508 38 T 4.6352 7.6029 110.5783 62.7107 68.8559 175.7457 39 Q 4.5859 7.9962 120.6215 57.1064 28.7794 177.3813 40 R 3.7432 7.2894 119.6019 59.2604 30.0346 177.1938 41 F 4.3720 7.2155 112.6431 58.1427 39.5851 175.6530 42 F 4.7738 7.6530 120.6968 56.6473 39.4465 177.2061 43 D 4.4725 8.3810 122.2642 57.2122 40.9159 177.9297 44 S 4.6636 8.2701 111.0086 58.5366 63.3590 174.2538 45 F 4.5181 8.4884 118.5518 57.3017 39.6344 177.7960 46 G 3.8786 8.1036 107.7463 45.4514 0.0000 172.7961 47 D 4.6259 8.5957 122.5416 53.8537 41.7371 176.4712 48 L 4.8506 8.3958 124.5918 54.3841 43.1918 177.5984 49 S 4.3742 7.9157 114.6434 60.1817 63.4906 174.3504 50 T 4.7040 7.4401 110.5935 58.2115 71.9309 172.6169 51 P 4.1534 0.0000 0.0000 66.3772 31.1906 178.5901 52 D 4.3470 8.1014 116.6047 57.1915 40.6472 178.4682 53 A 3.9946 8.1954 121.6482 55.0757 18.1387 179.9623 54 V 3.5384 7.5903 115.1932 66.5264 31.8926 177.8409 55 M 4.1773 8.0224 117.1914 57.4733 31.8293 177.8118 56 S 4.6599 7.5011 111.9319 56.9597 64.6062 173.9964 57 N 4.1875 7.4034 122.5800 54.3654 39.1152 175.1552 58 A 4.2560 8.6065 126.6236 53.9685 18.6322 179.1803 59 K 3.8201 8.5688 119.0652 59.0210 32.2488 178.6635 60 V 3.8197 8.2482 118.1601 66.2294 31.2685 178.0143 61 K 3.9453 7.7557 116.0808 59.4736 31.7951 178.9980 62 A 3.9791 8.1411 120.9561 55.6750 18.5076 178.8861 63 H 4.2492 9.2984 117.5899 59.6242 29.8607 177.5320 64 G 3.6853 8.3647 107.6502 47.7372 0.0000 175.5686 65 K 4.0381 8.3100 122.0406 59.1978 32.0326 179.1279 66 K 4.0803 7.9040 118.9134 59.3772 31.4883 179.5766 67 V 3.7237 7.8012 118.3099 65.8350 31.4290 177.8228 68 L 4.3690 8.1132 118.9068 58.3040 41.5483 179.2932 69 N 4.4929 8.1886 115.6297 56.5569 38.5121 177.3759 70 S 4.1913 8.0036 116.4909 62.0209 63.0007 177.0120 71 F 4.1508 8.2651 119.0048 60.2964 38.6038 177.8245 72 S 4.0677 8.5390 113.2313 61.5378 61.9532 175.9832 73 D 4.4466 8.8541 122.0509 57.0948 40.2239 178.9734 74 G 3.6185 7.8552 105.7554 47.5271 0.0000 175.6754 75 L 3.9961 7.6742 120.3809 57.2582 41.6043 179.2739 76 K 4.2218 7.6747 117.3717 57.5519 33.6893 177.0441 77 N 4.9472 7.5775 115.9892 51.4404 38.4590 174.7439 78 L 4.2517 7.8071 118.4688 56.1821 42.6522 177.6514 79 D 4.7307 7.8635 116.8969 54.1545 41.5882 176.6584 80 N 5.0076 7.5553 116.4916 51.6231 39.7692 175.1514 81 L 4.1092 7.8175 122.2287 57.7942 42.4347 179.1851 82 K 4.0136 8.1443 118.2719 59.4501 31.8467 179.0530 83 G 3.7176 7.9515 104.6935 48.4955 0.0000 175.3026 84 T 3.8343 7.3371 116.7110 65.3421 68.5003 175.9366 85 F 4.7684 7.7408 117.4155 57.2705 39.2873 177.4481 86 A 3.9873 7.6437 121.9115 55.7268 18.0194 180.8777 87 K 3.9969 7.8796 115.6516 59.2956 31.7443 179.6312 88 L 4.0972 7.8900 118.9363 57.5049 41.4736 179.2076 89 S 4.2637 8.2811 115.2332 60.8285 62.2863 175.9981 90 E 3.8660 7.9145 121.1932 59.0938 29.0430 179.1920 91 L 3.9004 7.7079 120.3707 58.5375 42.1580 178.7857 92 H 4.2012 7.9377 115.2017 58.8797 28.5384 177.5228 93 C 4.0896 8.0832 119.0266 61.1829 28.1333 174.4493 94 D 4.5843 7.8766 118.4431 54.4747 41.6517 177.3516 95 K 4.4504 7.9216 116.4444 56.8982 34.2997 176.9278 96 L 4.3562 8.1173 117.3108 54.6187 42.5811 176.1113 97 H 4.1282 8.0023 113.8162 56.6730 26.0016 175.0592 98 V 3.6720 7.8953 118.4554 62.0591 32.4007 174.8904 99 D 4.2865 8.5002 126.5627 53.5907 41.6101 174.8380 100 P 3.1702 0.0000 0.0000 63.1705 31.9877 177.7942 101 E 3.8838 8.4179 120.5293 59.4545 29.5517 178.2933 102 N 4.5144 8.1376 115.8424 55.4792 38.4633 177.3858 103 F 4.6039 7.3622 119.9316 60.2130 38.9535 177.6769 104 K 4.0051 8.1306 118.2828 59.4990 31.9308 179.2051 105 L 3.8684 7.8590 118.5624 57.6769 41.5297 179.1683 106 L 4.0818 7.9953 120.1888 58.2027 42.0306 178.8883 107 G 3.9637 7.9943 105.3822 48.4153 0.0000 175.2836 108 N 4.4705 8.3249 119.0553 55.8503 38.6558 177.8601 109 V 3.8135 8.0923 120.1849 64.0020 31.5524 178.3025 110 L 3.8450 8.0055 121.9549 57.9046 41.8535 178.7188 111 V 3.5369 7.9685 118.3521 66.2871 31.4408 177.5399 112 C 3.9926 7.9917 116.3084 63.0957 28.0038 176.4749 113 V 3.5604 7.5942 119.3567 65.8940 30.9557 178.0839 114 L 3.8139 7.6546 118.5572 57.3675 41.3592 179.1392 115 A 3.7069 7.3728 120.7925 55.4697 18.1270 179.1006 116 H 4.1149 8.2147 115.5103 59.7394 29.9387 176.9258 117 H 4.0491 8.4015 117.2405 58.4730 29.0994 177.1250 118 F 4.4413 8.9317 118.4699 55.4741 39.4363 177.6043 119 G 3.8965 9.1225 108.6773 46.8354 0.0000 177.5238 120 K 4.2458 8.9554 126.5437 57.6496 32.2481 177.1306 121 E 4.1660 8.0773 117.2684 59.1243 29.5803 177.5179 122 F 4.5854 7.7614 122.4341 57.0651 37.8742 175.5360 123 T 4.1910 7.5615 115.9758 60.1464 71.2801 173.4720 124 P 4.1364 0.0000 0.0000 65.7487 31.0853 178.8273 125 Q 3.9296 8.0246 116.4466 59.1583 28.6630 179.2079 126 V 3.6487 7.2332 118.9817 65.8223 31.5314 177.7796 127 Q 3.3924 8.1961 119.4684 59.0232 28.6227 178.2347 128 A 4.0062 7.7018 120.4108 54.8194 18.6311 179.3142 129 A 4.0439 7.6588 118.1150 55.7008 18.5515 179.5600 130 Y 3.9877 8.1294 115.0405 61.1093 37.9011 178.9339 131 Q 4.1841 8.4705 119.3866 58.6552 28.7589 178.7708 132 K 4.0056 8.0562 119.8582 59.2314 32.0391 179.5596 133 V 3.4874 7.6430 117.9964 66.1608 31.5356 178.1306 134 V 3.8120 7.9708 117.7491 65.8184 31.2887 177.8875 135 A 4.1040 8.1505 120.7472 55.1574 18.3057 179.9072 136 G 3.5133 8.0322 104.3007 47.7355 0.0000 176.1718 137 V 2.9983 8.1107 120.8069 65.6438 31.3414 177.9785 138 A 3.9057 7.9235 119.3012 54.9027 18.3366 178.5440 139 N 4.5589 8.2002 115.0257 56.2524 39.1522 177.1318 140 A 4.0279 8.2197 121.2565 54.4170 18.3869 178.4885 141 L 4.0160 7.6966 117.4903 55.7942 41.6159 177.3279 142 A 5.0302 7.7591 120.8661 52.9253 19.0836 177.9138 143 H 4.0696 8.1631 121.0403 60.2231 30.0616 177.3588 144 K 4.0701 7.8626 116.6227 58.2973 31.8317 176.8018 145 Y 4.7077 7.5208 115.6668 58.1548 38.8013 175.6459 146 H 4.6257 9.2332 123.0232 55.9327 28.8809 174.9066 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 4.08 2.07 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 0.92 0.00 0.00 0.92 0.00 0.00 2 H 8.40 4.01 0.00 3.16 3.37 0.00 6.07 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 3 L 8.04 4.25 0.00 1.69 1.56 0.83 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 4 T 7.72 3.64 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 5 A 8.29 3.79 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 6 E 8.21 3.96 0.00 1.98 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.33 0.00 7 E 8.69 3.94 0.00 2.11 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.33 0.00 8 K 7.97 3.85 0.00 1.74 1.81 0.00 1.61 0.00 0.00 1.75 0.00 0.00 2.86 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.45 1.72 7.81 9 S 7.56 4.25 0.00 3.73 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 10 L 8.26 4.06 0.00 1.99 1.75 0.92 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 11 V 7.42 3.81 2.02 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 0.59 0.00 0.00 0.45 0.00 0.00 12 S 8.10 4.42 0.00 4.21 4.14 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 13 G 7.87 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 14 L 7.66 3.90 0.00 2.06 2.04 -0.20 0.45 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 15 W 8.71 4.43 0.00 3.80 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 16 G 8.38 3.78 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 0.00 0.00 0.00 17 K 7.45 4.63 0.00 2.08 1.98 0.00 1.93 0.00 0.00 1.76 0.00 0.00 3.00 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.45 1.70 7.81 18 V 7.14 3.82 1.39 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 0.18 0.00 0.00 0.46 0.00 0.00 19 N 8.10 4.60 0.00 2.65 2.60 0.00 0.00 7.01 7.71 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 20 V 8.07 3.55 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 0.80 0.00 0.00 0.92 0.00 0.00 21 D 7.94 4.48 0.00 2.77 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 22 E 8.36 4.44 0.00 1.97 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 0.00 2.21 2.25 0.00 23 V 7.58 3.52 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 0.85 0.00 0.00 0.60 0.00 0.00 24 G 8.01 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 25 G 8.01 3.67 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 0.00 0.00 0.00 26 E 7.80 3.91 0.00 2.27 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 2.26 2.30 0.00 27 A 8.03 3.95 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 28 L 7.95 4.02 0.00 1.90 1.79 0.81 0.94 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 29 G 8.05 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 R 7.88 3.99 0.00 1.99 1.93 0.00 3.07 0.00 0.00 3.01 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.81 0.00 31 L 7.84 4.00 0.00 1.92 1.85 0.96 0.73 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 32 L 7.39 4.05 0.00 1.61 1.62 0.55 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 33 I 7.05 3.64 1.91 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.47 0.83 0.00 0.00 34 V 7.95 3.52 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 0.19 0.00 0.00 0.81 0.00 0.00 35 Y 8.05 4.24 0.00 2.23 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 36 P 0.00 4.77 0.00 2.32 2.34 0.00 3.88 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 1.93 0.00 37 W 8.28 4.53 0.00 3.60 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 38 T 7.60 4.64 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 0.82 0.00 0.00 39 Q 8.00 4.59 0.00 2.21 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.78 0.00 0.00 0.00 0.00 0.00 2.38 2.50 0.00 40 R 7.29 3.74 0.00 1.66 1.68 0.00 3.05 0.00 0.00 2.86 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.20 0.00 41 F 7.22 4.37 0.00 2.29 2.51 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 0.00 0.00 0.00 0.00 42 F 7.65 4.77 0.00 2.94 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 0.00 0.00 0.00 0.00 43 D 8.38 4.47 0.00 2.69 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 44 S 8.27 4.66 0.00 4.07 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 F 8.49 4.52 0.00 3.26 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 46 G 8.10 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 47 D 8.60 4.63 0.00 2.67 2.61 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 48 L 8.40 4.85 0.00 1.64 1.59 1.02 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 49 S 7.92 4.37 0.00 4.06 4.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.44 4.70 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 1.21 0.00 0.00 51 P 0.00 4.15 0.00 2.15 2.15 0.00 3.58 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 2.10 2.18 0.00 52 D 8.10 4.35 0.00 2.71 2.70 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 53 A 8.20 3.99 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 54 V 7.59 3.54 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 0.97 0.00 0.00 55 M 8.02 4.18 0.00 2.00 2.21 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.56 0.00 56 S 7.50 4.66 0.00 3.95 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 57 N 7.40 4.19 0.00 2.89 2.97 0.00 0.00 6.95 8.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 A 8.61 4.26 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 59 K 8.57 3.82 0.00 1.59 1.37 0.00 1.17 0.00 0.00 0.61 0.00 0.00 2.13 0.00 0.00 2.62 0.00 0.00 0.00 0.00 0.85 1.13 7.81 60 V 8.25 3.82 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 1.05 0.00 0.00 1.08 0.00 0.00 61 K 7.76 3.95 0.00 2.08 1.84 0.00 1.73 0.00 0.00 1.65 0.00 0.00 3.16 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.46 1.58 7.81 62 A 8.14 3.98 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 63 H 9.30 4.25 0.00 3.44 3.78 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 64 G 8.36 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 65 K 8.31 4.04 0.00 2.04 1.85 0.00 1.70 0.00 0.00 1.78 0.00 0.00 2.98 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.62 1.64 7.81 66 K 7.90 4.08 0.00 2.12 1.89 0.00 1.65 0.00 0.00 1.83 0.00 0.00 3.02 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.53 1.54 7.81 67 V 7.80 3.72 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.92 0.00 0.00 68 L 8.11 4.37 0.00 2.13 1.92 0.87 0.95 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 69 N 8.19 4.49 0.00 3.09 2.95 0.00 0.00 7.05 6.94 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 70 S 8.00 4.19 0.00 4.14 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 71 F 8.27 4.15 0.00 3.61 2.98 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 72 S 8.54 4.07 0.00 4.36 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 73 D 8.85 4.45 0.00 2.73 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 0.00 0.00 0.00 0.00 74 G 7.86 3.62 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 0.00 0.00 0.00 75 L 7.67 4.00 0.00 1.49 1.48 0.62 -0.64 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 76 K 7.67 4.22 0.00 1.67 1.82 0.00 1.66 0.00 0.00 1.67 0.00 0.00 3.00 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.63 1.61 7.81 77 N 7.58 4.95 0.00 2.65 2.62 0.00 0.00 6.90 6.40 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 78 L 7.81 4.25 0.00 1.57 1.66 0.81 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 79 D 7.86 4.73 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 80 N 7.56 5.01 0.00 2.76 2.58 0.00 0.00 7.20 6.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 L 7.82 4.11 0.00 1.81 1.81 1.04 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 82 K 8.14 4.01 0.00 1.75 1.77 0.00 1.55 0.00 0.00 1.39 0.00 0.00 2.91 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.46 1.47 7.81 83 G 7.95 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 84 T 7.34 3.83 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 0.34 0.00 0.00 85 F 7.74 4.77 0.00 3.12 2.82 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 86 A 7.64 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 87 K 7.88 4.00 0.00 1.79 1.86 0.00 1.65 0.00 0.00 1.80 0.00 0.00 2.94 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.51 1.50 7.81 88 L 7.89 4.10 0.00 1.79 1.74 1.04 0.89 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 89 S 8.28 4.26 0.00 3.86 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 90 E 7.91 3.87 0.00 2.17 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 0.00 2.43 2.28 0.00 91 L 7.71 3.90 0.00 1.70 1.81 0.91 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 92 H 7.94 4.20 0.00 3.38 3.64 0.00 5.86 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 C 8.08 4.09 0.00 2.60 1.74 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 94 D 7.88 4.58 0.00 2.87 2.65 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 95 K 7.92 4.45 0.00 1.88 1.81 0.00 1.61 0.00 0.00 1.67 0.00 0.00 3.11 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.32 1.48 7.81 96 L 8.12 4.36 0.00 1.67 1.62 0.69 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 97 H 8.00 4.13 0.00 3.45 3.51 0.00 5.69 0.00 0.00 0.00 0.00 8.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 7.90 3.67 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 0.37 0.00 0.00 0.43 0.00 0.00 99 D 8.50 4.29 0.00 2.76 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 0.00 100 P 0.00 3.17 0.00 2.15 2.15 0.00 3.35 0.00 0.00 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 2.18 0.00 101 E 8.42 3.88 0.00 2.14 1.91 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 2.28 2.40 0.00 102 N 8.14 4.51 0.00 2.82 2.88 0.00 0.00 7.08 8.81 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 0.00 103 F 7.36 4.60 0.00 3.18 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 0.00 104 K 8.13 4.01 0.00 2.13 1.88 0.00 1.68 0.00 0.00 1.67 0.00 0.00 2.94 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.51 1.53 7.81 105 L 7.86 3.87 0.00 1.72 1.32 0.40 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 106 L 8.00 4.08 0.00 1.89 1.81 0.98 1.24 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 0.00 107 G 7.99 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 0.00 108 N 8.32 4.47 0.00 2.99 2.95 0.00 0.00 6.82 7.83 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 0.00 109 V 8.09 3.81 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.98 0.00 0.00 110 L 8.01 3.85 0.00 1.80 1.85 0.44 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 111 V 7.97 3.54 2.32 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 1.30 0.00 0.00 1.13 0.00 0.00 112 C 7.99 3.99 0.00 3.21 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 0.00 113 V 7.59 3.56 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 0.79 0.00 0.00 0.91 0.00 0.00 114 L 7.65 3.81 0.00 1.09 0.98 0.59 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 115 A 7.37 3.71 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 0.00 116 H 8.21 4.11 0.00 3.17 3.45 0.00 5.77 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 0.00 117 H 8.40 4.05 0.00 2.92 2.69 0.00 5.71 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 0.00 118 F 8.93 4.44 0.00 3.20 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 0.00 119 G 9.12 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 0.00 120 K 8.96 4.25 0.00 1.75 1.88 0.00 1.74 0.00 0.00 1.75 0.00 0.00 3.13 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.45 1.55 7.81 121 E 8.08 4.17 0.00 2.39 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 0.00 2.42 2.34 0.00 122 F 7.76 4.59 0.00 2.89 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 0.00 123 T 7.56 4.19 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 124 P 0.00 4.14 0.00 2.15 2.13 0.00 3.59 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.18 0.00 125 Q 8.02 3.93 0.00 2.09 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.93 0.00 0.00 0.00 0.00 0.00 2.44 2.47 0.00 126 V 7.23 3.65 1.94 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 1.01 0.00 0.00 0.90 0.00 0.00 127 Q 8.20 3.39 0.00 1.60 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.57 0.00 0.00 0.00 0.00 0.00 2.38 2.51 0.00 128 A 7.70 4.01 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 0.00 129 A 7.66 4.04 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 0.00 130 Y 8.13 3.99 0.00 3.28 3.23 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 0.00 131 Q 8.47 4.18 0.00 2.29 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.82 0.00 0.00 0.00 0.00 0.00 2.74 2.60 0.00 132 K 8.06 4.01 0.00 2.07 1.84 0.00 1.65 0.00 0.00 1.58 0.00 0.00 2.90 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.47 1.60 7.81 133 V 7.64 3.49 2.19 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 1.06 0.00 0.00 0.74 0.00 0.00 134 V 7.97 3.81 2.34 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 1.16 0.00 0.00 1.15 0.00 0.00 135 A 8.15 4.10 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 0.00 136 G 8.03 3.51 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 V 8.11 3.00 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 -0.37 0.00 0.00 0.84 0.00 0.00 138 A 7.92 3.91 1.51 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 0.00 0.00 0.00 0.00 0.00 0.00 139 N 8.20 4.56 0.00 2.90 3.15 0.00 0.00 7.01 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 A 8.22 4.03 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 0.00 141 L 7.70 4.02 0.00 1.40 0.99 -0.09 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 142 A 7.76 5.03 1.58 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 0.00 0.00 143 H 8.16 4.07 0.00 3.30 3.30 0.00 5.68 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 0.00 144 K 7.86 4.07 0.00 1.57 1.66 0.00 1.71 0.00 0.00 1.70 0.00 0.00 2.94 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.43 1.49 7.81 145 Y 7.52 4.71 0.00 3.16 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 0.00 146 H 9.23 4.63 0.00 3.00 3.11 0.00 5.69 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00