NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 E 4.2659 8.4449 121.4885 54.2436 31.9984 174.6429 3 Q 4.3913 7.9532 117.4567 53.7852 32.3102 173.3918 4 Y 4.7682 8.7891 122.4572 56.9484 39.6427 173.8191 5 Y 5.9791 8.5191 125.8396 55.8137 41.4846 174.4294 6 G 3.9556 6.8800 110.0673 44.8961 0.0000 172.0403 7 T 4.4046 8.4272 121.3843 62.5068 68.5177 174.1358 8 G 3.9571 8.5001 114.8535 45.1191 0.0000 171.3049 9 R 5.2870 7.6250 119.0620 56.0195 33.3200 173.8414 10 R 4.2489 8.4648 120.4231 56.5806 32.5979 173.9092 11 K 4.0460 9.4451 128.7732 57.8491 30.8498 174.9899 12 E 3.5580 8.0791 114.2725 55.7198 26.5128 174.8287 13 A 4.6862 7.4721 114.5213 52.3123 23.0123 176.3463 14 V 4.8410 8.1033 121.0429 61.8684 34.2571 174.3555 15 A 4.8172 8.7871 129.6395 50.2008 21.7235 175.3927 16 R 4.5510 8.3885 122.7831 55.5817 30.9923 175.5819 17 V 4.4394 7.6059 124.8925 61.1745 33.5527 174.8657 18 F 6.1381 9.1161 125.7843 55.3675 43.0674 174.9494 19 L 4.5262 8.5712 119.5470 53.8383 44.8062 174.7446 20 R 4.3331 8.5006 123.7605 53.6741 31.5816 174.4942 21 P 4.9017 0.0000 0.0000 60.6667 32.0380 175.6436 22 G 4.4962 7.9078 113.6737 46.3800 0.0000 174.6131 23 N 4.7518 9.3998 126.7941 53.0709 36.6183 176.4871 24 G 4.2526 6.9450 115.5190 46.4682 0.0000 173.4241 25 K 4.0515 8.0172 119.1437 56.9996 33.8497 175.8236 26 V 5.5253 8.2299 119.8166 60.7634 35.5202 174.0061 27 T 5.2084 8.4313 121.5299 61.8706 73.4185 172.9388 28 V 4.8650 8.6464 124.1428 61.1703 34.7529 174.4695 29 N 3.9852 9.4800 119.7735 55.5964 35.2142 174.1781 30 G 4.2040 7.9477 111.9375 45.3685 0.0000 170.6380 31 Q 4.4515 7.5651 115.3448 52.9999 32.8926 172.6567 32 D 4.6768 8.6867 123.2616 54.5423 43.0635 177.7330 33 F 4.0418 8.8650 126.4150 61.6928 39.3906 177.5450 34 N 4.2556 8.3920 113.5366 55.3155 38.5438 176.1736 35 E 4.2263 7.9313 119.4209 58.2470 30.1823 176.9984 36 Y 4.1672 7.5690 118.6896 59.6821 39.7749 176.3420 37 F 4.7619 7.1638 118.8337 56.6346 38.7188 175.5300 38 Q 4.2542 7.5785 121.9862 56.1483 30.4671 176.4864 39 G 3.9168 8.6638 110.3342 45.5925 0.0000 173.3208 40 L 4.3874 7.3249 121.1143 53.3881 42.1379 177.1936 41 V 3.9927 8.2619 122.8785 63.3369 31.9621 176.2468 42 R 4.1201 7.7232 118.4783 58.1770 30.7585 177.5789 43 A 3.7297 7.5596 121.6880 55.8181 18.1763 179.5525 44 V 4.2348 7.7568 104.0458 62.1588 31.3312 177.2547 45 A 4.1610 8.4281 125.8370 54.6623 18.7633 180.2368 46 A 4.0176 7.7711 118.6596 55.5094 18.4656 179.2514 47 L 4.2578 7.6750 114.3984 55.1110 41.4242 178.4355 48 E 4.2519 7.6800 120.5773 57.8500 29.9315 175.1627 49 P 4.1851 0.0000 0.0000 65.3657 31.5534 178.3387 50 L 3.9985 7.8241 118.5148 57.1746 41.3358 178.3442 51 R 4.5989 7.4184 114.6499 56.0999 30.4408 176.5716 52 A 4.8011 7.6305 120.6448 51.8487 19.4635 177.5424 53 V 4.3888 7.9638 109.9514 61.2338 34.1450 176.1828 54 D 4.9288 8.3806 117.6926 53.6891 40.3329 175.1137 55 A 4.8428 7.7333 121.1269 50.5316 18.3031 175.1968 56 L 4.4216 7.9185 123.2253 55.5566 43.5767 176.9196 57 G 4.1386 8.0017 105.7635 45.7447 0.0000 173.8235 58 R 4.3464 7.9372 115.9139 55.0694 32.8449 174.9235 59 F 4.8292 7.9687 116.8468 55.5038 41.5445 174.3176 60 D 5.1142 9.2894 124.2769 53.4960 40.2427 174.4117 61 A 4.8459 8.3679 125.0720 51.2999 20.0521 175.1862 62 Y 4.8335 8.9189 124.5049 56.1813 40.9733 174.2616 63 I 5.2369 8.3557 127.7650 59.0780 40.9350 175.1662 64 T 5.3411 8.0199 121.7417 60.5744 69.3714 173.7109 65 V 4.3671 7.8752 124.7381 61.5194 33.3836 176.7189 66 R 4.1823 9.1297 120.6582 60.0297 32.4521 173.8847 67 G 4.1907 9.6753 114.3326 45.3249 0.0000 173.9468 68 G 4.1595 8.6627 107.7708 45.2156 0.0000 176.7310 69 G 4.2228 8.4912 113.8019 42.8694 0.0000 172.6400 70 K 4.1357 8.6278 119.4092 57.8751 32.0736 176.8922 71 S 4.4838 7.8918 111.2525 58.7788 64.1557 175.4116 72 G 3.5316 7.7655 106.1089 47.1466 0.0000 175.9400 73 Q 3.9689 8.0768 120.4465 59.2496 28.6684 178.5291 74 I 3.7493 7.6354 118.7729 64.6149 37.2457 177.7487 75 D 4.3828 7.6866 119.3423 56.9779 40.6772 178.0790 76 A 3.9794 7.8164 120.7124 55.7068 18.3536 179.5601 77 I 3.6095 8.1652 118.3121 64.6633 36.9485 178.5599 78 K 3.7485 8.0606 119.9324 58.8170 31.9869 178.6246 79 L 4.1826 7.7095 120.6983 57.7316 41.7988 178.5217 80 G 3.5943 8.3544 105.5619 46.8845 0.0000 175.5039 81 I 3.8078 8.2072 121.0030 62.9383 37.2937 176.9889 82 A 4.3790 7.0649 119.9791 52.5320 19.8132 177.9675 83 R 4.2553 7.6018 115.7624 57.2168 30.6161 177.7090 84 A 4.4903 7.8239 119.5846 53.0442 18.7007 177.7708 85 L 4.4772 7.7764 113.9695 55.4816 41.0485 177.2349 86 V 4.0716 7.1519 117.8660 62.3275 31.8620 176.4842 87 Q 4.0160 7.2209 122.9259 58.6464 29.4892 176.0490 88 Y 3.8879 7.6029 113.8092 58.7571 36.9366 176.1197 89 N 4.7972 8.1207 119.6561 51.6830 41.5846 173.5157 90 P 4.5692 0.0000 0.0000 64.9685 32.0168 177.4273 91 D 4.5298 8.2556 118.8027 56.9678 41.5848 176.2137 92 Y 4.5113 7.6201 118.4371 57.9785 37.1942 175.6229 93 R 4.4512 7.7929 119.0942 56.4747 32.4656 175.9408 94 A 4.6901 7.4324 120.2911 52.0152 18.1240 177.7156 95 K 4.5199 7.9092 118.0824 57.7482 34.6354 177.4536 96 L 4.4157 7.6503 120.5774 55.8045 42.6684 177.2362 97 K 4.1847 7.9206 117.0647 57.7042 33.5868 175.0903 98 P 4.2611 0.0000 0.0000 65.5677 31.8040 177.4868 99 L 4.0202 7.3252 119.9919 57.1814 40.6790 178.6845 100 G 3.9377 6.3676 108.4200 45.7350 0.0000 172.1778 101 F 5.2304 8.7708 123.2598 56.6521 39.8143 176.3840 102 L 4.6807 7.3199 123.1042 52.5297 42.1717 174.8901 103 T 4.1981 7.4367 116.1176 62.6230 72.1085 173.9386 104 R 4.2095 8.8755 123.9118 56.0851 30.2298 176.0094 105 D 4.2173 7.9783 114.4498 55.0842 37.8931 173.9992 106 A 4.1817 8.1828 120.9900 53.3752 18.7150 179.7883 107 R 4.3008 7.7548 116.5659 56.1620 27.3955 175.2897 108 V 4.2684 7.4683 113.0404 58.5810 34.0971 175.4857 109 V 3.4838 8.5199 123.9024 63.0043 31.1020 175.5256 110 E 4.2124 8.4718 125.1129 55.4903 30.3076 176.5533 111 R 3.9046 8.1899 119.8673 55.9654 30.5982 175.7877 112 K 4.2128 8.4873 126.4846 55.9970 32.8420 176.5014 113 K 4.3498 8.4694 126.1030 55.5281 33.2105 175.6758 114 Y 4.4809 8.7896 120.6451 58.5284 38.2960 175.7443 115 G 3.9684 9.7064 113.1539 44.9850 0.0000 173.6376 116 K 4.4626 7.8681 119.2652 53.8145 32.7511 176.5949 117 H 4.1212 8.1622 120.4369 58.5745 29.6575 176.0096 118 K 4.5311 7.5078 117.4909 55.1487 33.0516 175.5074 119 A 4.4215 8.7843 128.2587 52.5500 18.6159 179.7623 120 R 4.4517 7.5812 109.2283 56.6678 33.0936 175.7241 121 R 4.0244 7.9306 116.9299 55.4756 28.2529 175.5423 122 A 4.1989 8.1700 126.7276 50.9405 19.1218 176.4642 123 P 4.4289 0.0000 0.0000 62.5453 32.4097 177.6008 124 Q 4.3784 8.4028 117.9172 57.0025 28.5008 175.1540 125 Y 4.6226 8.1497 118.4032 58.7394 41.3650 173.5802 126 S 4.3798 9.2870 124.0602 59.4441 64.3385 174.7932 127 K 4.4516 8.5366 125.2777 56.9862 31.6100 176.0741 128 R 4.0907 7.7260 117.1611 56.4074 29.3084 176.0781 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 2 E 8.44 4.27 0.00 1.97 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 2.13 2.29 0.00 3 Q 7.95 4.39 0.00 1.91 1.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.06 6.78 0.00 0.00 0.00 0.00 0.00 2.05 2.37 0.00 4 Y 8.79 4.77 0.00 2.82 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 5 Y 8.52 5.98 0.00 3.52 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 6 G 6.88 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 7 T 8.43 4.40 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 1.26 0.00 0.00 8 G 8.50 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 9 R 7.63 5.29 0.00 1.72 1.75 0.00 3.14 0.00 0.00 3.82 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.47 0.00 10 R 8.46 4.25 0.00 1.83 1.73 0.00 3.39 0.00 0.00 3.26 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.42 0.00 11 K 9.45 4.05 0.00 1.91 1.82 0.00 1.97 0.00 0.00 1.70 0.00 0.00 2.84 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.32 1.44 7.81 12 E 8.08 3.56 0.00 2.20 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 2.30 2.23 0.00 13 A 7.47 4.69 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 14 V 8.10 4.84 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 1.15 0.00 0.00 0.95 0.00 0.00 15 A 8.79 4.82 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 16 R 8.39 4.55 0.00 1.63 1.86 0.00 3.13 0.00 0.00 3.14 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.61 0.00 17 V 7.61 4.44 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 0.97 0.00 0.00 0.80 0.00 0.00 18 F 9.12 6.14 0.00 3.34 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 19 L 8.57 4.53 0.00 1.73 1.76 0.71 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 20 R 8.50 4.33 0.00 1.71 1.75 0.00 3.15 0.00 0.00 3.14 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.69 0.00 21 P 0.00 4.90 0.00 1.69 1.66 0.00 3.53 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.38 0.00 22 G 7.91 4.50 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 0.00 0.00 0.00 23 N 9.40 4.75 0.00 2.85 2.15 0.00 0.00 6.51 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 24 G 6.94 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 0.00 0.00 0.00 0.00 25 K 8.02 4.05 0.00 1.87 2.03 0.00 1.46 0.00 0.00 1.76 0.00 0.00 2.84 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.65 1.52 7.81 26 V 8.23 5.53 1.84 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 0.96 0.00 0.00 0.82 0.00 0.00 27 T 8.43 5.21 4.37 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 1.23 0.00 0.00 28 V 8.65 4.86 1.55 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 0.85 0.00 0.00 0.97 0.00 0.00 29 N 9.48 3.99 0.00 2.44 2.56 0.00 0.00 7.10 7.58 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 30 G 7.95 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 0.00 0.00 0.00 0.00 31 Q 7.57 4.45 0.00 2.06 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.75 0.00 0.00 0.00 0.00 0.00 2.25 2.25 0.00 32 D 8.69 4.68 0.00 2.76 2.58 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 33 F 8.87 4.04 0.00 3.18 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 34 N 8.39 4.26 0.00 2.78 2.89 0.00 0.00 6.79 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 35 E 7.93 4.23 0.00 1.96 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 2.25 2.35 0.00 36 Y 7.57 4.17 0.00 2.83 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 37 F 7.16 4.76 0.00 2.70 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 38 Q 7.58 4.25 0.00 2.27 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.77 0.00 0.00 0.00 0.00 0.00 2.36 2.33 0.00 39 G 8.66 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 40 L 7.32 4.39 0.00 1.58 1.51 0.77 0.65 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 41 V 8.26 3.99 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 0.76 0.00 0.00 0.92 0.00 0.00 42 R 7.72 4.12 0.00 1.83 1.80 0.00 3.22 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 1.59 1.58 0.00 43 A 7.56 3.73 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 44 V 7.76 4.23 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 0.86 0.00 0.00 0.98 0.00 0.00 45 A 8.43 4.16 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 0.00 0.00 0.00 0.00 0.00 0.00 46 A 7.77 4.02 1.45 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 0.00 0.00 0.00 47 L 7.68 4.26 0.00 1.59 1.63 0.40 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 48 E 7.68 4.25 0.00 2.48 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 2.40 2.58 0.00 49 P 0.00 4.19 0.00 2.05 1.30 0.00 3.57 0.00 0.00 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.62 0.00 50 L 7.82 4.00 0.00 1.84 1.75 0.86 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 51 R 7.42 4.60 0.00 1.89 2.00 0.00 3.15 0.00 0.00 3.26 7.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.81 0.00 52 A 7.63 4.80 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 V 7.96 4.39 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 1.06 0.00 0.00 1.10 0.00 0.00 54 D 8.38 4.93 0.00 2.91 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 55 A 7.73 4.84 1.61 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 56 L 7.92 4.42 0.00 1.65 1.73 0.92 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 57 G 8.00 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 0.00 0.00 0.00 58 R 7.94 4.35 0.00 1.37 1.14 0.00 3.09 0.00 0.00 3.22 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.55 0.00 59 F 7.97 4.83 0.00 2.80 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 60 D 9.29 5.11 0.00 2.77 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 61 A 8.37 4.85 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 62 Y 8.92 4.83 0.00 3.20 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 63 I 8.36 5.24 1.76 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 1.18 0.78 0.82 0.00 0.00 64 T 8.02 5.34 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 1.20 0.00 0.00 65 V 7.88 4.37 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 0.81 0.00 0.00 1.01 0.00 0.00 66 R 9.13 4.18 0.00 1.86 1.82 0.00 3.07 0.00 0.00 3.18 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.56 0.00 67 G 9.68 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 0.00 0.00 0.00 0.00 68 G 8.66 4.16 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 G 8.49 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 0.00 0.00 0.00 0.00 70 K 8.63 4.14 0.00 1.65 1.77 0.00 1.21 0.00 0.00 1.49 0.00 0.00 2.69 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.31 1.40 7.81 71 S 7.89 4.48 0.00 3.77 3.73 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 72 G 7.77 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 Q 8.08 3.97 0.00 2.21 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.66 0.00 0.00 0.00 0.00 0.00 2.55 2.74 0.00 74 I 7.64 3.75 1.63 0.00 0.00 0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 -0.16 0.74 0.00 0.00 75 D 7.69 4.38 0.00 2.93 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 76 A 7.82 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 77 I 8.17 3.61 2.04 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.07 0.96 0.00 0.00 78 K 8.06 3.75 0.00 1.88 1.88 0.00 1.62 0.00 0.00 1.53 0.00 0.00 2.93 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.14 1.34 7.81 79 L 7.71 4.18 0.00 1.70 1.81 0.89 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 80 G 8.35 3.59 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 0.00 81 I 8.21 3.81 1.72 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.70 0.75 0.00 0.00 82 A 7.06 4.38 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 83 R 7.60 4.26 0.00 1.93 1.88 0.00 3.05 0.00 0.00 3.16 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.60 0.00 84 A 7.82 4.49 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 85 L 7.78 4.48 0.00 1.48 1.50 0.97 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 86 V 7.15 4.07 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 0.73 0.00 0.00 1.01 0.00 0.00 87 Q 7.22 4.02 0.00 2.23 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.84 7.11 0.00 0.00 0.00 0.00 0.00 2.04 2.24 0.00 88 Y 7.60 3.89 0.00 2.44 2.48 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.12 4.80 0.00 2.72 2.63 0.00 0.00 6.77 8.06 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 90 P 0.00 4.57 0.00 2.21 2.18 0.00 3.83 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 2.03 2.00 0.00 91 D 8.26 4.53 0.00 2.94 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 92 Y 7.62 4.51 0.00 3.16 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 93 R 7.79 4.45 0.00 1.89 1.90 0.00 3.24 0.00 0.00 3.36 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.66 0.00 94 A 7.43 4.69 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 95 K 7.91 4.52 0.00 2.02 2.02 0.00 1.55 0.00 0.00 1.88 0.00 0.00 3.18 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.48 1.51 7.81 96 L 7.65 4.42 0.00 1.96 1.74 1.09 0.50 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 97 K 7.92 4.18 0.00 1.71 1.77 0.00 1.72 0.00 0.00 1.70 0.00 0.00 3.09 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.32 1.47 7.81 98 P 0.00 4.26 0.00 2.11 2.07 0.00 3.75 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.06 0.00 99 L 7.33 4.02 0.00 1.64 1.55 -0.02 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 100 G 6.37 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 0.00 101 F 8.77 5.23 0.00 3.02 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 0.00 102 L 7.32 4.68 0.00 1.60 1.56 0.94 0.95 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 0.00 103 T 7.44 4.20 4.26 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 1.25 0.00 0.00 104 R 8.88 4.21 0.00 1.77 1.93 0.00 3.39 0.00 0.00 3.23 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.86 0.00 105 D 7.98 4.22 0.00 2.86 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 0.00 106 A 8.18 4.18 1.28 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 0.00 107 R 7.75 4.30 0.00 1.83 1.92 0.00 3.13 0.00 0.00 3.42 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.60 0.00 108 V 7.47 4.27 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 0.70 0.00 0.00 0.95 0.00 0.00 109 V 8.52 3.48 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 0.81 0.00 0.00 0.93 0.00 0.00 110 E 8.47 4.21 0.00 2.11 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 2.28 2.30 0.00 111 R 8.19 3.90 0.00 1.77 1.85 0.00 3.17 0.00 0.00 3.09 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.58 0.00 112 K 8.49 4.21 0.00 1.77 1.72 0.00 1.86 0.00 0.00 1.74 0.00 0.00 3.03 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.70 1.43 7.81 113 K 8.47 4.35 0.00 2.11 1.88 0.00 1.60 0.00 0.00 1.92 0.00 0.00 3.02 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.56 1.52 7.81 114 Y 8.79 4.48 0.00 3.03 2.89 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 0.00 0.00 0.00 115 G 9.71 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 0.00 0.00 0.00 116 K 7.87 4.46 0.00 2.01 1.72 0.00 1.75 0.00 0.00 1.62 0.00 0.00 2.94 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.36 1.56 7.81 117 H 8.16 4.12 0.00 3.14 3.37 0.00 5.68 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 K 7.51 4.53 0.00 1.70 1.72 0.00 1.85 0.00 0.00 1.73 0.00 0.00 3.07 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.36 1.47 7.81 119 A 8.78 4.42 1.49 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 0.00 0.00 120 R 7.58 4.45 0.00 1.75 1.92 0.00 3.22 0.00 0.00 3.16 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.78 0.00 121 R 7.93 4.02 0.00 1.78 1.89 0.00 3.44 0.00 0.00 3.22 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.58 0.00 122 A 8.17 4.20 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 0.00 123 P 0.00 4.43 0.00 2.16 1.98 0.00 3.64 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.89 0.00 124 Q 8.40 4.38 0.00 2.11 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.97 6.86 0.00 0.00 0.00 0.00 0.00 2.40 2.33 0.00 125 Y 8.15 4.62 0.00 2.79 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 0.00 126 S 9.29 4.38 0.00 3.98 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 0.00 127 K 8.54 4.45 0.00 1.45 1.81 0.00 1.31 0.00 0.00 1.56 0.00 0.00 3.05 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.25 1.44 7.81 128 R 7.73 4.09 0.00 1.94 1.88 0.00 3.40 0.00 0.00 3.20 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.56 0.00