NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 6 R 4.4232 8.1548 116.6709 56.3486 30.8309 173.9929 7 M 4.8099 8.1932 115.4518 51.6319 35.8143 173.7521 8 K 5.5935 8.7630 132.4851 57.3024 35.1529 174.0459 9 Y 4.1278 9.1321 117.0568 59.3334 38.5304 177.1013 10 R 3.5905 8.3748 114.4949 56.9522 27.7567 177.8479 11 K 4.2667 7.2524 125.8043 55.3325 31.9611 175.8453 12 Q 4.5683 8.3507 116.3782 56.0148 34.4850 172.9823 13 Q 4.7290 7.7800 113.8375 53.4119 31.9532 174.4333 14 R 4.0308 7.9644 118.8426 57.5303 30.3946 177.2198 15 G 4.3118 7.6799 107.2867 44.4419 0.0000 173.6776 16 R 4.6455 8.2198 124.5735 55.1515 30.2467 176.5532 17 L 4.1907 8.1582 128.3336 55.6438 45.4725 173.9757 18 K 4.8203 8.2865 124.0673 55.7911 34.1191 173.6985 19 G 3.6036 8.3429 117.5562 41.4946 0.0000 170.6630 20 A 3.3900 8.0303 124.6340 51.8592 18.7309 176.1204 21 T 4.4295 7.2957 113.4349 61.6866 73.7550 172.6654 22 K 4.1857 7.4361 119.2576 57.2026 36.9550 172.1334 23 G 4.1521 8.2225 113.8088 44.8042 0.0000 174.6359 24 G 5.2285 4.0000 123.7813 46.5244 0.0000 172.9583 25 D 3.6032 6.8189 118.5563 52.0223 44.4981 176.1116 26 Y 4.7267 6.3912 118.3100 57.3994 44.5893 176.5756 27 V 3.9307 8.9459 119.4069 61.7015 30.3510 177.7424 28 A 4.9874 9.0952 121.3239 53.3119 22.3141 176.9643 29 F 4.9024 8.3887 114.8741 57.9833 42.7408 174.1649 30 G 4.0192 8.6207 109.7982 45.5194 0.0000 174.3911 31 D 4.8754 9.0811 118.2429 54.5912 38.2985 175.0650 32 Y 4.4743 8.0999 119.1766 56.6213 36.9257 173.9093 33 G 4.4490 7.9738 107.5829 44.9944 0.0000 170.7817 34 L 5.2598 8.9570 128.2754 52.6291 43.9758 176.0300 35 V 4.8925 8.4938 123.8375 59.3280 34.5402 175.8176 36 A 4.0421 8.5373 126.6563 52.5848 19.5572 176.0536 37 L 4.7004 8.5851 116.6742 54.4789 47.9009 176.7808 38 E 4.8845 8.4051 121.8561 55.4357 31.0939 174.5005 39 P 5.1140 0.0000 0.0000 61.1328 31.5612 179.7849 40 A 4.5464 7.6996 133.6625 53.3852 20.8069 179.5800 41 W 5.1479 8.4994 122.5734 59.0386 30.5492 174.4320 42 I 4.1194 8.7363 117.2561 60.6313 40.0085 172.9764 43 T 3.8468 8.7493 124.5408 63.0601 67.6952 173.4880 44 A 3.9617 9.1127 131.4222 56.0631 18.3420 179.2934 45 Q 3.7429 7.9408 114.6416 59.2138 28.9006 179.4263 46 Q 3.9175 9.7315 120.2685 60.1052 28.8832 178.9863 47 I 3.5682 7.7816 118.5958 64.7521 37.3182 177.2785 48 E 4.0789 8.7698 118.4806 60.4822 29.4578 179.7750 49 A 3.9172 8.2306 119.8885 55.1346 18.4804 179.3323 50 A 3.9439 8.3303 118.8985 55.0542 18.4331 179.5901 51 R 3.9139 8.3411 115.0832 59.8347 29.1481 178.9245 52 V 3.5536 8.0012 118.6922 65.5062 31.5992 177.5920 53 A 3.8949 8.2195 120.3694 55.8847 18.2474 178.9987 54 M 3.7229 8.6402 116.9613 58.4192 31.8843 179.3114 55 V 3.7352 8.1292 119.0474 66.2401 32.0651 178.1150 56 R 4.2320 8.0555 114.3510 58.9801 29.8106 177.5479 57 H 4.2632 8.1467 118.3086 58.8098 31.2198 176.7012 58 F 4.6101 8.4865 120.7406 61.3845 34.7392 175.8776 59 R 3.7459 8.4437 107.7204 56.5856 29.2641 176.4381 60 R 3.9523 8.2603 122.7682 56.0642 27.9093 177.2973 61 G 4.2612 8.4566 117.3617 45.6393 0.0000 168.7279 62 G 4.3079 7.9609 113.9710 44.1106 0.0000 170.7519 63 K 3.8063 8.4749 123.0193 56.4482 32.2047 177.3002 64 I 4.2131 7.8488 117.1708 60.2463 39.0896 175.4847 65 F 5.1187 8.4627 119.3998 57.5103 39.2727 177.5668 66 I 4.7688 5.4200 135.0000 62.6723 44.8576 173.4890 67 R 5.1768 8.6494 127.8343 56.9562 27.4192 178.7760 68 I 3.9964 8.1801 119.8284 61.0259 38.1227 172.8387 69 F 4.6067 8.3424 120.2320 56.3770 42.5077 173.7258 70 P 4.5367 0.0000 0.0000 62.7799 31.4851 180.5055 71 D 4.0895 8.0327 116.4330 54.5204 41.9915 175.2352 72 K 4.8653 6.8533 122.5693 54.9907 36.2673 174.1551 73 P 4.7515 0.0000 0.0000 61.6585 32.5871 174.1414 74 Y 4.2572 9.2739 123.5387 56.5326 40.0048 175.1098 75 T 5.8680 8.4387 119.2512 60.7922 71.6780 173.9551 76 K 4.2694 9.6110 124.8205 55.5801 34.2946 180.0136 77 K 4.3123 8.5077 116.3353 55.9693 32.9739 174.9313 78 P 4.6072 0.0000 0.0000 61.6721 32.5913 177.7346 79 L 4.4077 7.7704 127.5494 56.2038 43.7989 174.6678 80 E 5.7385 9.0624 127.4237 57.8611 28.0738 178.0209 81 V 3.5660 5.9653 110.3010 61.4054 34.4069 177.2919 82 R 4.6736 8.3544 119.4487 54.9528 32.8760 172.6962 83 M 4.7965 9.2297 115.4928 53.0821 33.8235 174.4238 84 G 3.7689 8.5278 117.9726 45.5681 0.0000 172.8003 85 K 4.3119 7.5156 123.6006 55.2129 33.6803 177.9835 86 G 3.9137 8.5051 106.9391 46.1295 0.0000 173.7598 87 K 3.9067 8.6445 117.8298 56.3558 31.6458 175.0556 88 G 3.7887 7.3340 106.0758 45.6199 0.0000 168.8454 89 N 4.7393 8.8862 122.6449 53.4391 37.8865 176.0508 90 V 4.4323 8.0027 118.7741 59.7987 31.5406 175.2763 91 E 4.1136 8.1564 122.3361 58.8723 30.8588 178.9771 92 G 4.0522 8.2070 106.5496 43.8122 0.0000 171.6796 93 Y 5.0479 7.3223 117.0516 56.2379 41.9389 175.1198 94 V 4.7586 9.1012 116.0156 60.7732 37.3655 172.4388 95 A 5.0190 8.9322 123.8308 51.6546 20.8050 177.0238 96 V 4.4426 8.4746 118.4838 60.8813 32.8875 173.9778 97 V 4.3900 8.7256 119.5467 59.3256 34.2624 176.0952 98 K 4.2368 8.8220 122.7237 56.6795 35.2439 174.7743 99 P 4.2079 0.0000 0.0000 61.8433 30.2799 175.4825 100 G 4.0353 8.2760 108.3539 46.5427 0.0000 172.2293 101 R 4.6559 7.6839 128.9609 53.6545 33.3465 176.6865 102 V 3.5867 7.4648 121.4802 61.9946 30.8385 175.0391 103 M 4.5915 8.5152 128.1682 53.7656 33.6501 174.4534 104 F 5.6609 9.4964 119.5100 54.9827 41.0735 174.4105 105 E 5.1859 9.5321 122.5169 54.9722 34.3196 174.6605 106 V 2.0000 7.6452 123.5003 61.4286 33.1749 174.3329 107 A 4.8850 5.9201 125.0408 50.9294 25.3246 176.3537 108 G 5.1422 8.7529 120.5226 44.0696 0.0000 174.5256 109 V 3.6198 7.9398 121.3753 65.9699 32.0017 173.8957 110 T 3.0633 8.3206 123.4117 64.7233 65.0487 171.2922 111 E 4.0622 8.2039 123.6564 54.8726 28.2656 175.8797 112 E 4.1096 8.8286 118.4024 59.3638 29.3810 178.7672 113 Q 3.9974 7.9244 118.7079 58.5845 29.0009 177.7764 114 A 4.1048 7.9640 121.3205 56.1454 18.4383 178.4344 115 M 3.7889 8.4107 115.6425 59.4857 31.9203 178.6682 116 E 3.6867 9.4008 116.3864 59.9347 29.9624 179.9998 117 A 3.7915 8.5654 119.9731 55.9296 18.7654 179.1866 118 L 3.9763 8.8561 117.6023 57.3151 41.5806 180.9209 119 R 3.6982 8.6515 118.3661 59.8296 30.9398 177.9373 120 I 3.8489 8.7073 121.0838 62.5738 36.8807 178.4109 121 A 4.0328 8.6318 121.6828 55.3108 18.5298 180.0746 122 G 3.4711 8.4541 103.4650 48.4557 0.0000 175.1886 123 H 4.1148 8.1838 120.9602 58.8200 30.0183 175.9949 124 K 3.8825 8.2272 119.9447 60.0493 32.2502 177.5685 125 L 4.8157 7.9605 118.2891 53.4269 43.6793 175.3551 126 P 4.7082 0.0000 0.0000 62.8269 31.5295 174.6770 127 I 4.2594 7.1846 110.7076 59.6531 40.0121 173.7159 128 K 4.0690 8.4679 120.2400 57.5928 32.6510 176.4331 129 T 4.9719 8.2169 113.9745 60.8681 72.4486 171.5667 130 K 4.7147 8.8298 121.8038 55.7187 36.3123 174.1191 131 I 4.9533 7.8453 120.0418 60.8537 41.6941 175.5019 132 V 4.4524 8.2789 114.8713 61.7193 37.4802 172.0327 133 R 4.9592 8.5721 117.3188 54.5993 32.6376 174.5603 134 R 3.9907 8.5602 119.1352 56.9851 30.0107 175.7669 135 D 4.8867 8.6184 122.1825 52.8354 41.0015 176.3775 136 A 4.7165 8.2320 119.9211 56.6722 21.4749 176.7513 137 Y 3.7536 6.3849 121.0882 54.7778 43.0160 177.1741 138 D 5.4013 9.0742 123.7874 53.9731 43.2267 175.0099 139 E 4.5768 8.6351 125.3556 54.2864 31.2870 174.6131 140 A 4.8937 8.0238 129.7049 50.0229 21.9806 176.0967 141 Q 4.1868 8.5204 115.0973 56.7385 28.9691 175.9078 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 6 R 8.15 4.42 0.00 1.93 2.23 0.00 2.77 0.00 0.00 2.25 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.60 0.00 7 M 8.19 4.81 0.00 2.32 1.87 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.52 0.00 8 K 8.76 5.59 0.00 2.03 2.10 0.00 0.61 0.00 0.00 1.49 0.00 0.00 3.01 0.00 0.00 3.16 0.00 0.00 0.00 0.00 0.93 0.88 7.81 9 Y 9.13 4.13 0.00 3.15 2.97 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 10 R 8.37 3.59 0.00 1.90 2.19 0.00 3.41 0.00 0.00 3.44 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.74 0.00 11 K 7.25 4.27 0.00 1.67 1.21 0.00 1.97 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.69 1.45 7.81 12 Q 8.35 4.57 0.00 1.97 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.07 6.57 0.00 0.00 0.00 0.00 0.00 2.15 2.23 0.00 13 Q 7.78 4.73 0.00 2.05 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.53 6.89 0.00 0.00 0.00 0.00 0.00 2.25 2.29 0.00 14 R 7.96 4.03 0.00 1.82 1.85 0.00 3.39 0.00 0.00 3.25 8.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.59 0.00 15 G 7.68 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 0.00 0.00 0.00 0.00 16 R 8.22 4.65 0.00 1.86 1.44 0.00 3.47 0.00 0.00 3.27 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.67 0.00 17 L 8.16 4.19 0.00 1.60 1.44 0.94 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 18 K 8.29 4.82 0.00 1.77 1.83 0.00 1.83 0.00 0.00 1.76 0.00 0.00 2.78 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.37 1.37 7.81 19 G 8.34 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.03 3.39 1.04 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 21 T 7.30 4.43 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 1.17 0.00 0.00 22 K 7.44 4.19 0.00 1.74 1.70 0.00 1.74 0.00 0.00 1.71 0.00 0.00 2.93 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.17 1.25 7.81 23 G 8.22 4.15 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 0.00 0.00 0.00 24 G 4.00 5.23 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 0.00 25 D 6.82 3.60 0.00 2.29 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 Y 6.39 4.73 0.00 3.10 3.06 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 27 V 8.95 3.93 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 1.11 0.00 0.00 1.61 0.00 0.00 28 A 9.10 4.99 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 0.00 0.00 0.00 0.00 0.00 0.00 29 F 8.39 4.90 0.00 2.25 3.19 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 30 G 8.62 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 0.00 0.00 0.00 31 D 9.08 4.88 0.00 2.82 2.96 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 32 Y 8.10 4.47 0.00 2.97 2.97 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 33 G 7.97 4.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 L 8.96 5.26 0.00 1.78 1.67 1.19 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 35 V 8.49 4.89 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 0.78 0.00 0.00 0.87 0.00 0.00 36 A 8.54 4.04 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 37 L 8.59 4.70 0.00 1.92 1.48 0.93 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 38 E 8.41 4.88 0.00 1.90 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 2.23 2.27 0.00 39 P 0.00 5.11 0.00 2.31 1.23 0.00 3.88 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 2.06 0.00 40 A 7.70 4.55 1.08 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 0.00 0.00 41 W 8.50 5.15 0.00 3.61 3.31 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 42 I 8.74 4.12 1.96 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.42 1.03 0.00 0.00 43 T 8.75 3.85 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 1.21 0.00 0.00 44 A 9.11 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 45 Q 7.94 3.74 0.00 2.09 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.71 0.00 0.00 0.00 0.00 0.00 2.41 2.50 0.00 46 Q 9.73 3.92 0.00 2.11 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.63 0.00 0.00 0.00 0.00 0.00 2.38 2.45 0.00 47 I 7.78 3.57 2.08 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.87 0.90 0.00 0.00 48 E 8.77 4.08 0.00 1.97 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 0.00 2.64 2.49 0.00 49 A 8.23 3.92 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 50 A 8.33 3.94 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 51 R 8.34 3.91 0.00 2.03 2.37 0.00 2.79 0.00 0.00 3.10 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.63 0.00 52 V 8.00 3.55 2.22 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 1.12 0.00 0.00 0.99 0.00 0.00 53 A 8.22 3.89 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 M 8.64 3.72 0.00 2.45 2.44 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.78 3.09 0.00 55 V 8.13 3.74 2.27 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 0.91 0.00 0.00 1.07 0.00 0.00 56 R 8.06 4.23 0.00 2.00 2.06 0.00 3.19 0.00 0.00 3.13 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.68 0.00 57 H 8.15 4.26 0.00 3.08 2.96 0.00 5.78 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 58 F 8.49 4.61 0.00 3.32 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 59 R 8.44 3.75 0.00 2.01 2.32 0.00 3.30 0.00 0.00 3.26 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.80 0.00 60 R 8.26 3.95 0.00 1.94 2.03 0.00 3.38 0.00 0.00 3.25 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.64 0.00 61 G 8.46 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 0.00 0.00 0.00 0.00 62 G 7.96 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 0.00 0.00 0.00 0.00 63 K 8.47 3.81 0.00 1.73 1.80 0.00 1.77 0.00 0.00 1.75 0.00 0.00 3.13 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.63 1.53 7.81 64 I 7.85 4.21 1.93 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.99 0.99 0.00 0.00 65 F 8.46 5.12 0.00 3.06 2.54 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 66 I 5.42 4.77 1.86 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 1.78 1.00 0.00 0.00 67 R 8.65 5.18 0.00 2.22 1.46 0.00 3.10 0.00 0.00 3.19 7.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.41 0.00 68 I 8.18 4.00 1.90 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.94 0.97 0.00 0.00 69 F 8.34 4.61 0.00 3.08 3.09 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 0.00 0.00 0.00 70 P 0.00 4.54 0.00 2.28 2.12 0.00 2.47 0.00 0.00 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.88 0.00 71 D 8.03 4.09 0.00 3.13 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 72 K 6.85 4.87 0.00 1.87 1.85 0.00 1.72 0.00 0.00 1.75 0.00 0.00 3.49 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.52 1.58 7.81 73 P 0.00 4.75 0.00 2.18 2.50 0.00 3.81 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.10 0.00 74 Y 9.27 4.26 0.00 2.78 2.52 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 75 T 8.44 5.87 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 1.47 0.00 0.00 76 K 9.61 4.27 0.00 1.75 1.85 0.00 1.62 0.00 0.00 1.68 0.00 0.00 2.93 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.32 1.60 7.81 77 K 8.51 4.31 0.00 1.81 1.65 0.00 1.67 0.00 0.00 2.33 0.00 0.00 3.08 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.32 1.72 7.81 78 P 0.00 4.61 0.00 2.03 1.42 0.00 3.89 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.12 0.00 79 L 7.77 4.41 0.00 1.68 1.70 0.92 0.54 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 80 E 9.06 5.74 0.00 2.17 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 2.05 2.07 0.00 81 V 5.97 3.57 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 0.77 0.00 0.00 0.96 0.00 0.00 82 R 8.35 4.67 0.00 1.74 1.75 0.00 3.23 0.00 0.00 3.27 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.61 0.00 83 M 9.23 4.80 0.00 2.09 1.95 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.44 0.00 84 G 8.53 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 85 K 7.52 4.31 0.00 1.84 1.72 0.00 1.61 0.00 0.00 1.82 0.00 0.00 3.25 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.50 1.61 7.81 86 G 8.51 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 0.00 0.00 0.00 87 K 8.64 3.91 0.00 1.75 1.80 0.00 1.81 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.37 1.35 7.81 88 G 7.33 3.79 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 0.00 89 N 8.89 4.74 0.00 2.92 3.25 0.00 0.00 6.65 7.68 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 90 V 8.00 4.43 2.36 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 0.91 0.00 0.00 1.09 0.00 0.00 91 E 8.16 4.11 0.00 1.95 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 0.00 2.40 2.24 0.00 92 G 8.21 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 Y 7.32 5.05 0.00 3.00 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 94 V 9.10 4.76 2.44 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 -0.06 0.00 0.00 1.59 0.00 0.00 95 A 8.93 5.02 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 96 V 8.47 4.44 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 0.23 0.00 0.00 0.84 0.00 0.00 97 V 8.73 4.39 2.04 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 0.76 0.00 0.00 0.93 0.00 0.00 98 K 8.82 4.24 0.00 1.49 1.72 0.00 1.55 0.00 0.00 1.51 0.00 0.00 2.88 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.19 1.39 7.81 99 P 0.00 4.21 0.00 2.15 2.06 0.00 3.70 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.99 0.00 100 G 8.28 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 0.00 101 R 7.68 4.66 0.00 1.63 2.01 0.00 3.16 0.00 0.00 3.59 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.46 0.00 102 V 7.46 3.59 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 -0.31 0.00 0.00 -0.34 0.00 0.00 103 M 8.52 4.59 0.00 1.98 2.30 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.60 0.00 104 F 9.50 5.66 0.00 3.09 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 E 9.53 5.19 0.00 2.07 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.54 0.00 106 V 7.65 2.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.54 0.00 0.00 0.14 0.00 0.00 107 A 5.92 4.89 0.20 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 0.00 108 G 8.75 5.14 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 0.00 109 V 7.94 3.62 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 0.98 0.00 0.00 1.26 0.00 0.00 110 T 8.32 3.06 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 1.19 0.00 0.00 111 E 8.20 4.06 0.00 2.02 2.36 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 2.21 2.18 0.00 112 E 8.83 4.11 0.00 2.04 2.00 0.00 0.00 0.00 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 2.47 0.00 113 Q 7.92 4.00 0.00 2.13 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.91 0.00 0.00 0.00 0.00 0.00 2.43 2.47 0.00 114 A 7.96 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 0.00 115 M 8.41 3.79 0.00 2.03 2.14 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.92 0.00 116 E 9.40 3.69 0.00 2.19 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.56 0.00 117 A 8.57 3.79 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.86 3.98 0.00 1.73 1.71 0.97 1.13 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 0.00 119 R 8.65 3.70 0.00 2.10 1.89 0.00 3.08 0.00 0.00 3.26 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.73 0.00 120 I 8.71 3.85 1.97 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 1.39 0.75 0.87 0.00 0.00 121 A 8.63 4.03 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 0.00 122 G 8.45 3.47 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 0.00 0.00 0.00 123 H 8.18 4.11 0.00 3.33 3.47 0.00 5.98 0.00 0.00 0.00 0.00 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 K 8.23 3.88 0.00 1.89 2.14 0.00 1.92 0.00 0.00 1.71 0.00 0.00 3.11 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.48 1.67 7.81 125 L 7.96 4.82 0.00 1.78 1.71 0.95 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 0.00 0.00 0.00 0.00 0.00 0.00 126 P 0.00 4.71 0.00 2.21 2.25 0.00 3.83 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.00 0.00 127 I 7.18 4.26 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.24 0.93 0.00 0.00 128 K 8.47 4.07 0.00 1.73 1.82 0.00 1.67 0.00 0.00 1.87 0.00 0.00 2.91 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.53 1.45 7.81 129 T 8.22 4.97 4.38 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 1.25 0.00 0.00 130 K 8.83 4.71 0.00 1.82 1.66 0.00 1.62 0.00 0.00 1.65 0.00 0.00 2.84 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.33 1.42 7.81 131 I 7.85 4.95 1.89 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.63 0.99 0.00 0.00 132 V 8.28 4.45 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 0.79 0.00 0.00 0.95 0.00 0.00 133 R 8.57 4.96 0.00 1.85 1.85 0.00 3.21 0.00 0.00 3.15 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.53 0.00 134 R 8.56 3.99 0.00 1.81 2.35 0.00 3.40 0.00 0.00 3.29 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.65 0.00 135 D 8.62 4.89 0.00 2.80 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 0.00 136 A 8.23 4.72 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 0.00 137 Y 6.38 3.75 0.00 2.99 2.22 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 0.00 138 D 9.07 5.40 0.00 2.94 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 0.00 139 E 8.64 4.58 0.00 1.94 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.21 0.00 140 A 8.02 4.89 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 0.00 141 Q 8.52 4.19 0.00 2.19 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.79 6.60 0.00 0.00 0.00 0.00 0.00 2.34 2.37 0.00