NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 S 4.7392 8.4287 116.1985 59.0286 63.4512 173.7648 1 A 4.1213 7.9403 124.5014 53.2728 19.1686 178.1168 2 F 4.6146 8.3434 113.1220 58.5473 40.5786 174.0244 3 N 4.5990 7.7391 119.5713 53.9361 39.4630 172.9801 4 G 3.6408 8.3031 111.0276 44.0080 0.0000 171.8226 5 K 5.0997 8.2095 117.8524 54.5904 34.8171 175.8339 6 W 5.4210 9.3556 123.5589 54.9172 33.4970 173.5815 7 E 4.9433 9.3445 125.7884 54.2771 31.3592 175.1883 8 T 4.1413 8.3010 123.8102 64.1024 68.5913 172.6114 9 E 4.6423 9.2505 126.3622 57.2873 31.6079 175.9907 10 S 4.6794 7.8002 112.0507 57.0178 66.9986 172.7832 11 Q 4.7719 8.4682 119.4426 54.2896 29.9926 172.6525 12 E 4.2074 9.2683 122.9111 56.3484 31.1460 177.2485 13 G 4.0843 9.1800 111.9174 46.8695 0.0000 173.9776 14 Y 4.2056 8.3667 121.5211 60.6556 38.5620 178.1441 15 E 3.7468 8.2793 117.6090 59.1995 29.9717 177.0980 16 P 4.2154 0.0000 0.0000 64.6438 31.3218 178.4778 17 F 4.0164 8.5221 119.6924 61.5209 39.5064 177.0131 18 C 4.0640 8.3864 116.7537 62.5855 27.7058 176.1205 19 K 3.8231 8.0953 120.1958 59.5110 31.4768 178.9799 20 L 3.8617 7.5356 119.1258 57.9097 42.1027 178.3914 21 I 3.9063 7.0656 109.9330 61.3962 37.9152 176.5623 22 G 3.9098 7.4369 109.4210 45.3273 0.0000 173.5965 23 I 3.7795 7.1992 120.4257 60.1862 37.5472 175.1770 24 P 4.3975 0.0000 0.0000 62.3142 33.2454 176.9927 25 D 4.3929 8.8020 121.4034 57.9216 40.7475 179.2119 26 D 4.4356 8.0135 118.8057 56.2317 39.7012 178.6823 27 V 3.6363 7.7480 119.3161 65.6356 31.2579 177.9099 28 I 3.7708 8.0839 119.7225 64.2925 36.7381 178.2368 29 A 4.0969 7.9194 120.2896 55.1667 18.3411 179.3111 30 K 4.1729 8.2080 117.1884 59.3115 32.6006 178.5825 31 G 3.9449 8.3588 104.5654 45.5697 0.0000 175.3872 32 R 3.3003 7.5514 121.0577 59.2758 30.0192 176.8963 33 D 4.5618 7.8762 113.6208 54.2615 41.5192 176.1328 34 F 4.1148 7.9341 123.2293 57.6654 39.6675 174.4724 35 K 4.1492 7.4853 127.9003 54.5687 32.6060 176.0625 36 L 4.2126 8.1427 125.2183 54.4572 42.9450 176.5260 37 V 4.4873 8.5681 124.3658 62.7695 33.2702 174.4650 38 T 5.1463 9.3796 124.6855 61.7885 71.2542 172.5594 39 E 5.2130 9.2348 127.8340 54.4277 32.4782 174.5048 40 I 4.8637 8.9666 127.3864 59.4866 40.9693 174.4905 41 V 4.2882 8.7015 127.5947 61.5141 32.9632 174.4068 42 Q 3.9458 8.4797 130.6790 54.5307 30.7208 173.8661 43 N 4.9737 8.8017 126.5131 51.5498 40.0641 178.0196 44 G 3.9103 8.5139 115.4571 46.7203 0.0000 172.5586 45 D 4.7500 9.1307 128.1871 55.2033 42.4012 175.2953 46 D 5.1194 7.9847 120.9239 53.5179 42.1534 175.5175 47 F 5.1112 8.9610 122.4230 55.7618 42.7628 174.1544 48 T 4.9607 8.8656 119.8002 61.4928 71.3165 173.0028 49 W 4.9791 9.4762 135.0000 56.0768 33.5287 173.8081 50 T 5.1004 8.9313 125.0268 61.7927 70.8676 173.4697 51 Q 5.0100 9.2520 125.3538 54.4368 31.9123 174.4651 52 Y 4.9009 8.6870 122.8941 57.1795 37.9126 175.2444 53 Y 4.5305 9.1784 122.9956 56.0748 39.6541 173.7561 54 P 4.3116 0.0000 0.0000 63.1999 31.8762 175.8541 55 N 4.1712 9.4359 113.4109 54.6126 35.9778 174.1115 56 N 4.2942 8.4246 110.9792 54.9805 37.5399 172.5871 57 H 4.7922 8.0467 114.2892 54.1330 30.3467 174.3426 58 V 4.6057 8.4904 123.7993 61.3374 33.2368 174.8967 59 V 4.2951 8.8668 128.4639 61.6428 33.3408 174.1729 60 T 5.1924 8.5619 124.7256 61.8149 71.0282 173.3940 61 N 5.0612 9.5903 124.1340 51.4469 41.6517 173.4439 62 K 5.1972 8.8548 123.7083 54.6722 34.1065 175.6901 63 F 5.1058 8.9387 119.0209 55.5124 42.3020 173.4586 64 I 4.9502 8.5664 120.1010 59.2963 39.8187 175.5019 65 V 3.8134 8.4991 127.1586 65.0367 31.4625 176.4513 66 G 4.0426 9.1841 115.9444 44.8945 0.0000 172.9000 67 K 4.7026 7.8092 118.5679 53.9330 35.2802 175.7877 68 E 4.2294 8.9091 125.1057 56.7832 30.0886 176.0125 69 S 4.9236 8.9305 122.8972 56.4862 66.7778 173.3829 70 D 4.8487 8.6531 123.0116 54.8295 41.3831 175.5529 71 M 4.8497 9.0601 121.4858 53.7293 36.9904 173.7203 72 E 5.2130 9.3719 120.7720 55.0763 33.9369 174.7142 73 T 4.7422 8.7414 116.1585 60.2662 70.7099 176.1389 74 V 3.3817 8.3632 121.3824 64.4786 31.2407 177.3262 75 G 3.6361 7.8821 106.8952 45.8560 0.0000 174.2581 76 G 4.2566 7.8927 108.7142 44.4828 0.0000 173.5797 77 K 4.0968 7.7935 122.2754 56.4741 32.8580 175.7775 78 K 5.1141 8.5587 127.5872 55.5524 33.9112 175.8113 79 F 4.8973 8.6082 117.7070 56.4282 41.7792 172.4772 80 K 5.1078 8.9133 117.7980 54.8697 34.8431 176.1529 81 G 4.3519 9.1178 109.5927 45.2738 0.0000 171.7046 82 I 4.7173 8.1156 121.5937 59.2638 39.4051 175.3141 83 V 4.1560 8.2386 127.8974 61.7476 32.9778 174.8134 84 S 5.0666 8.8035 122.6516 56.9677 65.8762 172.6666 85 M 5.0572 8.5459 121.1972 54.0349 34.1153 174.9549 86 E 4.5072 9.0842 126.3499 55.5219 33.0805 176.1346 87 G 3.7068 9.7188 114.3496 46.7518 0.0000 174.2320 88 G 4.0335 8.4796 105.0429 45.2298 0.0000 173.7021 89 K 4.8907 7.8428 119.8550 54.5698 34.8350 175.0963 90 L 4.8370 9.1044 127.0642 53.7680 43.5969 174.9647 91 T 5.0600 8.7898 121.0833 60.2451 71.4404 172.2647 92 I 4.7373 8.4776 126.8663 59.3061 41.6415 173.8827 93 S 5.1221 8.5304 124.2076 56.8544 65.6469 173.4810 94 F 4.8227 9.8216 123.6507 54.5784 41.8727 174.6942 95 P 4.2773 0.0000 0.0000 65.3101 31.3020 177.8561 96 K 4.6046 7.9560 114.4933 55.7569 32.9473 174.2549 97 Y 5.4515 7.8134 119.8463 56.7259 42.6389 173.3419 98 Q 4.8109 8.4717 123.5635 54.3983 32.7808 173.4224 99 Q 4.9016 8.4208 121.6171 54.5787 32.5445 174.1056 100 T 5.0967 8.9936 122.0393 62.0279 72.3484 172.9592 101 T 5.2575 9.0005 122.8957 61.7668 72.1121 172.9920 102 E 5.3094 9.2913 122.9394 55.1697 34.1791 173.7927 103 I 4.6992 8.0925 120.4815 59.8120 38.7237 175.6616 104 S 4.4611 8.9220 122.0240 57.2664 64.5820 173.9213 105 G 3.8188 9.9762 116.9810 46.6418 0.0000 174.0145 106 G 4.0258 8.6844 105.9101 44.7123 0.0000 173.9408 107 K 5.0048 7.6857 118.7898 54.2008 35.9023 175.4220 108 L 4.2664 8.5709 125.5771 54.6429 42.9217 175.5637 109 V 4.7452 8.7983 128.0180 61.1961 33.9338 174.1127 110 E 5.0303 9.3496 128.2068 55.1034 32.2546 175.1063 111 T 4.9810 9.1553 122.8653 61.9214 70.8026 173.9003 112 S 5.1138 8.9766 123.2080 56.9035 66.2359 173.4428 113 T 5.2182 8.7379 119.6582 61.7875 71.8323 172.8366 114 A 5.3138 9.2312 127.7239 50.0768 22.6354 174.7162 115 S 4.8783 8.9704 115.6367 56.7252 64.9253 173.5002 116 G 4.1400 9.0074 116.8574 43.1462 0.0000 172.9391 117 A 4.0132 8.6171 121.0265 54.7247 18.2054 178.5319 118 Q 4.4719 7.9595 110.7402 54.8274 30.0425 175.0723 119 G 3.9220 6.6058 106.5156 45.9164 0.0000 171.5820 120 T 5.1711 8.2287 108.4371 59.9225 71.5778 173.6100 121 A 4.8368 8.8913 123.3146 50.4792 22.7795 175.0790 122 V 4.9256 8.5636 120.0688 60.9672 34.7712 173.9174 123 L 4.9800 8.7209 129.3836 53.1008 45.0436 175.0510 124 V 4.7167 8.8209 126.1553 61.3520 33.9133 174.1167 125 R 4.9992 9.0873 128.2781 55.2493 32.2040 175.8754 126 T 5.1245 8.8708 119.4930 61.9412 71.6297 173.2480 127 S 5.1931 9.2106 121.4199 56.6331 67.5007 172.7192 128 K 4.8698 8.9305 124.4129 54.2301 34.3737 175.4184 129 K 3.5785 8.7815 128.3886 56.5874 32.8542 175.9865 130 V 4.0273 8.2391 128.0633 61.6947 31.8936 175.0197 131 L 4.6689 8.1124 127.7683 52.4491 44.0304 177.1658 132 V 3.7483 8.0018 114.9350 60.4944 32.1717 174.5591 133 P 4.1035 0.0000 0.0000 64.1382 31.7593 176.6053 134 R 4.0739 8.5917 121.0503 56.9347 30.9826 175.5772 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 0 S 8.43 4.74 0.00 3.92 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 1 A 7.94 4.12 1.12 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 0.00 0.00 2 F 8.34 4.61 0.00 3.42 3.29 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 3 N 7.74 4.60 0.00 2.93 2.78 0.00 0.00 7.28 7.86 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 4 G 8.30 3.64 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 0.00 0.00 0.00 5 K 8.21 5.10 0.00 1.57 1.64 0.00 1.57 0.00 0.00 1.82 0.00 0.00 2.96 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.49 1.42 7.81 6 W 9.36 5.42 0.00 3.19 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 7 E 9.34 4.94 0.00 2.02 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 0.00 2.17 2.28 0.00 8 T 8.30 4.14 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 1.18 0.00 0.00 9 E 9.25 4.64 0.00 1.96 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 2.22 2.22 0.00 10 S 7.80 4.68 0.00 4.01 3.87 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 11 Q 8.47 4.77 0.00 1.84 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.91 0.00 0.00 0.00 0.00 0.00 2.25 2.30 0.00 12 E 9.27 4.21 0.00 1.98 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 2.31 2.33 0.00 13 G 9.18 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 Y 8.37 4.21 0.00 3.21 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 15 E 8.28 3.75 0.00 2.23 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 2.44 2.43 0.00 16 P 0.00 4.22 0.00 2.24 2.17 0.00 3.77 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 2.16 2.17 0.00 17 F 8.52 4.02 0.00 3.23 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 18 C 8.39 4.06 0.00 2.71 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 K 8.10 3.82 0.00 1.97 1.82 0.00 1.65 0.00 0.00 1.56 0.00 0.00 2.90 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.42 1.57 7.81 20 L 7.54 3.86 0.00 1.66 1.58 0.95 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 21 I 7.07 3.91 1.66 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.59 0.39 0.00 0.00 22 G 7.44 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 23 I 7.20 3.78 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 1.36 0.83 0.91 0.00 0.00 24 P 0.00 4.40 0.00 2.28 1.95 0.00 3.61 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.15 0.00 25 D 8.80 4.39 0.00 2.71 2.75 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.01 4.44 0.00 2.88 2.93 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 27 V 7.75 3.64 2.21 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 1.09 0.00 0.00 0.94 0.00 0.00 28 I 8.08 3.77 2.06 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.74 0.90 0.00 0.00 29 A 7.92 4.10 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 0.00 0.00 30 K 8.21 4.17 0.00 1.90 1.89 0.00 1.81 0.00 0.00 1.72 0.00 0.00 3.04 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.47 1.49 7.81 31 G 8.36 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 32 R 7.55 3.30 0.00 2.05 2.01 0.00 3.32 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 1.53 1.46 0.00 33 D 7.88 4.56 0.00 2.72 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 34 F 7.93 4.11 0.00 3.04 3.12 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 35 K 7.49 4.15 0.00 1.41 1.72 0.00 1.57 0.00 0.00 1.78 0.00 0.00 2.99 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.25 1.66 7.81 36 L 8.14 4.21 0.00 1.63 1.67 0.91 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 37 V 8.57 4.49 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 1.11 0.00 0.00 0.94 0.00 0.00 38 T 9.38 5.15 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 39 E 9.23 5.21 0.00 2.26 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 2.26 2.31 0.00 40 I 8.97 4.86 2.12 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.06 1.03 0.00 0.00 41 V 8.70 4.29 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 0.93 0.00 0.00 42 Q 8.48 3.95 0.00 1.88 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.70 6.69 0.00 0.00 0.00 0.00 0.00 2.05 1.25 0.00 43 N 8.80 4.97 0.00 2.60 2.63 0.00 0.00 6.55 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 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 45 D 9.13 4.75 0.00 2.81 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 46 D 7.98 5.12 0.00 2.82 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 47 F 8.96 5.11 0.00 1.51 2.40 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 0.00 0.00 0.00 0.00 48 T 8.87 4.96 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 1.26 0.00 0.00 49 W 9.48 4.98 0.00 3.69 3.12 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 50 T 8.93 5.10 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.60 0.00 0.00 51 Q 9.25 5.01 0.00 2.23 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.84 0.00 0.00 0.00 0.00 0.00 2.53 2.63 0.00 52 Y 8.69 4.90 0.00 3.02 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 53 Y 9.18 4.53 0.00 3.07 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 P 0.00 4.31 0.00 1.99 1.63 0.00 3.71 0.00 0.00 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.44 0.00 55 N 9.44 4.17 0.00 2.96 2.94 0.00 0.00 6.88 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 56 N 8.42 4.29 0.00 2.86 2.89 0.00 0.00 7.19 7.89 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 57 H 8.05 4.79 0.00 3.16 3.22 0.00 5.65 0.00 0.00 0.00 0.00 6.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 V 8.49 4.61 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 0.63 0.00 0.00 1.11 0.00 0.00 59 V 8.87 4.30 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 0.83 0.00 0.00 0.53 0.00 0.00 60 T 8.56 5.19 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 1.26 0.00 0.00 61 N 9.59 5.06 0.00 2.73 2.83 0.00 0.00 6.47 7.70 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 62 K 8.85 5.20 0.00 1.66 1.75 0.00 1.74 0.00 0.00 1.78 0.00 0.00 2.95 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.40 1.46 7.81 63 F 8.94 5.11 0.00 3.00 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 I 8.57 4.95 1.95 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.85 0.98 0.00 0.00 65 V 8.50 3.81 2.39 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 0.87 0.00 0.00 1.24 0.00 0.00 66 G 9.18 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 67 K 7.81 4.70 0.00 1.78 1.72 0.00 1.74 0.00 0.00 1.67 0.00 0.00 2.70 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.37 1.36 7.81 68 E 8.91 4.23 0.00 1.98 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.36 0.00 69 S 8.93 4.92 0.00 3.80 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 70 D 8.65 4.85 0.00 2.52 2.53 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 71 M 9.06 4.85 0.00 1.20 0.57 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.23 0.00 72 E 9.37 5.21 0.00 1.90 1.68 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 2.18 2.34 0.00 73 T 8.74 4.74 4.21 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 1.21 0.00 0.00 74 V 8.36 3.38 1.22 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 0.60 0.00 0.00 0.31 0.00 0.00 75 G 7.88 3.64 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 0.00 0.00 0.00 76 G 7.89 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 77 K 7.79 4.10 0.00 1.76 1.71 0.00 1.45 0.00 0.00 1.54 0.00 0.00 2.73 0.00 0.00 2.56 0.00 0.00 0.00 0.00 1.40 1.38 7.81 78 K 8.56 5.11 0.00 1.70 1.71 0.00 1.84 0.00 0.00 1.75 0.00 0.00 2.94 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.37 1.60 7.81 79 F 8.61 4.90 0.00 3.02 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 K 8.91 5.11 0.00 1.70 1.75 0.00 1.80 0.00 0.00 1.73 0.00 0.00 2.75 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.43 1.41 7.81 81 G 9.12 4.35 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 0.00 82 I 8.12 4.72 1.79 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.67 0.83 0.00 0.00 83 V 8.24 4.16 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 0.62 0.00 0.00 0.15 0.00 0.00 84 S 8.80 5.07 0.00 3.89 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 85 M 8.55 5.06 0.00 2.08 2.07 0.00 0.00 0.00 0.00 0.00 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.73 0.00 86 E 9.08 4.51 0.00 1.99 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 0.00 2.22 2.23 0.00 87 G 9.72 3.71 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 0.00 88 G 8.48 4.03 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 0.00 0.00 0.00 89 K 7.84 4.89 0.00 1.91 1.74 0.00 1.65 0.00 0.00 1.59 0.00 0.00 3.04 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.43 1.54 7.81 90 L 9.10 4.84 0.00 1.54 1.20 0.53 -0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 91 T 8.79 5.06 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 1.20 0.00 0.00 92 I 8.48 4.74 1.72 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 1.32 1.01 0.00 0.00 93 S 8.53 5.12 0.00 3.64 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 94 F 9.82 4.82 0.00 3.17 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 95 P 0.00 4.28 0.00 2.08 2.16 0.00 3.82 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.16 0.00 96 K 7.96 4.60 0.00 1.78 1.94 0.00 1.68 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.42 1.39 7.81 97 Y 7.81 5.45 0.00 2.84 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 98 Q 8.47 4.81 0.00 2.13 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.52 0.00 0.00 0.00 0.00 0.00 2.13 2.15 0.00 99 Q 8.42 4.90 0.00 2.03 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.79 0.00 0.00 0.00 0.00 0.00 2.09 2.18 0.00 100 T 8.99 5.10 4.18 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 1.18 0.00 0.00 101 T 9.00 5.26 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 102 E 9.29 5.31 0.00 2.04 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 2.21 2.30 0.00 103 I 8.09 4.70 1.68 0.00 0.00 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.42 0.55 0.98 0.00 0.00 104 S 8.92 4.46 0.00 3.77 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 0.00 105 G 9.98 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 0.00 0.00 0.00 106 G 8.68 4.03 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 0.00 0.00 0.00 107 K 7.69 5.00 0.00 1.92 1.89 0.00 1.70 0.00 0.00 1.63 0.00 0.00 3.01 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.47 1.58 7.81 108 L 8.57 4.27 0.00 0.27 1.23 0.60 0.32 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 0.00 109 V 8.80 4.75 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 0.91 0.00 0.00 0.99 0.00 0.00 110 E 9.35 5.03 0.00 1.91 1.83 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 0.00 2.32 2.31 0.00 111 T 9.16 4.98 4.18 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 1.20 0.00 0.00 112 S 8.98 5.11 0.00 3.22 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 0.00 113 T 8.74 5.22 4.17 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 1.22 0.00 0.00 114 A 9.23 5.31 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 S 8.97 4.88 0.00 3.86 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 G 9.01 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 0.00 117 A 8.62 4.01 1.26 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 0.00 118 Q 7.96 4.47 0.00 1.99 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.98 0.00 0.00 0.00 0.00 0.00 2.23 2.23 0.00 119 G 6.61 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 0.00 120 T 8.23 5.17 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 1.21 0.00 0.00 121 A 8.89 4.84 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 0.00 122 V 8.56 4.93 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 1.00 0.00 0.00 0.96 0.00 0.00 123 L 8.72 4.98 0.00 0.94 0.43 1.00 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 124 V 8.82 4.72 2.06 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 0.91 0.00 0.00 0.90 0.00 0.00 125 R 9.09 5.00 0.00 1.76 1.84 0.00 3.39 0.00 0.00 3.18 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.55 0.00 126 T 8.87 5.12 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 1.24 0.00 0.00 127 S 9.21 5.19 0.00 3.84 3.99 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 0.00 0.00 0.00 0.00 128 K 8.93 4.87 0.00 2.01 1.68 0.00 1.79 0.00 0.00 1.58 0.00 0.00 2.81 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.37 1.41 7.81 129 K 8.78 3.58 0.00 1.30 1.35 0.00 1.48 0.00 0.00 1.28 0.00 0.00 2.47 0.00 0.00 2.71 0.00 0.00 0.00 0.00 0.61 0.21 7.81 130 V 8.24 4.03 1.93 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 0.72 0.00 0.00 0.86 0.00 0.00 131 L 8.11 4.67 0.00 1.56 1.46 0.84 0.85 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 0.00 132 V 8.00 3.75 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 0.65 0.00 0.00 0.88 0.00 0.00 133 P 0.00 4.10 0.00 2.01 1.97 0.00 3.79 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.05 0.00 134 R 8.59 4.07 0.00 1.86 1.83 0.00 3.30 0.00 0.00 3.25 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.64 0.00