NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 17 G 3.8735 8.3549 109.7379 45.3979 0.0000 173.6341 18 L 4.4101 8.2424 124.2472 52.6798 43.7471 170.2741 19 V 4.4777 7.5680 117.9978 61.0621 35.2295 171.2067 20 P 4.5800 0.0000 0.0000 61.3186 32.4302 176.0678 21 V 3.5604 8.3478 121.5617 63.2737 31.7407 175.3136 22 S 4.1897 8.7918 122.5729 60.7491 62.5456 173.7157 23 I 4.5500 7.3249 119.1837 59.1446 39.7430 175.5380 24 I 3.9570 8.4468 126.7043 61.0645 37.4154 175.3605 25 G 4.1946 9.0915 112.1820 42.9471 0.0000 172.0795 26 A 4.0215 8.2293 121.8593 53.4475 18.6162 177.9498 27 E 4.8038 8.8131 117.0060 57.6171 27.0337 175.6209 28 D 4.8032 7.7595 116.4344 54.7770 40.8979 176.3475 29 E 4.5724 7.9227 118.8123 56.2366 31.4963 176.1132 30 D 4.4170 7.7580 117.1807 56.0285 41.6376 176.6322 31 F 4.7997 7.6478 118.8486 56.5586 40.0514 175.9787 32 E 4.0493 8.5482 122.2452 58.1462 29.7747 175.7970 33 N 4.9210 7.5532 114.5991 51.6211 40.4305 173.6454 34 E 3.9814 9.0755 127.2876 56.6095 28.2774 177.8785 *44 S 4.3138 9.0338 106.1362 58.4420 64.8609 172.7431 45 Q 4.3606 8.9364 121.4169 57.4201 30.9625 176.9947 46 F 4.5266 8.1876 117.6151 56.3552 37.6856 175.1887 47 Q 4.4079 8.0865 122.2446 57.1658 30.3018 176.5738 48 S 4.7587 7.4908 110.2522 55.1865 66.4760 174.4185 49 L 3.9455 8.4979 122.8388 58.2068 41.4768 178.8365 50 E 3.9295 8.1099 118.2307 59.3676 29.5741 178.5471 51 Q 4.1009 7.8390 117.6060 59.0195 29.0192 178.9260 52 V 3.6330 7.6588 119.3050 63.6267 31.6265 177.6965 53 K 4.2726 8.0198 117.6838 58.5379 32.5685 177.6807 54 R 4.3040 7.3579 117.9603 57.1628 31.2402 176.9997 55 R 4.4156 7.7176 118.0888 54.1078 30.8958 175.2083 56 P 4.2936 0.0000 0.0000 65.8474 31.2085 178.2523 57 A 3.9375 7.8930 120.0988 55.2632 18.5046 179.0340 58 H 4.2856 8.2000 114.0478 59.1207 28.6824 177.6790 59 L 4.0843 8.1828 122.0527 58.2505 41.8861 178.8069 60 M 4.1291 8.0376 118.1961 58.3540 31.9370 178.4364 61 A 4.2841 8.0475 120.8480 55.2975 18.6541 179.0679 62 L 3.2436 7.8878 118.6446 58.3280 41.9287 179.3689 63 L 4.0070 8.2594 118.7232 58.0145 41.3712 179.2905 64 Q 4.0607 8.7562 119.7709 59.2439 28.8639 178.0313 65 H 4.3499 8.4437 119.4577 59.2694 30.1964 177.4319 66 V 3.9856 8.4579 119.8615 65.3789 31.0122 177.9403 67 A 4.0347 8.1405 120.4615 55.2586 18.5436 179.0750 68 L 4.2090 7.4255 113.1101 56.1342 41.9781 177.7435 69 Q 4.2305 7.8316 115.5756 55.5787 31.2884 174.6837 70 F 4.8516 7.7071 114.0204 56.0057 42.7872 172.8772 71 E 4.4223 8.8589 121.2256 55.4760 29.8544 175.3898 72 P 4.5071 0.0000 0.0000 63.4934 31.2005 178.0473 73 G 3.8406 7.6882 107.0093 45.6883 0.0000 173.9654 74 P 4.3934 0.0000 0.0000 64.5189 32.2502 178.1202 75 L 3.8643 7.8292 118.2338 58.2677 42.2570 178.7635 76 L 4.0164 7.6884 118.9166 57.7530 41.3566 179.1731 77 C 3.1963 7.9450 118.8668 62.3990 31.6324 175.0737 78 C 3.8888 7.7697 117.7680 62.9190 27.5003 176.4557 79 L 3.4852 7.2842 118.7938 57.9859 41.5050 178.9116 80 H 4.3612 7.9144 115.4329 58.6843 28.6157 177.5485 81 A 3.5281 7.9097 122.7613 55.2916 17.9672 179.2101 82 D 4.2933 7.6911 114.7359 57.6969 41.2870 177.9694 83 M 3.9817 7.7105 118.3672 56.7800 32.0352 177.1527 84 L 3.8739 8.1616 118.4086 55.3533 40.5552 178.2281 85 G 4.1405 8.5036 115.0616 43.7328 0.0000 171.7448 *89 P 4.2018 0.0000 0.0000 62.3449 31.9181 176.1939 90 K 3.9586 7.6856 123.2150 58.1128 32.3783 176.5447 91 E 4.2457 8.5458 114.7773 56.5665 31.2787 177.9407 92 A 4.0592 7.9166 124.2091 55.5690 18.1590 179.9545 93 K 4.1555 8.0354 116.6490 58.8840 32.1493 178.9404 94 K 3.9371 8.2946 118.4410 58.9684 32.0984 178.6816 95 A 4.2925 7.9631 120.8013 54.8762 18.8111 179.0574 96 F 4.2437 8.2040 118.7016 61.0717 39.0421 176.8417 97 L 4.0131 7.4651 119.1753 58.4641 42.1427 178.2701 98 D 4.5700 8.1507 117.9701 57.5817 40.5803 178.2777 99 F 4.4874 8.1685 120.8634 61.9711 39.1516 176.7263 100 Y 3.4993 7.6010 118.8275 60.3400 38.4790 176.6473 101 H 4.5105 8.3585 115.2838 57.4294 29.1194 176.6732 102 S 4.2525 7.7591 116.1975 58.4897 63.7636 174.8763 103 F 5.2193 7.1078 116.3998 58.1388 40.8516 177.6363 104 L 3.7172 7.2841 118.0837 56.8598 41.3682 177.4551 105 E 3.6777 7.4853 119.3623 56.0746 29.9271 177.8277 106 K 4.0850 8.5506 125.4522 58.8619 32.5178 177.0429 107 T 4.5882 7.0347 105.3524 60.9333 69.0877 174.0741 108 A 4.1276 7.8713 123.6724 52.8143 19.3569 178.9630 109 V 3.5844 8.2504 119.5056 65.9670 32.4608 177.4570 110 L 4.5201 6.9869 120.7469 53.4653 39.7346 176.6489 111 R 4.4498 7.6338 119.2707 56.6879 31.0831 176.8656 112 V 4.7273 8.0093 118.8634 58.4144 35.1437 173.9228 113 P 4.3339 0.0000 0.0000 62.9676 31.6703 176.1668 114 V 4.5206 7.9811 115.3945 58.1379 35.0052 174.3286 115 P 4.4351 0.0000 0.0000 62.3030 33.0813 176.1762 116 P 4.3987 0.0000 0.0000 65.6545 31.1054 178.5846 117 N 4.5858 8.1288 116.2807 55.6695 37.8071 176.8568 118 V 4.1224 7.7716 119.8496 65.4472 31.6587 177.8289 119 A 4.0273 8.0662 119.4659 54.9369 18.2015 178.8517 120 F 4.4934 7.8572 116.7942 60.0653 40.1263 175.2624 121 E 4.3041 8.1445 118.6138 55.9515 29.3016 178.1849 122 L 4.3308 7.0604 118.6426 53.3065 44.0196 176.2703 *134 V 3.9132 8.1740 123.0202 62.5984 33.6193 177.3829 135 Q 3.9454 7.9272 119.6252 59.4132 28.7648 178.4934 136 R 4.0135 7.8761 118.4622 59.1045 28.8787 178.7655 137 R 3.9021 7.6856 117.9433 58.7662 29.8779 178.6346 138 F 4.5929 7.8695 117.7382 60.3443 39.3074 177.7797 139 V 3.8881 8.2070 117.3359 66.4869 31.3509 177.3685 140 Q 4.1110 8.1323 119.0671 59.3935 28.4431 178.5475 141 E 3.9379 7.5104 119.5072 59.2649 29.9906 178.5597 142 V 3.7862 7.9966 118.3662 66.0283 31.6081 178.1938 143 V 3.6161 8.4052 118.3678 65.9156 31.1815 177.4149 144 Q 4.0946 7.8291 114.5187 57.0321 28.6227 175.9493 145 S 4.6488 7.6418 112.5545 58.6112 64.6055 175.4392 146 Q 4.2556 8.1648 118.7166 58.1857 28.5924 177.6814 147 Q 3.7749 7.8337 118.1768 59.0211 28.8356 179.4840 148 V 3.5462 7.8006 118.0565 66.1392 31.2323 178.0712 149 A 3.9200 7.8805 119.7111 55.3071 17.9296 179.6477 150 V 3.6462 8.5205 116.6300 65.1730 31.4827 178.5866 151 G 3.5211 7.9986 105.9370 48.1290 0.0000 176.0430 152 R 3.9709 7.9905 121.1036 58.7802 29.9782 179.0686 153 Q 3.5602 7.5339 117.1546 58.2752 28.8053 178.3261 154 L 4.0674 7.5646 119.5494 57.4915 41.6761 178.9302 155 E 3.9138 8.2057 119.3279 59.5668 29.6448 178.5272 156 D 4.4083 7.9620 117.5244 57.0594 41.1439 178.1073 157 F 3.7689 8.2760 121.4066 61.2769 39.5451 177.3684 158 R 3.9163 8.6153 118.0840 59.3204 29.6642 179.1943 159 S 4.0569 8.1796 114.8633 61.6925 62.8526 176.8372 160 K 3.8274 7.9365 120.9933 59.3156 31.7459 179.2148 161 R 3.7516 7.7448 120.6879 58.5766 29.6489 178.5651 162 L 3.9301 7.3626 116.6551 58.3050 41.6619 178.3417 163 M 4.2132 7.7646 114.1738 54.9200 31.6289 176.4314 164 G 3.9230 7.5417 106.7684 47.3707 0.0000 173.9820 165 M 4.4273 8.1602 115.0275 54.8689 33.0762 175.2875 166 T 4.0592 7.2126 108.0980 60.3057 70.1926 172.6434 167 P 4.2360 0.0000 0.0000 62.1166 32.4665 175.5385 168 W 4.3644 7.8050 113.7886 56.1745 26.9597 176.6332 169 E 4.0741 7.8698 120.5444 58.8838 28.8994 178.0135 170 Q 3.9955 8.1291 119.7034 59.3514 28.9159 177.5129 171 E 4.0146 8.2432 118.9871 59.2977 29.4913 178.6591 172 L 4.0067 8.3881 120.3311 58.5694 41.9325 178.9971 173 A 4.2685 8.0382 119.4626 55.3041 18.4138 179.0688 174 Q 4.1024 8.0352 117.3452 59.1052 29.2600 177.7905 175 L 4.2848 8.2053 121.1679 56.9031 42.7601 176.8474 176 E 4.7485 7.8960 119.3555 55.1479 28.6627 176.0786 177 A 4.7252 7.7017 119.7940 52.9198 26.3000 178.9472 178 W 4.4349 7.6470 124.6251 57.1721 30.2156 178.5776 *185 S 4.4938 8.7905 110.8112 58.0894 63.4592 174.6422 186 Y 4.0901 8.1332 120.6185 60.6107 38.6335 177.2369 187 E 3.9368 8.3812 118.4747 58.5840 29.3194 179.0083 188 A 3.8371 7.4175 121.6926 55.0513 18.3703 179.5795 189 R 3.6976 7.2802 116.5367 59.1206 30.1918 177.6800 190 E 3.5441 7.7485 119.4032 59.5404 28.9891 178.9630 191 R 4.1288 7.9213 117.0746 58.3355 29.9192 178.5230 192 H 4.1696 7.4884 117.2846 59.3378 29.9991 177.2962 193 V 3.3608 8.4634 120.7653 65.7289 31.0822 177.7690 194 A 3.9264 7.5208 119.3470 55.1925 18.1635 179.4937 195 E 3.6326 7.7599 114.9199 59.3484 29.3926 179.4231 196 R 3.7519 7.5504 119.4792 59.2237 30.1737 178.4862 197 L 3.3097 7.6938 118.7674 57.5073 41.4616 179.2544 198 L 4.0387 8.5995 120.6321 58.0418 41.8076 178.9472 199 M 4.2995 7.5292 118.8483 58.5177 31.8831 178.1360 200 H 4.2215 7.5898 114.8764 58.7426 29.0491 177.1912 201 L 4.3335 7.8920 121.8661 57.8269 41.8516 178.8301 202 E 4.1742 7.7011 118.6058 58.7893 29.4070 178.7695 203 E 4.2160 8.4297 116.6561 58.3349 29.7349 177.4586 204 M 4.8968 7.5428 117.5382 54.8314 33.7778 177.0745 205 Q 4.2790 8.4321 118.9004 58.5657 28.7849 177.1812 206 H 4.6628 7.6156 114.5218 56.2551 28.1744 176.3757 207 T 4.6658 7.8785 105.2991 62.0388 71.5418 174.5295 208 I 3.7783 7.9477 123.8828 64.6649 37.2932 175.6421 209 S 4.5177 7.3410 110.5059 57.6327 64.8737 175.4061 210 T 3.8140 8.7521 118.6588 65.0017 67.2998 173.3504 211 D 4.3394 8.0121 122.5266 54.4547 40.5180 176.1335 212 E 4.1610 8.7785 125.9186 57.8727 29.7028 177.2957 213 E 4.4480 8.1592 119.8821 57.4767 31.2424 177.5088 214 K 3.9658 8.8958 120.0182 59.0902 32.0827 179.0476 215 S 4.0392 7.9922 114.1750 61.5131 63.2420 176.0947 216 A 3.9762 8.0332 124.4201 54.4153 18.0912 179.2940 217 A 3.8788 7.9574 119.2227 55.3162 18.0613 179.8981 218 V 3.5445 7.7128 116.8054 66.1606 31.5351 178.4351 219 V 3.6594 7.8028 117.8108 66.2362 31.5461 177.8209 220 N 4.3788 8.1864 115.9001 56.2424 38.1340 177.2721 221 A 4.2492 8.1031 121.2502 54.7050 18.6942 178.9391 222 I 4.3089 7.5087 116.9105 63.0976 37.5921 178.3963 223 G 3.7078 8.1466 106.9880 48.0706 0.0000 175.2989 224 L 4.0295 7.9433 121.5392 57.8182 41.4693 178.9720 225 Y 3.9690 8.0895 118.8294 60.9797 38.9619 178.1463 226 M 4.2012 8.2582 119.8008 58.3483 32.0835 178.4823 227 R 4.0739 8.2600 120.5755 59.1153 29.9810 177.8427 228 H 4.0555 8.1529 117.0049 58.2375 29.7976 175.9872 229 L 4.4745 7.8129 118.5765 53.9901 42.3904 176.9395 230 G 3.8513 8.1603 107.8208 44.9761 0.0000 173.9047 231 V 3.9710 7.6414 120.2902 61.6116 31.2733 174.8163 232 R 4.7122 8.2661 125.8181 54.6689 32.9051 176.5241 233 T 4.1701 8.2930 115.4977 63.8227 68.8445 174.5022 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 17 G 8.35 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 0.00 0.00 0.00 18 L 8.24 4.41 0.00 1.73 1.63 0.93 0.58 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 19 V 7.57 4.48 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 0.78 0.00 0.00 0.93 0.00 0.00 20 P 0.00 4.58 0.00 2.22 2.03 0.00 3.84 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 1.96 1.94 0.00 21 V 8.35 3.56 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 0.78 0.00 0.00 0.94 0.00 0.00 22 S 8.79 4.19 0.00 3.87 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 23 I 7.32 4.55 1.87 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 1.42 0.79 0.91 0.00 0.00 24 I 8.45 3.96 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 0.47 0.98 0.00 0.00 25 G 9.09 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 26 A 8.23 4.02 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 27 E 8.81 4.80 0.00 2.32 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 0.00 2.35 2.33 0.00 28 D 7.76 4.80 0.00 2.92 2.73 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 29 E 7.92 4.57 0.00 1.88 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 2.17 2.33 0.00 30 D 7.76 4.42 0.00 2.82 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 0.00 0.00 0.00 0.00 31 F 7.65 4.80 0.00 3.08 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 32 E 8.55 4.05 0.00 1.92 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.42 0.00 33 N 7.55 4.92 0.00 2.83 2.77 0.00 0.00 6.84 7.54 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 34 E 9.08 3.98 0.00 1.95 1.66 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 2.23 2.36 0.00 *44 S 9.03 4.31 0.00 4.09 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 45 Q 8.94 4.36 0.00 2.18 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.63 7.44 0.00 0.00 0.00 0.00 0.00 2.30 2.44 0.00 46 F 8.19 4.53 0.00 3.12 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 47 Q 8.09 4.41 0.00 2.05 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.80 0.00 0.00 0.00 0.00 0.00 2.35 2.30 0.00 48 S 7.49 4.76 0.00 3.93 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 49 L 8.50 3.95 0.00 1.74 1.68 0.85 0.71 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 50 E 8.11 3.93 0.00 1.97 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 2.29 2.47 0.00 51 Q 7.84 4.10 0.00 2.19 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.60 0.00 0.00 0.00 0.00 0.00 2.36 2.49 0.00 52 V 7.66 3.63 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 0.89 0.00 0.00 0.78 0.00 0.00 53 K 8.02 4.27 0.00 1.94 2.03 0.00 1.77 0.00 0.00 1.75 0.00 0.00 2.99 0.00 0.00 3.23 0.00 0.00 0.00 0.00 1.67 1.49 7.81 54 R 7.36 4.30 0.00 1.78 2.05 0.00 3.17 0.00 0.00 3.24 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.62 0.00 55 R 7.72 4.42 0.00 1.89 1.99 0.00 3.25 0.00 0.00 3.22 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.67 0.00 56 P 0.00 4.29 0.00 2.25 2.31 0.00 3.74 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.02 0.00 57 A 7.89 3.94 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 58 H 8.20 4.29 0.00 3.07 2.95 0.00 5.63 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 L 8.18 4.08 0.00 2.17 1.95 0.93 1.03 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 60 M 8.04 4.13 0.00 2.22 2.41 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.78 2.97 0.00 61 A 8.05 4.28 1.75 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 0.00 0.00 62 L 7.89 3.24 0.00 1.48 1.86 0.56 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 63 L 8.26 4.01 0.00 1.96 1.79 0.93 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 64 Q 8.76 4.06 0.00 2.54 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.84 0.00 0.00 0.00 0.00 0.00 2.63 3.07 0.00 65 H 8.44 4.35 0.00 3.64 3.78 0.00 5.84 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 74 P 0.00 4.39 0.00 2.14 2.18 0.00 4.10 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 2.13 2.18 0.00 75 L 7.83 3.86 0.00 1.71 1.64 0.84 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 76 L 7.69 4.02 0.00 2.16 1.91 0.99 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 77 C 7.95 3.20 0.00 2.88 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 78 C 7.77 3.89 0.00 2.92 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 79 L 7.28 3.49 0.00 1.33 0.72 0.66 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 80 H 7.91 4.36 0.00 3.26 3.31 0.00 5.65 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 81 A 7.91 3.53 1.18 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 0.00 0.00 82 D 7.69 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0.00 154 L 7.56 4.07 0.00 1.85 1.76 0.93 0.76 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 0.00 155 E 8.21 3.91 0.00 2.21 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 2.33 2.34 0.00 156 D 7.96 4.41 0.00 2.94 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 0.00 157 F 8.28 3.77 0.00 3.26 3.11 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 0.00 0.00 0.00 0.00 158 R 8.62 3.92 0.00 2.05 2.01 0.00 3.28 0.00 0.00 3.56 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 2.06 0.00 159 S 8.18 4.06 0.00 4.02 3.89 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 0.00 160 K 7.94 3.83 0.00 1.44 1.69 0.00 1.65 0.00 0.00 1.52 0.00 0.00 2.97 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.75 1.62 7.81 161 R 7.74 3.75 0.00 1.38 1.87 0.00 2.96 0.00 0.00 2.92 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.51 0.00 162 L 7.36 3.93 0.00 1.80 1.69 0.91 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 163 M 7.76 4.21 0.00 1.90 2.11 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 2.44 0.00 164 G 7.54 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 0.00 165 M 8.16 4.43 0.00 1.81 1.94 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.41 0.00 166 T 7.21 4.06 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 0.09 0.00 0.00 167 P 0.00 4.24 0.00 1.16 1.76 0.00 3.82 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 2.04 1.91 0.00 168 W 7.80 4.36 0.00 3.55 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 0.00 169 E 7.87 4.07 0.00 2.23 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 2.31 2.41 0.00 170 Q 8.13 4.00 0.00 2.29 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.68 0.00 0.00 0.00 0.00 0.00 2.49 2.57 0.00 171 E 8.24 4.01 0.00 2.18 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.44 0.00 172 L 8.39 4.01 0.00 2.18 1.95 0.95 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 173 A 8.04 4.27 1.42 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 0.00 0.00 0.00 174 Q 8.04 4.10 0.00 2.23 2.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.07 6.96 0.00 0.00 0.00 0.00 0.00 2.44 2.44 0.00 175 L 8.21 4.28 0.00 1.80 1.84 0.60 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 176 E 7.90 4.75 0.00 2.21 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 0.00 2.57 2.73 0.00 177 A 7.70 4.73 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 0.00 178 W 7.65 4.43 0.00 3.29 2.59 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 *185 S 8.79 4.49 0.00 4.05 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 0.00 186 Y 8.13 4.09 0.00 3.17 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 0.00 187 E 8.38 3.94 0.00 2.06 1.98 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 2.63 2.49 0.00 188 A 7.42 3.84 1.16 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 0.00 189 R 7.28 3.70 0.00 1.13 1.31 0.00 2.32 0.00 0.00 2.95 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.26 0.00 190 E 7.75 3.54 0.00 1.57 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.35 0.00 191 R 7.92 4.13 0.00 1.97 1.89 0.00 3.12 0.00 0.00 3.23 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.58 0.00 192 H 7.49 4.17 0.00 3.28 3.22 0.00 5.62 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 193 V 8.46 3.36 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 0.85 0.00 0.00 0.81 0.00 0.00 194 A 7.52 3.93 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 0.00 195 E 7.76 3.63 0.00 2.31 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 2.44 2.24 0.00 196 R 7.55 3.75 0.00 1.73 1.96 0.00 2.99 0.00 0.00 3.01 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.52 0.00 197 L 7.69 3.31 0.00 1.68 1.22 0.90 -0.34 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 0.00 198 L 8.60 4.04 0.00 1.77 1.83 0.96 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 199 M 7.53 4.30 0.00 2.22 2.11 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.53 0.00 200 H 7.59 4.22 0.00 2.90 3.44 0.00 5.65 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 0.00 201 L 7.89 4.33 0.00 1.99 1.92 1.05 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 202 E 7.70 4.17 0.00 2.23 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 0.00 2.34 2.45 0.00 203 E 8.43 4.22 0.00 1.93 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 0.00 2.35 2.41 0.00 204 M 7.54 4.90 0.00 2.20 2.09 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 2.71 2.72 0.00 205 Q 8.43 4.28 0.00 2.19 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.84 7.11 0.00 0.00 0.00 0.00 0.00 2.31 2.16 0.00 206 H 7.62 4.66 0.00 3.26 3.35 0.00 5.65 0.00 0.00 0.00 0.00 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 207 T 7.88 4.67 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 1.24 0.00 0.00 208 I 7.95 3.78 1.88 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 1.33 0.61 0.93 0.00 0.00 209 S 7.34 4.52 0.00 3.76 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 0.00 210 T 8.75 3.81 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 1.20 0.00 0.00 211 D 8.01 4.34 0.00 2.78 2.57 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 0.00 0.00 0.00 0.00 212 E 8.78 4.16 0.00 1.98 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 0.00 2.48 2.37 0.00 213 E 8.16 4.45 0.00 1.97 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 0.00 2.18 2.40 0.00 214 K 8.90 3.97 0.00 1.92 1.78 0.00 1.67 0.00 0.00 1.68 0.00 0.00 3.01 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.42 1.42 7.81 215 S 7.99 4.04 0.00 4.21 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 216 A 8.03 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 0.00 217 A 7.96 3.88 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 218 V 7.71 3.54 2.26 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 1.02 0.00 0.00 1.04 0.00 0.00 219 V 7.80 3.66 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 1.00 0.00 0.00 1.03 0.00 0.00 220 N 8.19 4.38 0.00 2.83 2.89 0.00 0.00 6.97 8.08 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 0.00 221 A 8.10 4.25 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 0.00 222 I 7.51 4.31 2.06 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.96 1.01 0.00 0.00 223 G 8.15 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 0.00 224 L 7.94 4.03 0.00 1.90 1.75 1.01 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 225 Y 8.09 3.97 0.00 3.04 3.11 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 0.00 0.00 0.00 0.00 226 M 8.26 4.20 0.00 2.11 2.41 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.92 0.00 227 R 8.26 4.07 0.00 1.95 2.08 0.00 3.15 0.00 0.00 3.18 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.49 0.00 228 H 8.15 4.06 0.00 3.13 3.07 0.00 5.77 0.00 0.00 0.00 0.00 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 229 L 7.81 4.47 0.00 1.62 1.59 0.98 0.69 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 0.00 230 G 8.16 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 0.00 0.00 0.00 231 V 7.64 3.97 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.90 0.00 0.00 232 R 8.27 4.71 0.00 1.78 1.78 0.00 3.19 0.00 0.00 3.20 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.58 0.00 233 T 8.29 4.17 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 1.29 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.