NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 P 4.3413 0.0000 0.0000 61.9871 33.1630 175.5538 4 T 3.7194 7.9843 108.7718 61.2973 69.1668 173.4731 5 A 3.8693 9.4521 127.2958 54.5625 19.3844 178.1627 6 I 4.3297 7.0000 114.4350 59.5245 38.4127 175.1704 7 E 3.9132 8.6766 126.6848 58.8112 29.8584 176.5166 8 H 4.4458 7.2417 113.4712 54.5653 32.4120 171.2825 *10 E 3.7904 8.5291 118.2424 55.5149 28.9399 174.1661 11 P 3.2196 0.0000 0.0000 61.5756 32.1129 175.7166 12 P 4.3519 0.0000 0.0000 65.3515 31.3900 176.0670 13 F 3.8401 6.5484 110.0896 55.5441 41.0121 172.0757 14 W 5.1836 8.6039 129.1533 56.2957 34.0848 173.0332 15 W 5.5034 8.3201 117.0675 54.7894 32.1959 175.5424 16 A 4.2618 9.1031 124.7255 52.9323 19.0140 174.8321 17 G 3.5403 8.8290 114.0900 45.4022 0.0000 173.3110 *19 Q 4.2359 8.4510 125.8064 55.6674 30.6756 175.0199 20 H 4.5680 9.0724 118.1582 55.3720 30.2418 175.0715 21 K 4.3878 8.6609 127.0660 58.9995 33.1512 177.6841 22 G 4.1069 7.9270 106.6492 46.0861 0.0000 173.2755 23 L 4.5699 9.0292 124.7167 53.3053 45.6996 174.4712 24 Q 4.6634 9.7182 129.2893 54.8528 29.9868 174.7805 25 L 4.7333 8.7322 132.0446 53.3577 45.1363 175.6107 *27 V 4.1038 8.2130 118.7692 63.9344 33.1413 175.0722 28 H 4.9723 8.8228 127.3039 54.3747 32.7619 172.4144 29 G 4.2348 8.0300 110.3248 45.6331 0.0000 172.7083 30 R 4.2273 8.5942 121.7613 57.6651 30.4559 175.7576 31 D 4.5076 9.6892 123.9189 55.1962 39.1993 175.7126 32 I 3.5560 7.6360 121.7263 63.7640 37.9356 177.5934 33 G 3.7528 8.2771 108.0634 47.0943 0.0000 174.0056 34 R 4.2201 7.4061 121.4635 55.1483 29.3470 176.1820 *36 E 4.2382 7.6791 118.5743 56.1474 31.5183 175.0716 37 A 5.1394 8.6194 127.4570 50.9542 21.3818 175.6467 38 A 4.6684 8.2728 120.2630 51.3618 23.1893 175.2069 39 L 4.6884 7.9959 117.8155 55.3697 43.3737 174.4458 40 D 4.4882 8.5384 118.6796 53.2143 43.0251 173.9362 41 Y 4.6806 8.0322 126.7825 55.4139 41.8183 172.0872 42 P 4.3020 0.0000 0.0000 64.1525 31.8934 176.8553 43 G 3.9583 9.0285 111.0306 45.1442 0.0000 172.6765 44 V 4.8284 7.4208 118.9016 60.8823 33.7382 174.6091 45 R 4.5543 8.6284 125.6744 54.2764 33.4373 173.6470 46 L 4.2952 8.5859 128.7617 55.3136 41.9932 176.3255 47 V 4.0203 8.9551 128.1983 65.1649 32.3613 175.7737 48 S 4.7951 7.3936 112.3582 58.0956 65.6219 174.8253 49 T 5.2163 8.5938 109.6914 60.2770 71.7769 173.2226 50 T 4.7825 9.5202 120.5776 61.9385 71.8271 173.2078 51 R 5.1552 8.7671 123.8624 54.5603 33.2604 175.3264 52 V 4.5596 8.2540 113.9369 58.5295 35.1536 174.0892 53 P 4.2234 0.0000 0.0000 65.6335 31.3542 176.4274 54 N 4.4813 8.1287 116.6530 52.9212 38.2703 174.7597 55 A 4.2645 8.5757 128.2185 53.7355 19.3400 177.5247 56 N 4.7996 9.0945 113.3278 53.3537 39.9857 174.2773 57 Y 5.1307 7.9976 116.7888 56.0091 42.1747 174.2260 58 L 4.7998 8.7397 124.6309 53.3420 45.4786 175.3691 59 F 4.9169 9.2886 124.8019 55.8764 41.3930 174.6465 60 V 4.5273 9.1222 125.1052 61.2520 33.7008 174.0021 61 D 5.1773 9.2926 129.3810 53.3147 42.2572 175.7944 62 L 5.1779 9.3850 124.3159 52.7953 45.6047 175.1464 63 E 4.8741 9.1204 123.0973 54.7490 31.8763 174.9540 64 I 4.6074 8.8482 129.9986 59.7087 37.9175 176.2401 65 G 4.1832 9.0892 115.5262 44.4754 0.0000 171.8283 66 P 4.5011 0.0000 0.0000 64.6354 31.5533 177.5882 67 E 4.2091 8.1400 114.9959 56.8857 30.3786 176.1714 68 A 4.3520 7.9138 123.9726 52.7186 18.7747 176.9559 69 Q 4.7553 8.4277 121.6878 53.3249 31.0765 173.9659 70 P 4.7133 0.0000 0.0000 62.3902 32.8681 177.8395 71 G 4.0290 7.4786 108.0258 45.8866 0.0000 171.6138 72 S 4.8535 7.9715 117.4627 57.5146 66.1084 174.3243 73 F 5.0547 8.1319 115.0151 55.4070 41.2917 173.4291 74 D 4.9824 8.9707 121.7062 54.5890 41.8940 175.6265 75 I 4.4753 9.2318 124.2015 59.9265 39.2437 174.8850 76 V 4.6805 8.7095 121.4561 59.5390 34.0975 174.9711 77 F 5.3379 9.2891 124.2638 55.7860 41.0728 174.6771 78 K 5.0288 8.6552 124.0572 54.5861 34.5048 176.2808 79 G 3.8774 9.3634 110.1974 46.3474 0.0000 172.8438 80 D 4.3129 9.9488 120.5426 55.1544 38.5305 173.9406 81 G 4.2878 8.2528 114.5517 46.0685 0.0000 174.0467 82 R 4.1356 7.2484 116.9516 55.8241 30.0391 175.2939 83 S 5.1665 8.2909 112.7690 57.1231 65.3095 172.7299 84 E 4.9857 9.8819 126.5197 54.7616 33.3438 174.7855 85 R 5.1853 8.4305 119.9126 55.2587 33.7278 173.4911 86 Y 4.6005 8.9479 125.7010 55.8001 42.3799 173.9703 87 R 4.3995 8.1778 127.5103 56.2669 30.6897 174.5678 88 Y 4.3485 8.8499 129.7804 56.1002 40.4612 174.5150 89 R 4.6427 7.7041 125.6729 54.9553 32.5976 175.2783 90 L 5.0907 8.8680 123.3171 53.1573 43.9735 176.1550 91 L 4.7063 8.6044 124.5276 53.5156 43.7457 176.0442 92 A 4.6536 8.4382 122.6680 51.7484 19.3570 177.7568 93 R 4.3078 8.5918 120.3342 54.9448 31.6211 176.4056 94 E 4.0235 8.4647 121.3899 56.0287 30.2809 176.1523 95 Q 4.1245 8.4829 125.9138 57.4295 29.4002 176.4843 96 G 3.9154 8.9373 111.7573 46.0059 0.0000 175.0246 97 S 4.0215 8.1102 115.8952 61.1857 62.5862 176.5646 98 A 4.0287 8.0373 122.5352 54.8959 18.2930 178.3623 99 Q 4.5973 7.6278 112.5866 55.4470 28.8636 175.9895 100 R 3.8310 7.5255 114.5864 56.9632 29.5273 175.7461 101 Q 4.1610 8.5567 122.9707 55.6963 29.7419 175.7233 102 G 4.4711 8.7792 114.7928 45.8535 0.0000 173.2113 103 F 4.6610 8.6004 115.6092 57.2133 38.6867 174.9411 104 G 4.1337 9.3644 109.2269 43.6018 0.0000 170.9712 105 P 4.1775 0.0000 0.0000 65.2862 31.2462 178.0992 106 G 3.2059 7.8417 105.3489 46.9818 0.0000 173.5228 107 D 4.9536 8.1337 119.0831 52.7334 42.2657 175.4378 108 A 4.9600 8.2383 121.2956 50.4953 22.3349 174.9043 109 I 4.8379 9.2761 124.2006 60.1205 39.4703 174.1839 110 Y 4.5231 8.8709 128.4630 55.8767 40.5507 173.8888 111 Q 4.4921 8.8309 129.3681 53.8695 30.9472 172.9550 112 I 4.5418 7.7577 121.6548 60.0428 40.4972 175.8765 *114 P 4.3266 0.0000 0.0000 62.3819 32.7981 177.9145 115 D 5.1368 8.3071 114.7385 55.8324 41.6176 176.4714 116 R 4.9872 8.3337 116.0583 56.2846 30.8220 176.6488 117 F 4.8455 7.9775 120.1675 58.9102 40.6300 174.5600 118 A 4.1820 7.3542 120.4480 50.6155 21.7688 174.8784 119 N 4.6949 7.7016 123.9999 52.0799 37.3243 174.8047 120 G 3.5449 9.1199 112.8469 46.6296 0.0000 171.2008 121 D 4.4506 8.6882 119.9181 52.2492 42.8512 173.8691 122 P 5.2467 0.0000 0.0000 64.5758 31.6781 179.0045 123 S 4.2832 8.3763 112.3702 60.0616 63.3504 174.5142 124 N 4.8150 7.7464 116.7583 52.5712 37.9018 176.4021 125 D 4.4493 8.0888 121.1319 56.9688 41.1484 176.2693 126 N 5.2622 7.8763 113.9415 51.2366 42.0217 173.7859 127 V 4.3928 7.9998 119.8442 60.8901 34.8542 174.9002 128 A 4.0614 8.9094 130.5403 55.6899 18.2437 179.3967 129 G 3.6506 7.9853 99.2502 47.4959 0.0000 174.2643 *131 R 4.2531 7.9381 118.5224 55.8408 31.8022 175.6400 132 E 3.9962 7.9316 118.1828 55.7210 29.8663 176.0125 133 Q 4.4089 8.4226 127.1049 55.7504 30.2128 174.3676 134 A 4.6905 8.2605 123.2682 51.1766 22.3825 175.5924 135 D 4.9218 8.1566 118.9274 52.2792 45.0401 176.1157 136 R 3.5640 8.6204 120.1391 59.4686 30.1538 179.3524 137 R 3.7168 7.8771 115.1191 59.0470 30.3313 176.0697 138 H 4.5502 7.8844 117.9454 54.4361 30.5036 176.1622 139 G 3.6518 8.7352 116.1979 47.7969 0.0000 174.0205 140 G 4.1949 8.3615 106.8613 45.1710 0.0000 173.0843 141 G 3.8039 7.9242 109.9673 43.8782 0.0000 173.8096 142 R 4.6328 8.1663 118.3146 55.2775 30.2782 176.8419 143 H 4.4525 10.0636 121.8540 56.8504 29.0731 176.6894 144 G 4.2425 9.3857 108.1461 44.8509 0.0000 174.1958 145 G 3.9948 8.7804 108.4947 45.3326 0.0000 172.5215 146 D 5.0677 8.7752 120.4452 50.8733 42.9876 176.4860 147 I 3.7531 8.8438 119.9112 64.5725 36.9035 178.5502 148 R 3.9919 8.2373 119.1951 59.5711 29.5451 178.5788 149 G 3.4730 8.2131 103.8477 47.9873 0.0000 175.3713 150 T 4.4115 7.8602 117.7730 66.6448 68.3936 176.8359 151 I 3.7382 8.1525 122.0560 64.4328 36.9227 177.8066 152 D 4.4925 7.9402 117.6810 56.0530 40.7826 176.5542 153 H 4.9561 7.9548 115.7900 54.8093 30.4091 175.3003 154 L 4.0784 7.9619 123.2496 58.1779 41.3425 179.1953 155 D 4.0629 8.1467 118.2804 57.3413 40.6535 178.1430 156 Y 4.1757 7.9979 119.7657 60.6738 38.5385 177.7919 157 I 3.1416 7.9421 120.4438 64.2265 37.1917 178.2345 158 A 4.3497 8.4016 124.2168 54.5697 17.9611 179.7001 159 G 3.6152 8.2253 103.4761 48.1001 0.0000 175.5682 160 L 4.0548 7.8179 120.8647 55.6203 41.2939 178.6658 161 G 3.9360 7.7829 106.7649 44.9921 0.0000 173.6772 162 F 4.5450 7.7440 118.5576 57.0655 40.1088 175.9721 163 T 4.8851 8.9364 111.9109 61.3354 70.6905 173.0806 164 Q 4.9590 8.0846 120.5475 54.4560 33.8027 173.1970 165 L 5.0085 9.1438 125.4700 53.1289 44.8403 174.7929 166 W 5.5071 9.3655 135.0000 54.1383 31.3916 172.0275 167 P 5.0602 0.0000 0.0000 61.4983 32.8761 175.8462 168 T 4.5976 7.7877 112.6667 60.1914 69.6847 172.1684 169 P 4.0578 0.0000 0.0000 63.2091 31.6804 177.1552 170 L 4.4212 7.9679 121.0726 54.1423 42.4752 176.8202 171 V 4.0186 7.3254 119.0964 60.9452 32.1592 175.3236 172 E 3.9295 8.9302 122.7879 57.0288 29.6323 175.9993 173 N 4.9236 9.0049 124.0558 51.5741 39.3959 174.1307 174 D 4.5521 8.7645 128.7064 52.9425 40.7287 176.0263 175 A 4.3797 7.3920 122.1083 51.2455 20.3708 177.9373 176 A 4.0506 8.4995 122.6635 54.4326 18.7803 178.3434 177 A 4.4172 7.1551 115.7428 51.5458 22.3007 174.7670 178 Y 4.0680 7.9781 116.0744 59.3744 35.5548 171.4230 179 S 4.3878 8.9212 114.7497 59.7249 64.0995 175.9157 180 Y 4.3405 8.2307 119.6822 60.2110 37.9394 177.1437 181 H 3.7331 7.0217 114.9677 56.2782 28.7354 176.4925 182 G 3.8692 7.4466 105.8734 46.7048 0.0000 173.3836 183 Y 4.4531 7.8897 115.3445 58.3007 38.0635 175.9098 184 A 4.6957 8.4673 123.6110 49.6640 19.0290 175.7263 185 A 4.3318 7.9753 124.7747 51.9888 19.7914 178.6552 186 T 4.2657 8.4796 110.0278 60.9529 69.6391 173.4379 187 D 4.2862 7.2323 118.3770 54.2498 42.0881 175.4303 188 H 4.5283 8.9598 124.5986 57.9283 29.1373 176.1399 189 Y 4.2832 8.7059 117.1619 57.1212 38.2423 174.6110 190 R 5.3131 8.1267 120.3647 54.8107 33.7247 174.4227 191 I 4.2920 9.6862 128.3304 61.0731 38.0288 175.5929 192 D 4.4237 9.5279 126.8814 54.3064 41.6700 175.8495 193 P 4.4711 0.0000 0.0000 65.4134 31.6755 178.7332 194 R 4.5069 8.1973 116.3812 58.1778 30.2122 177.1792 195 Y 4.6119 9.1191 115.3545 58.3490 39.0043 175.5114 196 G 4.0848 6.3632 104.2190 44.6615 0.0000 173.0762 197 S 4.8705 8.9090 116.9009 56.7530 66.5545 174.5737 198 N 4.8077 8.8873 118.8016 56.8103 38.1935 177.1695 199 E 4.1350 8.5198 120.1389 59.4790 29.6939 178.4471 200 D 4.4381 8.3865 119.0439 57.2598 40.9324 178.5110 201 F 4.3394 8.4285 121.3157 61.3659 39.4064 177.3714 202 V 3.3910 8.0490 117.9657 65.8562 31.2460 177.9242 203 R 3.8904 8.2264 120.2009 58.6184 29.8136 178.0166 204 L 3.8525 8.1107 120.4320 58.2969 41.9329 179.0230 205 S 3.9059 7.6426 112.8310 61.6072 61.9460 176.2684 206 T 3.8308 7.9348 112.5386 64.7615 68.2689 176.4697 207 E 3.9422 8.6454 120.8829 59.0154 29.8974 178.7303 208 A 4.0985 8.2911 121.3031 55.0898 18.4455 179.5492 209 R 3.8272 8.2774 117.5644 59.6105 29.8807 178.8565 210 K 4.1997 7.7055 116.8962 58.9686 32.0053 177.8357 211 R 4.2891 7.5431 115.9167 55.6005 30.1427 175.3848 212 G 3.4638 8.0972 110.1794 45.5620 0.0000 173.3012 *214 G 4.2346 7.4986 110.7514 46.4663 0.0000 168.4779 215 L 5.2259 7.9198 121.2108 53.1027 44.6912 174.9595 216 I 4.8356 8.9691 127.6942 59.7164 39.3362 174.4860 217 Q 4.5312 8.7682 129.2688 55.2028 30.7202 173.8423 218 D 5.1646 8.2914 123.2837 53.6825 42.7706 175.3800 219 V 4.6918 9.1460 119.2398 59.5122 35.7240 174.5799 220 V 4.6999 8.5195 123.4566 61.3895 32.7456 175.0830 221 L 4.5565 8.5689 126.3999 55.6411 43.9005 177.7406 222 S 4.1467 7.8946 112.9486 60.6634 62.6878 172.5442 223 H 5.3452 7.4686 113.4332 54.3763 31.5946 171.8924 224 I 4.7171 8.3347 112.2788 59.1632 40.9730 174.7522 225 G 4.1892 8.9982 109.1712 44.8389 0.0000 175.6406 226 K 4.1350 8.6972 120.9658 59.5662 32.6373 177.5507 227 H 4.7537 8.0464 115.0842 55.6231 28.9921 174.4707 228 H 4.2761 8.1518 121.2225 55.5224 30.0500 176.3878 229 W 4.5528 7.7516 122.6360 59.2741 28.0074 178.4005 230 W 4.2680 7.1065 119.5903 56.3017 27.2836 177.8509 *232 K 4.3027 8.0475 118.1665 56.4502 33.8175 176.3643 233 D 4.7412 8.0503 114.2246 52.9894 43.2106 174.1514 234 L 3.8776 8.0150 120.4571 54.1928 42.6464 175.7901 235 P 3.4242 0.0000 0.0000 64.9041 31.1920 176.3713 236 T 4.6849 6.9651 105.4682 59.3549 71.6549 172.5453 237 P 4.5588 0.0000 0.0000 64.1340 31.4675 176.5655 238 D 4.9553 7.4110 117.1525 52.6493 39.9310 177.3198 239 W 3.9472 8.2612 132.6955 60.1928 31.0316 175.6913 240 I 4.7759 7.4121 109.2215 58.6974 39.6573 174.6752 241 N 4.3986 8.7275 119.6653 53.8583 39.6201 174.7570 242 Y 3.8274 8.2597 116.4927 60.4701 35.0566 172.0840 243 G 3.5736 7.4762 102.0033 49.7083 0.0000 174.9423 244 G 3.5791 7.5352 112.0710 45.5362 0.0000 173.0105 245 K 3.6118 8.0997 122.5218 55.6444 32.8148 176.6399 246 F 3.6526 8.6692 128.9989 58.2282 39.7270 174.2788 247 V 3.6514 6.6695 127.5639 59.8945 33.1340 172.6208 248 P 4.4747 0.0000 0.0000 62.3089 32.3986 175.9177 249 T 4.1306 8.6984 117.1016 61.7555 67.0887 174.2514 250 Q 4.4815 9.8254 126.6445 55.3591 29.0716 175.6325 251 H 4.6965 7.8000 113.2742 57.2804 27.4480 176.7110 252 H 4.6763 7.4808 116.1019 54.0033 25.7242 174.9681 253 R 2.0000 7.5028 124.3351 59.0682 30.2559 177.4113 254 V 3.7904 7.4733 109.7266 62.8916 31.4885 177.8890 255 A 3.9523 7.6373 120.7030 54.8331 18.2641 178.6922 256 V 3.8536 7.0838 107.6764 62.8022 32.4646 176.6231 257 Q 4.6153 7.8882 118.3765 54.3607 28.8180 174.6286 258 D 4.6081 7.6969 116.9164 52.7599 44.7869 173.9485 259 P 4.3481 0.0000 0.0000 65.1824 31.4347 176.6527 260 Y 4.6840 8.3942 113.6813 57.3335 38.2924 175.7853 261 A 4.0616 7.4929 122.8885 52.4330 19.2480 176.9234 262 A 4.6453 8.2700 123.1799 50.5235 20.7341 178.3016 263 Q 4.0076 8.8461 122.9791 59.3334 28.9569 178.8281 264 A 4.0214 8.0419 121.3132 55.2631 18.3160 179.1548 265 D 4.4154 8.2118 117.4031 57.2702 40.9777 178.9461 266 S 4.1526 8.0237 113.2536 61.4722 62.5012 175.8729 267 E 4.0006 8.5413 121.6293 59.5351 29.2372 178.9113 268 N 4.4740 8.2801 117.0635 56.5879 38.7514 176.7325 269 F 4.2583 8.4077 121.9969 61.0074 39.6289 176.4740 270 T 4.6120 7.7475 108.1101 61.4263 69.3176 175.3379 271 K 4.6264 7.7483 119.6849 55.9913 34.3056 177.1385 272 G 3.8999 8.0213 107.0318 45.4006 0.0000 172.9406 273 W 4.7864 8.6644 120.8917 55.0993 30.9349 178.1473 274 F 4.1584 8.7668 119.8599 60.3040 38.4820 176.3192 275 V 4.8490 7.7208 111.8533 59.3875 35.4927 176.0092 276 E 3.8628 8.5675 121.5691 59.3891 29.9494 178.1980 277 G 3.8853 7.6329 108.3555 44.5685 0.0000 171.5893 *279 P 2.0000 0.0000 0.0000 61.1394 33.5913 176.8264 280 D 4.6839 6.0957 123.5128 53.1989 42.4738 175.3488 281 L 3.9579 8.4521 127.0696 54.7298 42.6964 177.3811 282 N 4.3616 8.6282 122.9095 52.3833 37.3914 175.4309 283 Q 3.6723 7.8801 123.2560 57.5701 29.1407 177.6214 284 T 3.9700 7.4186 106.9341 62.6721 69.3861 174.6395 285 N 4.3747 7.8770 122.5905 52.4814 39.5307 173.5688 286 P 4.2341 0.0000 0.0000 65.3798 31.4494 178.6702 287 L 4.0144 7.9142 118.2772 57.4926 41.3968 179.6547 288 V 2.7358 6.8855 117.4286 65.4569 31.4668 177.5109 289 A 4.0529 7.7301 120.5146 55.5681 18.2055 179.3220 290 N 4.3883 8.4316 114.9098 56.5598 38.6333 176.9055 291 Y 4.1448 8.1762 120.8574 60.8811 38.9856 178.3322 292 L 4.1961 8.4211 119.7808 57.8974 41.7952 179.5436 293 I 3.9987 8.1931 119.7009 64.8284 37.0584 178.5941 294 Q 4.3903 8.4645 118.8908 58.9672 28.4755 178.4652 295 N 4.5061 8.2516 119.5398 56.2685 38.9689 176.8019 296 N 4.7578 8.6372 117.9716 56.5387 38.7080 177.4526 297 I 3.9558 8.2912 121.3210 64.1125 37.2308 178.1199 298 W 4.4811 8.9132 129.5051 60.5530 30.5952 178.0502 299 W 4.5914 8.6798 118.7670 60.0451 28.6821 178.5150 300 I 3.6758 8.0304 119.7818 64.3398 36.2681 178.1805 301 E 3.5417 7.7338 118.8596 59.0165 29.3925 177.7839 302 Y 4.4612 8.0028 118.4575 60.4769 38.9854 177.0500 303 A 4.3217 8.4855 118.3663 50.7003 19.5032 176.8497 304 G 3.8149 7.9801 105.0397 46.3490 0.0000 174.4943 305 L 4.2197 7.5786 117.9580 54.6242 42.4438 177.6637 306 S 4.5857 9.2933 115.1430 56.9268 63.5056 173.7430 307 G 4.6984 6.7548 109.8455 46.5260 0.0000 171.4985 308 L 5.4946 8.4042 118.8203 52.7157 45.8315 176.2329 309 R 4.4870 8.8735 122.3503 54.6500 32.6179 174.4941 310 I 4.9316 9.0427 128.5815 59.5859 38.6884 175.0674 311 D 4.8087 9.0766 127.9252 54.4052 42.2186 176.3083 312 T 3.7468 9.5875 112.6315 62.5287 68.1867 172.0870 313 Y 3.8460 8.5494 128.6360 61.8084 39.3814 178.1998 314 G 3.4710 7.7113 106.5545 47.1150 0.0000 173.7325 315 Y 3.3076 7.7608 117.1752 58.9254 38.2401 175.6978 316 S 4.7380 7.2194 115.8239 56.9312 64.3509 174.1282 317 D 4.5452 8.8732 122.4600 54.5286 42.3996 177.6878 318 G 3.8788 8.9528 113.3712 48.2364 0.0000 175.6762 319 A 4.2005 8.2599 123.1433 54.6650 18.4552 179.3131 320 F 4.1473 8.5763 119.2186 61.5252 39.4116 177.4165 321 L 3.8296 8.3570 118.7559 57.7985 41.3609 179.5707 322 T 3.8997 8.1617 115.8023 66.7589 68.4527 176.2623 323 E 3.8966 8.1155 121.1186 59.1990 29.5627 178.1291 324 Y 3.8323 8.0930 120.2146 60.8705 38.6332 178.1618 325 T 3.8884 8.1329 109.6187 64.7156 68.8974 175.8846 326 R 3.6822 7.7824 120.5815 59.1862 30.5134 178.3477 327 R 4.0798 8.2458 118.0016 59.1395 30.0045 179.5334 328 L 4.0882 7.7775 115.4458 55.5049 41.0350 178.7470 *330 A 4.2445 7.9061 123.9403 52.3267 20.4406 178.9780 331 E 3.8442 7.9584 114.0785 58.8992 29.8376 177.0390 332 Y 5.1861 8.0129 116.3828 53.7125 38.2394 174.0657 333 P 4.3307 0.0000 0.0000 64.7139 31.9814 178.3063 334 R 4.4409 7.8087 116.5922 55.6031 30.6809 175.3619 335 L 4.3223 7.7070 120.7002 55.2590 43.0189 175.3387 336 N 4.7970 8.0738 121.8207 51.2724 42.8068 172.7114 *338 V 4.0337 8.1408 117.8001 61.5972 33.0505 174.7117 339 G 3.8767 8.9260 112.7573 44.7774 0.0000 172.5425 340 E 4.7073 9.5359 126.0642 54.8709 30.1567 174.0185 341 E 4.7871 8.7345 128.0318 54.0113 30.9051 175.7383 342 W 3.2467 8.8880 135.0000 56.2398 29.1294 174.4936 343 S 4.7203 7.7020 116.2973 56.7743 65.0586 173.5910 344 T 4.5429 8.5797 115.4954 61.6826 69.1876 174.6861 345 R 4.5080 7.9029 122.9255 54.7048 31.8346 176.8914 346 V 3.5582 8.3426 123.6802 65.8073 31.3002 176.1672 347 P 4.1497 0.0000 0.0000 65.4249 30.9043 178.8116 348 V 3.7003 7.5764 115.8896 65.9460 31.7425 177.8732 349 V 4.0584 7.9510 117.8512 66.0979 31.4784 177.9176 350 A 4.1488 8.4924 120.8326 54.9804 17.8214 179.2754 351 R 3.7612 7.4072 116.4256 59.2602 30.0021 177.9201 352 W 4.8431 7.8325 116.3810 56.8237 30.1399 176.5480 353 Q 4.4540 7.9609 121.6874 55.1031 29.2590 175.3869 354 R 4.8119 8.1647 121.4715 57.3634 29.7759 177.2764 355 G 3.9157 8.8012 109.0194 45.0148 0.0000 173.4704 356 K 3.9111 7.6823 121.3331 56.0718 32.6119 176.2156 357 A 4.3954 8.4613 129.4521 51.1152 18.6797 176.0728 358 N 4.9654 8.2748 119.7504 52.3276 40.2807 177.0244 359 F 4.2800 9.0495 116.4100 59.0617 38.1102 175.6434 360 D 4.1647 7.2696 118.7403 52.4263 39.2840 177.1159 361 G 3.8249 7.9607 107.4719 45.6353 0.0000 173.6593 362 Y 4.0216 7.9470 121.5873 57.7777 39.1591 175.4026 363 T 4.5193 7.0570 115.8160 60.0199 72.1119 172.8379 364 S 4.6014 7.9408 114.6836 58.0462 65.1920 174.1357 365 H 4.5611 8.6662 121.6538 55.2649 29.1336 174.4869 366 L 4.1543 8.0604 123.8969 54.3547 41.6373 176.0178 367 P 4.5920 0.0000 0.0000 65.1349 32.0220 176.2010 368 S 4.7611 7.5015 111.6930 57.0994 66.5680 173.8084 369 L 5.4442 7.4941 124.8382 53.6732 42.4077 178.4880 *371 D 4.6763 8.6016 122.6489 55.0159 41.4940 175.0997 372 F 4.0422 8.0541 122.4181 59.9493 39.4232 175.3066 373 P 4.3860 0.0000 0.0000 65.6651 30.9475 178.4052 374 L 3.9965 7.8920 117.7173 57.8646 42.0794 178.8632 375 V 3.5669 7.2733 117.2959 65.9226 31.6633 176.9091 376 D 4.5435 8.5453 117.8930 57.4531 40.8647 178.5589 377 A 3.9616 7.9045 116.9020 53.4865 18.1368 178.9952 *379 R 4.1844 7.8603 120.3357 57.5475 32.3444 177.6880 380 N 4.2527 8.5627 115.2662 56.2933 38.2850 176.9720 381 A 4.0103 7.8681 120.7703 55.4550 18.5204 179.4259 382 L 4.0817 7.7116 115.4501 57.7022 41.8334 179.5996 383 S 4.2803 8.2276 113.5725 60.9279 65.0265 175.0724 384 K 4.2433 8.4641 124.4720 55.9200 30.1419 177.7109 385 T 3.9125 7.8783 116.8453 66.5987 69.2413 176.5259 386 G 3.7331 8.1106 109.3005 48.3409 0.0000 174.1374 387 E 4.0840 7.7313 118.1953 56.2957 29.8818 176.6713 388 E 4.3104 8.5863 121.8324 57.4082 30.7339 175.7311 389 N 5.1077 7.7208 117.7326 51.3499 39.4012 175.7621 390 G 3.6524 8.3119 106.7112 47.9402 0.0000 174.3551 391 L 3.8818 8.4778 120.6441 56.6448 41.4952 178.8103 392 N 4.2333 8.1294 118.0492 56.5796 38.8293 176.3726 393 E 3.9876 8.0964 120.1328 59.4073 29.4201 179.6078 394 V 3.4783 7.2718 117.6994 65.8302 31.6435 177.2451 395 Y 4.1064 7.4523 119.1349 60.9076 38.4426 178.0152 396 E 3.7483 8.4826 118.2554 59.5810 29.8530 179.2261 397 T 4.0152 7.9320 115.7521 66.6810 68.5611 176.6597 398 L 4.1068 8.2775 121.3848 57.7960 41.4669 179.4812 399 S 4.3754 7.8446 112.5448 60.2525 63.1330 175.3107 400 L 4.2233 7.7271 122.4256 54.8439 41.4894 177.8177 401 D 4.6279 8.2433 121.8093 57.5150 40.9492 178.3013 402 Y 4.3247 7.8904 115.5450 59.0093 38.1460 177.1462 403 L 3.8217 7.1115 120.7343 56.8888 41.8931 176.7976 404 Y 4.6188 7.4666 116.3630 55.8830 39.0165 174.1291 405 P 4.4791 0.0000 0.0000 65.4412 32.3660 176.7153 406 E 4.7180 7.8090 117.2879 53.7043 30.1590 174.0680 407 P 3.8684 0.0000 0.0000 65.3895 32.0816 178.8802 408 Q 4.8542 7.8647 114.7474 56.0674 28.7751 175.5100 409 N 4.6815 7.7827 115.9482 53.1701 39.5161 174.7540 410 L 4.2601 7.4751 117.8040 55.3729 43.2185 176.1043 411 V 4.5266 8.2570 122.2931 61.7340 32.3767 174.9043 412 L 4.5739 8.8553 131.5077 53.7235 43.5867 175.1868 413 F 6.0851 7.2017 119.7607 53.9830 40.4784 175.1755 414 G 3.6687 9.2002 107.6668 48.0283 0.0000 173.3838 415 G 4.1744 7.8591 107.1110 46.4364 0.0000 170.4300 416 N 3.7053 7.8495 115.7227 51.8336 39.2613 174.1723 417 H 4.3443 8.2127 111.3939 56.9453 28.2645 175.3164 418 D 4.8281 8.3612 119.9032 54.3164 41.2799 175.8086 *420 A 4.0453 7.8181 120.3677 51.6267 20.3882 180.5170 421 R 4.4032 8.5306 119.0369 55.7780 30.0182 178.4048 *423 F 4.9764 8.7172 120.4064 59.6251 41.2444 177.9442 424 S 4.0563 8.0932 115.8063 61.2605 62.4491 176.2811 425 A 4.0090 8.8525 123.7030 54.5658 18.1931 178.6273 426 A 4.3203 7.8368 116.7314 52.3509 18.9865 177.7318 427 G 3.6694 7.7743 105.5584 45.5818 0.0000 173.4286 428 E 2.0000 7.4974 115.9839 56.3734 27.6810 175.4151 429 D 4.8203 7.3333 117.6255 52.4047 42.8924 174.5186 430 F 4.4986 9.1369 130.1354 61.8596 39.1901 176.5533 431 D 4.4676 8.4111 117.0802 57.4231 40.7670 178.4900 432 R 4.1311 8.4480 118.0023 58.8958 30.4310 178.4412 433 W 4.3942 8.6229 128.3980 60.2572 30.6012 178.2888 434 R 3.7273 7.9882 116.1159 56.8205 29.2054 177.4551 *436 N 4.7011 8.1189 117.5086 53.0571 40.7706 176.0988 437 L 3.8204 7.5936 118.3000 58.1157 42.1270 178.7872 438 V 3.7631 7.4956 116.9175 65.8224 31.5135 177.3687 439 F 4.7727 8.2311 120.2552 60.6847 39.3701 177.8658 440 L 3.7851 7.8216 116.1265 55.3092 43.2095 177.4985 *442 T 4.1134 7.6731 104.8927 60.4858 69.6443 173.3311 *444 P 4.1413 0.0000 0.0000 62.7523 32.0124 175.8536 445 R 4.8373 7.4361 123.5453 56.1084 35.1662 174.0009 446 I 4.3444 8.5829 122.1667 59.6859 38.4430 173.9615 447 P 5.0186 0.0000 0.0000 62.5632 33.0547 174.9495 448 Q 5.2539 9.8184 124.0681 54.3539 32.5036 173.5844 449 F 5.1576 9.9092 128.5410 56.5406 43.0794 172.9076 450 Y 4.7344 7.7243 126.2301 55.6621 40.2377 174.5595 451 S 4.0881 7.2223 121.0808 59.2346 63.0775 173.2919 452 G 4.3541 10.2664 115.7110 46.4097 0.0000 175.4179 453 D 4.6684 8.5812 119.3418 56.4417 40.6059 177.4772 454 E 5.0229 8.9001 116.4662 57.3203 30.1857 177.1926 455 I 4.3330 7.4102 112.3302 60.0673 38.2437 171.8316 456 L 2.9419 7.3240 125.9007 55.1083 41.7361 174.3943 *458 T 4.3218 8.1610 111.7022 62.0749 69.7650 172.1149 459 S 4.6205 8.4741 115.6606 57.5480 65.8892 174.0768 460 T 4.2838 8.9053 111.6400 61.7142 69.0810 174.3121 461 V 4.3302 8.2855 119.8401 62.6849 33.7824 175.3406 462 K 4.4258 8.1998 120.4624 55.8689 33.6618 176.7268 463 G 4.0184 8.7888 113.1329 44.5747 0.0000 171.4073 464 R 3.8982 8.9143 121.9096 56.8154 28.2035 177.4790 465 D 4.1583 9.3049 110.1713 54.7639 39.6172 171.8773 466 D 4.2775 7.7791 123.5553 57.3584 41.4797 177.9903 467 A 4.0494 8.0472 120.6152 55.7149 17.9696 179.4953 468 S 4.1150 7.6432 109.4576 61.0296 62.4915 174.9929 469 Y 4.9846 7.7496 117.4452 58.3945 38.0024 175.7388 470 R 4.9847 7.8110 118.6856 55.7490 31.6241 175.9441 471 R 4.1669 8.2444 116.1405 56.2031 30.6776 176.3398 472 D 5.0111 8.3304 119.7344 54.5141 41.8256 176.0952 473 F 4.4199 9.5677 125.6603 57.2950 40.8671 172.4787 474 P 4.4202 0.0000 0.0000 65.0339 31.5173 176.5776 475 G 4.2912 9.6926 112.8257 45.6734 0.0000 174.4993 476 G 3.9060 8.7669 108.2820 46.0748 0.0000 173.4341 477 W 4.8013 8.9852 119.6107 54.0174 31.9680 175.2821 478 A 3.9198 8.7539 124.7596 54.0403 18.1178 177.6241 479 G 3.8040 8.7624 112.0020 46.7569 0.0000 173.2602 480 D 4.6978 8.0243 118.0659 52.7258 41.5671 176.7917 481 K 3.8678 8.0690 122.8557 59.3754 32.6814 176.7023 482 A 4.2095 7.5657 122.9629 52.0238 19.4488 176.8036 483 N 4.8553 9.6149 121.8897 51.2061 39.8617 174.6242 484 A 3.8979 8.4982 129.7580 54.6504 18.6302 179.0341 485 F 4.0979 7.9429 114.3428 59.4096 39.0219 176.2941 486 S 4.6524 8.3417 112.1987 57.3772 64.4880 174.0025 487 G 4.0004 8.6408 110.0692 45.3319 0.0000 173.2642 488 A 3.9658 7.4116 122.7038 54.2485 18.3258 178.3056 489 G 3.9541 8.9561 111.0534 45.4135 0.0000 172.9819 490 L 4.2846 7.8387 120.9215 54.0019 42.4341 177.7195 491 T 4.1000 8.5284 114.3448 61.4660 70.7993 175.8136 492 S 4.0414 8.3758 117.0733 61.6107 62.6878 176.7360 493 Q 3.5460 7.7934 121.7789 59.1173 28.8246 178.1453 494 Q 3.7652 7.5799 119.1355 59.0414 28.7168 179.1069 495 R 3.9169 7.9305 118.8422 59.0063 29.9634 179.0195 496 A 3.9821 7.9939 120.4596 54.9652 18.2989 179.3354 497 A 4.3163 8.1902 119.5670 55.7273 18.4351 179.7007 498 Q 4.2311 8.2269 119.2556 59.0256 29.0641 178.1798 499 D 4.4271 8.6742 120.4758 57.0576 40.7867 178.5858 500 L 3.9822 8.5161 121.3802 58.0552 42.1796 178.8773 501 V 3.5658 8.3171 118.6368 66.1282 31.4464 177.7620 502 R 4.3268 8.0337 119.4194 58.8998 30.0709 178.3208 503 K 4.0259 8.2635 119.4241 59.4953 32.2022 178.5029 504 L 4.2597 8.7600 120.7868 58.0104 41.9951 178.7423 505 A 3.9361 8.4308 121.3046 55.0781 18.0844 179.4146 506 N 4.3197 8.0452 114.1840 55.8359 38.7608 177.3176 507 W 4.2178 8.2621 129.8031 60.4385 30.7774 177.8565 508 R 3.2908 8.1559 118.6686 59.4538 29.1884 178.4919 509 K 3.9475 7.6320 116.5918 58.7035 31.9634 177.9305 510 N 4.8042 7.6184 114.7586 52.1578 40.2731 175.7678 511 Q 4.2061 7.3706 122.1802 52.4928 28.3743 174.1767 512 P 3.9795 0.0000 0.0000 65.7296 31.3376 178.8494 513 V 3.4956 7.5445 118.2923 64.7665 30.9261 178.2234 514 I 3.7976 7.5580 120.0104 64.0117 37.0087 177.8242 515 H 4.4048 7.7874 116.0806 58.3133 28.8690 175.9008 516 N 4.8531 8.1780 113.8827 52.4735 40.2471 174.7491 517 G 3.7885 7.6787 105.8253 45.7527 0.0000 173.5935 518 R 4.2643 8.2039 119.7356 55.5256 31.8515 175.1578 519 L 5.9120 7.9881 121.1390 52.6974 45.6633 174.4423 *521 H 5.0081 8.5857 114.2313 55.7599 29.6562 172.5266 522 F 4.9993 9.1431 117.6008 55.1961 41.8480 175.8668 523 G 2.7721 8.8846 109.6933 45.4583 0.0000 171.6755 524 P 4.8275 0.0000 0.0000 62.8512 32.1964 175.6118 525 E 4.5942 8.4222 118.8757 55.9999 32.9640 175.7605 526 E 3.9663 9.6564 122.2175 57.7241 27.3407 174.2194 527 N 4.2475 8.4110 111.1483 54.4934 37.1900 173.9266 528 T 5.0542 7.8312 107.5078 59.9581 72.1577 172.9425 529 W 5.7175 8.4793 132.0447 56.1986 34.6846 173.3638 530 V 4.5677 8.4827 125.9112 61.2101 33.9185 173.5074 531 Y 5.3764 7.6260 123.6331 56.0207 42.0270 173.3717 532 F 5.1846 9.2408 117.6357 55.8940 43.5857 174.0006 533 R 5.3912 9.1065 121.5809 54.7773 32.3363 174.8467 534 Y 5.5449 8.5541 121.1178 56.2268 42.2868 173.4232 535 N 5.4277 9.1933 117.7397 51.7806 41.0956 175.1802 536 K 4.0839 8.9191 116.9303 59.5627 32.6198 178.2906 537 D 4.5285 7.9942 118.4855 55.6350 41.5548 176.0288 538 K 4.4962 7.5155 117.2781 55.8690 36.4514 173.8655 539 R 5.3010 8.9333 123.4837 54.7632 34.1127 174.9109 540 I 5.3155 8.8077 122.0371 58.4658 42.3233 173.8994 *542 V 3.9372 8.1601 120.5505 63.0904 32.4986 174.4805 543 A 5.3261 8.0762 127.8245 48.7915 23.4844 174.2339 *545 N 4.5853 8.5156 116.0871 53.0331 39.9585 174.1758 546 N 4.9371 8.6758 131.4616 53.1539 37.4326 174.0332 547 N 5.1845 8.1439 114.8947 51.3223 44.0907 175.9872 548 D 4.9918 8.6389 119.4939 53.0421 40.0445 176.2315 549 K 4.6633 7.6134 116.9348 54.8889 35.6280 174.8847 550 P 4.8417 0.0000 0.0000 62.2754 32.5435 174.9604 *552 T 4.3149 8.2523 115.7821 64.1598 69.4412 173.7264 553 L 4.6697 9.0844 127.3134 52.0968 44.1740 174.5880 554 P 4.5344 0.0000 0.0000 63.2454 31.5161 177.3124 555 T 4.3138 8.3934 112.5575 62.6763 69.0014 176.5078 556 A 3.9089 7.6983 124.8585 55.4220 18.2779 179.2830 557 R 3.6616 6.8872 115.2944 58.9644 28.7833 177.6833 558 F 4.6899 6.8302 115.4835 57.5050 39.2411 177.8114 559 Q 4.2769 7.9588 121.2740 58.6067 28.1677 177.7512 560 E 3.8859 7.3273 118.4234 58.0436 30.0392 177.1773 *562 L 4.2452 7.9144 117.7336 54.5316 43.9984 177.0775 563 K 3.7987 8.8242 115.5221 57.7113 29.7587 174.7910 564 G 3.8944 9.2642 98.5224 46.2845 0.0000 173.1030 565 A 4.1445 7.6553 123.2432 50.9057 19.1395 177.0013 566 P 4.3499 0.0000 0.0000 65.3732 31.6718 175.9397 567 S 5.0676 7.4917 110.0276 58.5220 65.5691 174.9390 568 G 4.2560 8.2707 104.9541 45.6933 0.0000 172.8054 569 V 4.7281 8.0593 120.6324 60.0727 33.7755 174.6156 570 D 4.6634 9.0366 125.8871 53.9312 41.2782 176.6989 571 F 4.2747 9.1566 130.1839 61.1471 39.1486 175.9778 572 L 3.6702 7.4932 120.1938 57.1554 41.7733 178.1237 573 S 4.1541 8.3417 114.9411 59.0243 63.7077 175.7653 574 G 3.9021 8.4792 109.3768 44.9744 0.0000 173.8340 575 K 4.2937 7.3954 119.4867 56.3733 33.4554 176.5691 576 T 4.5818 8.3683 119.6250 63.3923 69.6955 174.2001 577 V 4.3567 8.8867 125.7336 60.7051 34.3785 174.8673 578 G 3.9717 8.8151 115.6156 46.0431 0.0000 173.0063 579 L 4.7996 8.6229 124.3735 54.6807 42.9857 178.6028 580 G 3.7152 8.5691 108.9180 48.1783 0.0000 175.2490 581 R 4.7533 7.8239 113.2580 53.4436 31.9385 173.5342 582 E 5.1268 7.9799 115.1385 55.5952 32.2570 174.3180 583 L 4.5715 9.6948 126.3121 53.7715 44.0291 175.0080 584 R 4.7770 8.6218 125.4399 54.6307 31.6234 175.3508 585 L 4.8060 8.3161 123.8565 52.4621 44.3689 176.3761 586 A 4.2840 8.6300 125.1873 51.0366 19.3105 175.2858 587 P 4.4297 0.0000 0.0000 62.9870 32.2237 176.5245 588 K 4.0418 9.1140 120.4430 56.8193 30.1743 173.7470 589 S 5.0766 7.7321 110.8828 56.6159 66.8281 174.3394 590 V 4.7089 8.0900 118.1983 60.4749 34.0197 174.4382 591 V 4.5204 8.9024 117.3308 59.5614 35.5556 175.1104 592 V 4.3731 8.8482 123.0022 61.2128 33.4732 173.3830 593 I 4.9835 7.8187 127.9982 59.0680 38.9849 174.4996 594 E 4.7588 8.8297 127.1207 55.5315 30.4448 175.7648 595 L 5.0743 8.9713 124.5168 51.7555 45.9387 174.4711 596 P 4.6931 0.0000 0.0000 62.6591 32.1713 176.0532 597 G 4.1613 8.4008 107.3687 45.3869 0.0000 173.5960 598 L 4.3055 8.5978 122.8335 53.7101 42.8265 175.2835 599 P 4.0141 0.0000 0.0000 63.8254 31.4753 177.3446 *600 E 4.1515 8.7106 118.5042 56.1066 30.3334 171.9742 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 3 P 0.00 4.34 0.00 1.94 1.99 0.00 3.59 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 2.02 0.00 4 T 7.98 3.72 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 1.16 0.00 0.00 5 A 9.45 3.87 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 I 7.00 4.33 1.92 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.67 0.81 0.00 0.00 7 E 8.68 3.91 0.00 1.70 1.67 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 2.13 2.22 0.00 8 H 7.24 4.45 0.00 2.96 3.07 0.00 5.65 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *10 E 8.53 3.79 0.00 2.22 1.77 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 1.47 2.12 0.00 11 P 0.00 3.22 0.00 2.54 2.23 0.00 3.54 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 2.00 1.73 0.00 12 P 0.00 4.35 0.00 1.69 1.98 0.00 2.37 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 1.33 0.00 13 F 6.55 3.84 0.00 2.83 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 W 8.60 5.18 0.00 3.73 3.26 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 15 W 8.32 5.50 0.00 3.07 2.91 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 16 A 9.10 4.26 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 17 G 8.83 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *19 Q 8.45 4.24 0.00 1.95 2.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.90 0.00 0.00 0.00 0.00 0.00 2.38 2.42 0.00 20 H 9.07 4.57 0.00 3.17 3.41 0.00 6.00 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 K 8.66 4.39 0.00 1.76 1.94 0.00 1.73 0.00 0.00 1.85 0.00 0.00 2.94 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.79 1.52 7.81 22 G 7.93 4.11 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 0.00 0.00 0.00 23 L 9.03 4.57 0.00 1.38 1.31 -0.26 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 24 Q 9.72 4.66 0.00 2.09 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.85 6.57 0.00 0.00 0.00 0.00 0.00 2.53 2.58 0.00 25 L 8.73 4.73 0.00 1.51 1.45 0.42 0.34 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 *27 V 8.21 4.10 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 0.63 0.00 0.00 0.88 0.00 0.00 28 H 8.82 4.97 0.00 3.30 3.05 0.00 5.69 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 29 G 8.03 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 0.00 0.00 0.00 0.00 30 R 8.59 4.23 0.00 1.67 1.78 0.00 3.34 0.00 0.00 3.18 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.59 0.00 31 D 9.69 4.51 0.00 2.86 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 I 7.64 3.56 1.65 0.00 0.00 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 0.57 0.10 0.74 0.00 0.00 33 G 8.28 3.75 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 0.00 34 R 7.41 4.22 0.00 1.89 1.92 0.00 3.27 0.00 0.00 3.14 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.65 0.00 *36 E 7.68 4.24 0.00 2.12 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 2.30 2.36 0.00 37 A 8.62 5.14 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 38 A 8.27 4.67 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 39 L 8.00 4.69 0.00 1.62 1.73 0.64 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 40 D 8.54 4.49 0.00 2.59 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 41 Y 8.03 4.68 0.00 2.71 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 0.00 0.00 0.00 42 P 0.00 4.30 0.00 1.74 1.82 0.00 2.60 0.00 0.00 3.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.90 0.00 43 G 9.03 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 44 V 7.42 4.83 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.63 0.00 0.00 1.08 0.00 0.00 45 R 8.63 4.55 0.00 1.85 1.69 0.00 3.13 0.00 0.00 3.08 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.53 0.00 46 L 8.59 4.30 0.00 1.66 1.56 1.01 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 47 V 8.96 4.02 2.20 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 0.83 0.00 0.00 0.96 0.00 0.00 48 S 7.39 4.80 0.00 3.90 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 49 T 8.59 5.22 4.33 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 1.27 0.00 0.00 50 T 9.52 4.78 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 1.19 0.00 0.00 51 R 8.77 5.16 0.00 1.70 1.86 0.00 3.18 0.00 0.00 3.36 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.69 0.00 52 V 8.25 4.56 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 0.77 0.00 0.00 1.10 0.00 0.00 53 P 0.00 4.22 0.00 2.05 2.14 0.00 3.69 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.10 0.00 54 N 8.13 4.48 0.00 2.78 2.98 0.00 0.00 7.11 8.43 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 55 A 8.58 4.26 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 56 N 9.09 4.80 0.00 2.58 2.46 0.00 0.00 6.65 7.03 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 57 Y 8.00 5.13 0.00 2.81 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 58 L 8.74 4.80 0.00 1.44 1.31 1.04 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 59 F 9.29 4.92 0.00 3.25 3.03 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 60 V 9.12 4.53 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 0.99 0.00 0.00 1.09 0.00 0.00 61 D 9.29 5.18 0.00 2.82 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 62 L 9.38 5.18 0.00 1.47 1.52 0.86 -0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 63 E 9.12 4.87 0.00 2.05 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.32 0.00 64 I 8.85 4.61 2.19 0.00 0.00 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 1.37 0.85 1.16 0.00 0.00 65 G 9.09 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 0.00 0.00 0.00 0.00 66 P 0.00 4.50 0.00 2.08 2.17 0.00 3.70 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.11 0.00 67 E 8.14 4.21 0.00 2.11 2.20 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 2.33 2.24 0.00 68 A 7.91 4.35 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 69 Q 8.43 4.76 0.00 2.13 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.94 0.00 0.00 0.00 0.00 0.00 2.33 2.37 0.00 70 P 0.00 4.71 0.00 2.11 2.10 0.00 3.86 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 2.10 2.19 0.00 71 G 7.48 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 72 S 7.97 4.85 0.00 3.73 3.65 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 73 F 8.13 5.05 0.00 3.12 2.99 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 74 D 8.97 4.98 0.00 2.65 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 75 I 9.23 4.48 1.86 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.11 0.33 0.00 0.00 76 V 8.71 4.68 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 0.71 0.00 0.00 0.87 0.00 0.00 77 F 9.29 5.34 0.00 2.99 2.91 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 78 K 8.66 5.03 0.00 1.61 1.72 0.00 1.75 0.00 0.00 1.72 0.00 0.00 2.96 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.38 1.37 7.81 79 G 9.36 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 D 9.95 4.31 0.00 2.75 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 81 G 8.25 4.29 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 0.00 82 R 7.25 4.14 0.00 1.96 2.08 0.00 2.73 0.00 0.00 3.08 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.57 0.00 83 S 8.29 5.17 0.00 3.87 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 E 9.88 4.99 0.00 2.08 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 0.00 2.24 2.35 0.00 85 R 8.43 5.19 0.00 1.80 1.77 0.00 3.19 0.00 0.00 3.25 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.64 0.00 86 Y 8.95 4.60 0.00 3.24 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 87 R 8.18 4.40 0.00 1.61 1.56 0.00 3.28 0.00 0.00 3.03 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.44 0.00 88 Y 8.85 4.35 0.00 3.00 1.82 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 89 R 7.70 4.64 0.00 1.49 1.54 0.00 2.82 0.00 0.00 3.14 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.40 0.00 90 L 8.87 5.09 0.00 1.64 1.71 1.33 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 91 L 8.60 4.71 0.00 0.96 1.58 0.49 -0.09 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 92 A 8.44 4.65 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 93 R 8.59 4.31 0.00 1.84 1.81 0.00 3.39 0.00 0.00 3.13 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.88 0.00 94 E 8.46 4.02 0.00 1.99 1.78 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 2.34 2.35 0.00 95 Q 8.48 4.12 0.00 2.05 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.98 0.00 0.00 0.00 0.00 0.00 2.34 2.36 0.00 96 G 8.94 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 97 S 8.11 4.02 0.00 3.89 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 A 8.04 4.03 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 99 Q 7.63 4.60 0.00 2.06 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.65 0.00 0.00 0.00 0.00 0.00 2.33 2.42 0.00 100 R 7.53 3.83 0.00 1.88 2.03 0.00 2.56 0.00 0.00 3.12 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.54 0.00 101 Q 8.56 4.16 0.00 2.04 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 7.06 0.00 0.00 0.00 0.00 0.00 2.30 2.39 0.00 102 G 8.78 4.47 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 0.00 103 F 8.60 4.66 0.00 2.99 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 0.00 104 G 9.36 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 0.00 0.00 0.00 0.00 105 P 0.00 4.18 0.00 2.06 2.16 0.00 3.63 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.06 0.00 106 G 7.84 3.21 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 183 Y 7.89 4.45 0.00 2.98 2.99 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 0.00 184 A 8.47 4.70 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 0.00 185 A 7.98 4.33 1.14 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 0.00 186 T 8.48 4.27 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 1.29 0.00 0.00 187 D 7.23 4.29 0.00 2.71 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 0.00 188 H 8.96 4.53 0.00 3.36 3.51 0.00 5.72 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 189 Y 8.71 4.28 0.00 2.88 2.45 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 0.00 190 R 8.13 5.31 0.00 2.08 1.85 0.00 3.17 0.00 0.00 3.25 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.74 0.00 191 I 9.69 4.29 2.06 0.00 0.00 0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.26 1.16 0.00 0.00 192 D 9.53 4.42 0.00 2.82 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 0.00 193 P 0.00 4.47 0.00 2.21 2.12 0.00 3.63 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.14 0.00 194 R 8.20 4.51 0.00 1.58 1.58 0.00 3.09 0.00 0.00 3.00 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.81 0.00 195 Y 9.12 4.61 0.00 3.17 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 0.00 196 G 6.36 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 0.00 197 S 8.91 4.87 0.00 4.16 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 0.00 198 N 8.89 4.81 0.00 3.22 3.61 0.00 0.00 6.43 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 0.00 199 E 8.52 4.13 0.00 2.23 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 2.46 2.54 0.00 200 D 8.39 4.44 0.00 3.16 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 0.00 201 F 8.43 4.34 0.00 3.20 3.45 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 0.00 202 V 8.05 3.39 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 0.74 0.00 0.00 0.35 0.00 0.00 203 R 8.23 3.89 0.00 2.05 2.09 0.00 3.22 0.00 0.00 3.20 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.49 0.00 204 L 8.11 3.85 0.00 1.76 1.72 0.90 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 205 S 7.64 3.91 0.00 3.64 3.76 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 0.00 0.00 0.00 206 T 7.93 3.83 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 1.16 0.00 0.00 207 E 8.65 3.94 0.00 1.95 2.03 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 2.45 2.45 0.00 208 A 8.29 4.10 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 209 R 8.28 3.83 0.00 1.98 2.07 0.00 3.11 0.00 0.00 3.13 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.69 0.00 210 K 7.71 4.20 0.00 1.91 1.85 0.00 1.82 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.46 1.70 7.81 211 R 7.54 4.29 0.00 1.98 1.94 0.00 3.30 0.00 0.00 3.38 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.61 0.00 212 G 8.10 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *214 G 7.50 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 0.00 0.00 0.00 0.00 215 L 7.92 5.23 0.00 1.52 1.36 0.91 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 216 I 8.97 4.84 1.83 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.71 0.68 0.00 0.00 217 Q 8.77 4.53 0.00 2.30 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.92 0.00 0.00 0.00 0.00 0.00 2.25 2.26 0.00 218 D 8.29 5.16 0.00 3.38 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 219 V 9.15 4.69 2.20 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 0.89 0.00 0.00 1.13 0.00 0.00 220 V 8.52 4.70 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 1.15 0.00 0.00 221 L 8.57 4.56 0.00 1.57 1.62 0.27 0.89 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 0.00 222 S 7.89 4.15 0.00 3.84 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 0.00 223 H 7.47 5.35 0.00 3.17 3.15 0.00 5.52 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 224 I 8.33 4.72 2.00 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 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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 1.01 0.00 0.00 276 E 8.57 3.86 0.00 1.67 1.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.47 0.00 277 G 7.63 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 0.00 0.00 0.00 *279 P 0.00 2.00 0.00 1.77 1.42 0.00 3.46 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.90 0.00 280 D 6.10 4.68 0.00 2.31 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 281 L 8.45 3.96 0.00 1.39 1.21 0.95 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 282 N 8.63 4.36 0.00 2.56 2.62 0.00 0.00 7.06 7.11 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 0.00 283 Q 7.88 3.67 0.00 1.76 1.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.83 0.00 0.00 0.00 0.00 0.00 1.16 1.71 0.00 284 T 7.42 3.97 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 2.75 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.59 0.50 0.00 310 I 9.04 4.93 2.12 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.68 1.03 0.00 0.00 311 D 9.08 4.81 0.00 3.10 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 312 T 9.59 3.75 4.51 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 0.99 0.00 0.00 313 Y 8.55 3.85 0.00 3.10 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 0.00 314 G 7.71 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 0.00 315 Y 7.76 3.31 0.00 3.11 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 0.00 316 S 7.22 4.74 0.00 3.82 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 0.00 317 D 8.87 4.55 0.00 2.68 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 468 S 7.64 4.12 0.00 4.07 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 469 Y 7.75 4.98 0.00 3.15 3.03 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 0.00 470 R 7.81 4.98 0.00 1.97 2.16 0.00 3.54 0.00 0.00 3.64 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.99 0.00 471 R 8.24 4.17 0.00 1.85 1.88 0.00 3.37 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 1.70 1.64 0.00 472 D 8.33 5.01 0.00 2.35 2.45 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 0.00 473 F 9.57 4.42 0.00 3.42 3.26 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 0.00 474 P 0.00 4.42 0.00 1.99 2.01 0.00 2.74 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 1.57 0.00 475 G 9.69 4.29 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 0.00 476 G 8.77 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 485 F 7.94 4.10 0.00 3.12 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 0.00 486 S 8.34 4.65 0.00 3.98 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 487 G 8.64 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 488 A 7.41 3.97 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 0.00 489 G 8.96 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 0.00 0.00 0.00 490 L 7.84 4.28 0.00 1.75 1.55 0.85 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 491 T 8.53 4.10 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 1.18 0.00 0.00 492 S 8.38 4.04 0.00 3.80 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.39 1.45 7.81 564 G 9.26 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 0.00 0.00 0.00 565 A 7.66 4.14 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 0.00 566 P 0.00 4.35 0.00 2.24 2.33 0.00 3.75 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 1.96 0.00 567 S 7.49 5.07 0.00 3.99 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 0.00 568 G 8.27 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 0.00 569 V 8.06 4.73 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 0.84 0.00 0.00 1.00 0.00 0.00 570 D 9.04 4.66 0.00 2.77 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 0.00 571 F 9.16 4.27 0.00 2.83 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 0.00 572 L 7.49 3.67 0.00 1.87 1.52 0.91 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 573 S 8.34 4.15 0.00 3.97 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 0.00 574 G 8.48 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 575 K 7.40 4.29 0.00 1.68 1.72 0.00 1.64 0.00 0.00 1.63 0.00 0.00 2.85 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.43 1.39 7.81 576 T 8.37 4.58 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 1.21 0.00 0.00 577 V 8.89 4.36 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 0.94 0.00 0.00 0.90 0.00 0.00 578 G 8.82 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 0.00 579 L 8.62 4.80 0.00 1.68 1.67 0.93 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 580 G 8.57 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 581 R 7.82 4.75 0.00 1.83 2.09 0.00 3.17 0.00 0.00 3.35 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.44 0.00 582 E 7.98 5.13 0.00 1.95 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 2.15 2.27 0.00 583 L 9.69 4.57 0.00 1.67 1.70 0.89 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 584 R 8.62 4.78 0.00 1.72 1.85 0.00 3.22 0.00 0.00 3.36 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.63 0.00 585 L 8.32 4.81 0.00 1.57 1.54 0.90 0.83 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 0.00 586 A 8.63 4.28 1.23 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 0.00 587 P 0.00 4.43 0.00 1.97 2.10 0.00 3.84 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 2.05 2.13 0.00 588 K 9.11 4.04 0.00 1.83 1.87 0.00 1.66 0.00 0.00 1.78 0.00 0.00 3.06 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.43 1.43 7.81 589 S 7.73 5.08 0.00 3.83 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 0.00 590 V 8.09 4.71 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 0.68 0.00 0.00 0.88 0.00 0.00 591 V 8.90 4.52 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 0.72 0.00 0.00 0.88 0.00 0.00 592 V 8.85 4.37 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.81 0.00 0.00 593 I 7.82 4.98 1.80 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 1.32 1.69 0.90 0.00 0.00 594 E 8.83 4.76 0.00 1.94 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 2.49 2.44 0.00 595 L 8.97 5.07 0.00 1.61 1.56 1.06 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 596 P 0.00 4.69 0.00 2.09 2.09 0.00 3.80 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 2.01 2.00 0.00 597 G 8.40 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 0.00 598 L 8.60 4.31 0.00 1.56 1.62 0.70 0.96 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 0.00 599 P 0.00 4.01 0.00 2.04 2.03 0.00 3.70 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.08 0.00 *600 E 8.71 4.15 0.00 1.73 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 2.13 2.37 0.00 * Residues marked with a * may have inaccurate shift predictions.