NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 C 4.7912 8.2033 118.3478 59.6986 30.5662 171.9312 2 L 4.8943 8.6014 121.8571 52.2713 44.0606 174.9115 3 A 4.7091 9.1164 125.4046 51.7150 20.2795 176.1442 4 E 4.3350 8.6525 121.1813 58.0104 29.8606 177.5550 5 G 4.0066 10.0397 115.6757 45.2267 0.0000 173.8432 6 T 4.1867 7.8146 117.5298 64.0093 69.5719 173.6010 7 R 4.8976 10.0678 127.0621 55.3398 32.2054 175.4885 8 I 5.0128 9.1714 124.7141 59.4147 40.1473 174.4370 9 F 4.7920 8.4216 129.5612 57.7477 40.4124 174.2141 10 D 5.0764 8.6617 126.9851 51.1796 41.5236 175.2925 11 P 4.2674 0.0000 0.0000 65.1561 31.8911 178.2063 12 V 3.6718 8.1737 119.4034 65.7149 31.4913 177.0088 13 T 4.0770 7.9555 107.3281 61.6848 69.4230 175.7711 14 G 3.8620 8.3337 109.6541 45.5757 0.0000 173.0634 15 T 4.4649 7.5052 116.6768 62.6749 70.4296 173.8152 16 T 5.0830 8.4200 121.5645 62.3992 70.3355 173.6079 17 H 5.0310 9.4064 123.7051 53.9460 32.4333 173.9177 18 R 4.6166 8.3287 119.8880 55.2872 31.2663 177.6637 19 I 3.6483 8.6134 123.1082 64.1846 37.8820 177.9945 20 E 2.6796 7.5880 117.5589 58.4439 29.4409 178.4867 21 D 4.3390 7.8879 120.1745 56.6977 40.9863 178.7502 22 V 3.5571 7.5657 118.4387 65.8210 31.5702 178.1989 23 V 3.8064 7.8262 118.0736 66.1006 31.3483 178.2975 24 G 3.8205 7.9842 104.0737 46.8889 0.0000 174.7036 25 G 3.7901 7.7663 104.5655 42.9749 0.0000 173.3496 26 R 2.0000 7.0777 118.7894 56.1203 28.0190 177.1152 27 K 4.0576 7.7398 116.6172 55.6221 33.4242 177.2322 28 P 5.1087 0.0000 0.0000 62.3146 29.3680 175.3889 29 I 4.1255 7.6174 115.0203 61.9499 40.1192 176.0546 30 H 5.2382 9.1905 119.2334 54.4249 31.8406 174.1883 31 V 5.0242 8.6193 112.8817 59.7862 36.9097 174.5410 32 V 4.5329 8.3752 121.0408 61.9911 32.7342 174.3417 33 A 5.3544 9.6649 130.5286 50.1251 22.1495 174.4841 34 A 5.1370 8.7753 122.1582 50.4670 20.9126 177.7369 35 A 4.4617 8.7280 127.3247 51.7875 20.8524 176.7160 36 K 4.2796 8.7861 114.1901 59.8392 32.6586 180.6545 37 D 4.5278 8.1329 112.8652 53.9094 38.5343 176.4828 38 G 3.9556 8.6633 106.6727 46.9216 0.0000 173.8506 39 T 4.6495 7.6497 109.0651 59.7724 71.5267 173.1778 40 L 5.1685 8.2458 122.8080 54.0945 43.4999 175.5242 41 H 5.0610 9.5743 118.5014 54.2405 33.9274 172.0690 42 A 5.0520 8.5843 122.2986 51.4002 19.7774 177.1606 43 R 4.8082 8.7497 121.0076 53.6858 34.8806 173.1665 44 P 4.6417 0.0000 0.0000 62.3667 33.3331 175.0341 45 V 4.2237 8.3903 122.6897 62.5928 31.5134 176.0003 46 V 3.9978 8.2922 120.6842 61.4166 33.5382 176.0015 47 S 3.8743 6.6887 114.9255 56.1245 67.5882 172.8879 48 W 5.1106 8.1061 120.6337 54.9360 32.6074 174.7265 49 F 5.0024 9.3372 122.6909 55.7493 42.1781 173.4900 50 D 4.9315 9.0662 123.9663 53.3812 41.4347 175.5849 51 Q 4.2047 8.9343 125.4622 55.4918 29.6621 177.7036 52 G 3.7685 8.1543 110.6104 44.7438 0.0000 172.3278 53 T 4.7759 8.1160 114.9491 63.2239 69.6561 174.8160 54 R 4.6517 8.5788 123.4703 55.0574 35.8237 173.5610 55 D 5.0597 8.6501 120.0516 54.4162 42.1816 176.2051 56 V 4.8565 8.7970 116.8506 59.5590 35.1037 175.2589 57 I 4.7513 9.2824 119.2271 59.7021 40.4490 174.4920 58 G 3.0403 8.1302 110.1386 43.8966 0.0000 172.2773 59 L 4.7846 8.2818 125.2180 52.7832 44.0589 175.5136 60 R 4.6045 8.8148 126.5401 55.4760 31.2380 175.4095 61 I 4.8876 8.8426 127.2975 59.0773 40.1537 175.0223 62 A 4.0208 8.3490 126.7038 53.9113 17.9911 177.8502 63 G 3.9314 9.4715 110.3884 44.6251 0.0000 173.7801 64 G 4.0774 8.3921 107.9626 45.7019 0.0000 174.5830 65 A 4.1392 8.0997 120.6796 52.5841 19.6061 176.8125 66 I 4.7627 8.1272 120.6208 59.4216 40.5631 174.5645 67 L 4.4007 8.5016 130.1102 53.6808 43.8074 175.1822 68 W 5.2648 8.8903 125.8034 55.1887 31.4212 174.5037 69 A 5.3926 8.8358 126.1681 50.0255 23.1294 174.8854 70 T 4.7757 9.0179 109.5535 60.3441 69.7715 174.3793 71 P 4.4493 0.0000 0.0000 65.2875 31.2441 177.0794 72 D 4.6516 7.9125 116.5239 53.7662 40.4468 175.9383 73 H 4.2962 8.4620 122.8215 56.2790 31.0455 174.3342 74 K 4.9098 8.5634 125.3058 56.3025 33.5909 175.9515 75 V 4.8504 9.0588 124.4885 60.8338 35.1481 174.0830 76 L 3.5173 8.0283 129.8876 54.6674 43.0719 175.7366 77 T 5.1758 8.2931 116.2577 59.3734 72.2391 174.5252 78 E 3.4548 8.6244 118.8460 58.4369 29.3018 177.2408 79 Y 4.7872 7.5768 116.9904 57.5673 38.8281 176.5304 80 G 3.7613 7.9718 109.1722 43.8968 0.0000 172.3458 81 W 4.8518 8.5815 119.1796 56.6196 29.4628 176.4357 82 R 4.9422 9.0007 123.1935 53.8119 34.2241 174.9388 83 A 4.5648 8.5844 122.6704 51.8412 19.1985 178.6453 84 A 3.9502 9.4597 125.3907 55.3386 18.6145 180.0850 85 G 3.8127 8.3641 103.4880 47.4398 0.0000 174.1389 86 E 4.3548 8.0024 118.4518 57.0182 30.2514 176.7756 87 L 4.4227 7.4436 119.0720 54.5562 42.4822 176.3252 88 R 4.7023 9.4160 120.4900 53.4845 34.0846 174.7923 89 K 4.1423 8.5349 120.2091 58.2795 32.3524 175.5333 90 G 4.1930 8.7451 114.7121 46.0000 0.0000 174.1642 91 D 4.7262 8.2723 119.0836 54.3787 42.3862 175.7810 92 R 5.0791 8.6048 120.4647 54.7378 32.5948 175.8875 93 V 4.8290 8.8569 116.8381 59.3932 34.9718 174.8714 94 A 3.5672 8.4758 125.5233 51.5638 19.4828 177.2132 95 V 4.7116 8.4849 115.3368 59.3897 36.3511 174.5775 96 R 4.7395 8.5045 124.2534 54.8531 31.0924 175.5485 97 D 4.4971 9.1397 127.9482 54.0799 41.5771 177.6061 98 V 3.4380 8.5738 125.8269 64.0752 31.8954 177.0796 99 E 4.2411 8.2715 119.4307 58.5732 29.9926 177.3665 100 T 4.0522 8.8991 107.0778 61.6317 69.4212 175.9781 101 G 3.8498 8.2554 109.6295 45.7642 0.0000 173.2682 102 E 4.3008 7.6838 119.4542 55.2522 31.4634 175.2276 *404 L 4.5409 8.2367 122.9781 55.5407 43.4689 175.7509 405 R 4.6920 8.1426 119.8953 55.9130 33.2272 172.6449 406 Y 5.0218 8.5443 115.3696 56.4421 41.3406 175.6406 407 S 4.8209 9.0833 118.6804 56.4783 67.2759 173.5525 408 V 4.2206 8.2048 122.8535 62.7046 33.0238 175.0058 409 I 4.1818 8.7997 129.5345 61.5503 37.2814 177.0780 410 R 4.1228 9.2988 127.5826 58.6836 30.9593 176.7281 411 E 4.6564 7.8153 116.7467 55.0927 33.1734 174.1273 412 V 4.5960 8.3201 125.8561 61.3758 32.8104 175.0650 413 L 4.5785 9.1427 129.3868 53.1230 43.3808 174.9105 414 P 4.6097 0.0000 0.0000 62.5850 32.1942 176.3052 415 T 4.8622 8.6847 111.6429 61.8247 69.9268 173.6863 416 R 4.7421 8.2365 117.2174 55.0029 32.8505 174.2105 417 R 4.7778 8.5479 119.9100 56.4411 31.1681 175.6821 418 A 4.4722 8.2800 121.2007 50.8698 23.4510 175.9794 419 R 4.4536 8.5058 119.7430 56.5736 31.4605 175.9778 420 T 5.1214 8.7263 112.9702 60.0160 72.3942 172.6985 421 F 5.4428 9.5623 120.4859 56.2337 44.0527 173.7470 422 G 4.7753 9.4491 106.2617 45.4288 0.0000 171.4653 423 L 5.3838 8.5292 118.7968 53.1563 46.6151 175.3461 424 E 4.7345 8.5848 121.3085 54.7090 32.0081 174.6247 425 V 4.4179 8.6930 128.2583 60.9067 33.2766 174.6858 426 E 3.8009 8.4385 129.3620 58.2227 29.4434 175.3402 427 E 4.0487 9.0097 132.2691 57.2580 29.0688 175.1752 428 L 4.2285 7.5277 116.3958 55.0964 42.6776 176.6383 429 H 4.4572 7.8473 115.5673 56.3802 26.8982 173.6936 430 T 5.2507 7.1032 106.5402 60.6851 72.6151 172.4132 431 L 5.2392 8.9607 120.8474 56.2663 43.0285 173.6569 432 V 4.8530 8.3446 119.2938 61.3886 33.2529 174.2520 433 A 5.0306 9.0685 131.6332 51.5378 20.9743 175.5685 434 E 3.8842 10.4235 122.1760 57.2483 27.8769 176.1878 435 G 3.9027 8.3833 106.5320 45.0833 0.0000 173.4593 436 V 4.6083 7.7931 120.6975 61.0628 34.0693 174.8821 437 V 4.4447 8.4367 127.9970 62.8994 32.5124 175.3367 438 V 5.4103 9.2798 120.4710 59.9281 36.7115 174.1288 439 H 4.6588 9.2335 122.2981 55.7512 30.6304 174.8491 440 N 4.6570 8.0582 119.8359 53.2138 36.8539 174.7722 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 1 C 8.20 4.79 0.00 2.94 3.07 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 0.00 0.00 0.00 0.00 2 L 8.60 4.89 0.00 1.70 1.65 1.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 3 A 9.12 4.71 1.40 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 0.00 0.00 4 E 8.65 4.34 0.00 2.48 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 2.38 2.44 0.00 5 G 10.04 4.01 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 0.00 0.00 0.00 6 T 7.81 4.19 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 1.29 0.00 0.00 7 R 10.07 4.90 0.00 1.95 1.90 0.00 3.10 0.00 0.00 3.20 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.78 0.00 8 I 9.17 5.01 1.93 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.73 0.97 0.00 0.00 9 F 8.42 4.79 0.00 3.03 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 10 D 8.66 5.08 0.00 2.67 2.46 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 11 P 0.00 4.27 0.00 2.24 2.27 0.00 3.74 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 2.11 0.00 12 V 8.17 3.67 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 0.70 0.00 0.00 0.69 0.00 0.00 13 T 7.96 4.08 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 1.19 0.00 0.00 14 G 8.33 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 T 7.51 4.46 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 1.03 0.00 0.00 16 T 8.42 5.08 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 17 H 9.41 5.03 0.00 3.06 3.18 0.00 5.80 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 R 8.33 4.62 0.00 2.02 2.10 0.00 3.12 0.00 0.00 3.36 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.60 0.00 19 I 8.61 3.65 1.97 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.38 0.80 0.00 0.00 20 E 7.59 2.68 0.00 1.78 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 2.19 2.26 0.00 21 D 7.89 4.34 0.00 2.82 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 22 V 7.57 3.56 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 1.30 0.00 0.00 0.97 0.00 0.00 23 V 7.83 3.81 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 1.26 0.00 0.00 1.25 0.00 0.00 24 G 7.98 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 25 G 7.77 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 R 7.08 2.00 0.00 1.22 0.66 0.00 2.90 0.00 0.00 2.78 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 1.14 0.00 27 K 7.74 4.06 0.00 1.71 1.71 0.00 1.67 0.00 0.00 1.73 0.00 0.00 3.02 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.35 1.38 7.81 28 P 0.00 5.11 0.00 2.16 2.30 0.00 3.76 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.00 0.00 29 I 7.62 4.13 1.93 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.13 0.67 0.00 0.00 30 H 9.19 5.24 0.00 3.32 3.21 0.00 5.75 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 31 V 8.62 5.02 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 0.69 0.00 0.00 1.01 0.00 0.00 32 V 8.38 4.53 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 1.04 0.00 0.00 1.17 0.00 0.00 33 A 9.66 5.35 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 A 8.78 5.14 1.40 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 0.00 0.00 35 A 8.73 4.46 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 K 8.79 4.28 0.00 1.87 1.86 0.00 1.78 0.00 0.00 1.91 0.00 0.00 2.97 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.58 1.51 7.81 37 D 8.13 4.53 0.00 2.87 2.80 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 0.00 0.00 0.00 38 G 8.66 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 39 T 7.65 4.65 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 1.27 0.00 0.00 40 L 8.25 5.17 0.00 1.52 1.63 0.95 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 41 H 9.57 5.06 0.00 3.05 3.15 0.00 5.80 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 42 A 8.58 5.05 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 R 8.75 4.81 0.00 1.70 1.72 0.00 3.44 0.00 0.00 3.21 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.68 0.00 44 P 0.00 4.64 0.00 1.95 1.84 0.00 3.63 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 1.97 1.90 0.00 45 V 8.39 4.22 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 0.34 0.00 0.00 0.87 0.00 0.00 46 V 8.29 4.00 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 0.60 0.00 0.00 0.86 0.00 0.00 47 S 6.69 3.87 0.00 3.37 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 48 W 8.11 5.11 0.00 3.11 2.90 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 F 9.34 5.00 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 50 D 9.07 4.93 0.00 2.82 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 51 Q 8.93 4.20 0.00 1.87 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 5.52 0.00 0.00 0.00 0.00 0.00 2.41 2.48 0.00 52 G 8.15 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 T 8.12 4.78 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 1.26 0.00 0.00 54 R 8.58 4.65 0.00 1.74 1.79 0.00 3.10 0.00 0.00 3.16 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.58 0.00 55 D 8.65 5.06 0.00 2.64 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 V 8.80 4.86 2.33 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 1.03 0.00 0.00 1.10 0.00 0.00 57 I 9.28 4.75 1.89 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 1.36 0.70 0.98 0.00 0.00 58 G 8.13 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 0.00 0.00 0.00 59 L 8.28 4.78 0.00 1.41 1.49 0.89 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 60 R 8.81 4.60 0.00 1.75 1.82 0.00 3.05 0.00 0.00 3.14 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.55 0.00 61 I 8.84 4.89 1.82 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.78 0.86 0.00 0.00 62 A 8.35 4.02 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 G 9.47 3.93 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 0.00 0.00 0.00 64 G 8.39 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 65 A 8.10 4.14 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 66 I 8.13 4.76 1.89 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.87 0.11 0.00 0.00 67 L 8.50 4.40 0.00 1.73 1.42 0.96 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 68 W 8.89 5.26 0.00 3.36 3.14 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 69 A 8.84 5.39 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 70 T 9.02 4.78 4.36 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 1.30 0.00 0.00 71 P 0.00 4.45 0.00 2.27 2.41 0.00 3.82 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 2.11 2.01 0.00 72 D 7.91 4.65 0.00 2.81 2.84 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 73 H 8.46 4.30 0.00 3.42 3.32 0.00 5.77 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 K 8.56 4.91 0.00 1.77 1.98 0.00 1.66 0.00 0.00 1.69 0.00 0.00 2.82 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.51 1.63 7.81 75 V 9.06 4.85 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 0.95 0.00 0.00 1.04 0.00 0.00 76 L 8.03 3.52 0.00 0.27 0.80 0.05 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 77 T 8.29 5.18 4.28 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 1.23 0.00 0.00 78 E 8.62 3.45 0.00 1.38 1.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.47 0.00 79 Y 7.58 4.79 0.00 3.01 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 G 7.97 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 0.00 0.00 0.00 81 W 8.58 4.85 0.00 3.20 3.21 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 0.00 82 R 9.00 4.94 0.00 1.79 1.83 0.00 3.27 0.00 0.00 3.28 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.80 0.00 83 A 8.58 4.56 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 84 A 9.46 3.95 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 G 8.36 3.81 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 0.00 0.00 0.00 86 E 8.00 4.35 0.00 2.16 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 0.00 2.31 2.29 0.00 87 L 7.44 4.42 0.00 1.70 1.60 0.93 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 88 R 9.42 4.70 0.00 1.74 1.77 0.00 3.31 0.00 0.00 3.10 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.68 0.00 89 K 8.53 4.14 0.00 1.70 1.74 0.00 1.74 0.00 0.00 1.70 0.00 0.00 2.86 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.42 1.56 7.81 90 G 8.75 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 91 D 8.27 4.73 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 92 R 8.60 5.08 0.00 1.66 1.86 0.00 3.07 0.00 0.00 3.12 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.51 0.00 93 V 8.86 4.83 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 0.64 0.00 0.00 0.86 0.00 0.00 94 A 8.48 3.57 0.66 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 0.00 0.00 95 V 8.48 4.71 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 0.72 0.00 0.00 0.87 0.00 0.00 96 R 8.50 4.74 0.00 1.76 1.77 0.00 3.31 0.00 0.00 3.13 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.52 0.00 97 D 9.14 4.50 0.00 2.74 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 8.57 3.44 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.00 0.00 0.75 0.00 0.00 99 E 8.27 4.24 0.00 2.15 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.24 0.00 100 T 8.90 4.05 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 101 G 8.26 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 0.00 102 E 7.68 4.30 0.00 1.94 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 2.28 2.39 0.00 *404 L 8.24 4.54 0.00 1.61 1.57 0.75 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 405 R 8.14 4.69 0.00 1.91 1.98 0.00 2.74 0.00 0.00 3.13 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.53 0.00 406 Y 8.54 5.02 0.00 2.75 2.80 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 0.00 0.00 0.00 407 S 9.08 4.82 0.00 3.63 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 0.00 408 V 8.20 4.22 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 1.03 0.00 0.00 0.91 0.00 0.00 409 I 8.80 4.18 1.84 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.68 0.89 0.00 0.00 410 R 9.30 4.12 0.00 1.72 1.96 0.00 3.35 0.00 0.00 3.13 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.69 0.00 411 E 7.82 4.66 0.00 1.98 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 2.23 2.26 0.00 412 V 8.32 4.60 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 0.84 0.00 0.00 0.90 0.00 0.00 413 L 9.14 4.58 0.00 1.42 1.68 0.95 0.68 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 0.00 414 P 0.00 4.61 0.00 2.02 2.04 0.00 3.80 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.13 0.00 415 T 8.68 4.86 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 1.27 0.00 0.00 416 R 8.24 4.74 0.00 1.76 1.98 0.00 2.52 0.00 0.00 2.75 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.42 0.00 417 R 8.55 4.78 0.00 1.69 1.88 0.00 3.52 0.00 0.00 3.25 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.57 0.00 418 A 8.28 4.47 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 419 R 8.51 4.45 0.00 1.99 1.61 0.00 3.03 0.00 0.00 3.41 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.66 0.00 420 T 8.73 5.12 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 1.30 0.00 0.00 421 F 9.56 5.44 0.00 3.03 3.07 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 0.00 0.00 0.00 0.00 422 G 9.45 4.78 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 0.00 0.00 0.00 423 L 8.53 5.38 0.00 1.50 1.43 0.96 0.96 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 0.00 424 E 8.58 4.73 0.00 2.15 1.70 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 2.20 2.33 0.00 425 V 8.69 4.42 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 0.83 0.00 0.00 0.88 0.00 0.00 426 E 8.44 3.80 0.00 1.92 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 2.27 2.22 0.00 427 E 9.01 4.05 0.00 2.10 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.29 0.00 428 L 7.53 4.23 0.00 1.73 1.87 0.94 1.14 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 0.00 429 H 7.85 4.46 0.00 3.22 3.20 0.00 5.58 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 0.00 430 T 7.10 5.25 4.55 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 0.99 0.00 0.00 431 L 8.96 5.24 0.00 1.78 1.80 1.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 432 V 8.34 4.85 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 0.99 0.00 0.00 1.04 0.00 0.00 433 A 9.07 5.03 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 0.00 434 E 10.42 3.88 0.00 2.08 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 0.00 2.33 2.62 0.00 435 G 8.38 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 0.00 436 V 7.79 4.61 2.17 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 0.90 0.00 0.00 0.93 0.00 0.00 437 V 8.44 4.44 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.89 0.00 0.00 438 V 9.28 5.41 2.46 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 0.79 0.00 0.00 1.16 0.00 0.00 439 H 9.23 4.66 0.00 2.99 3.06 0.00 5.95 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 440 N 8.06 4.66 0.00 2.89 2.74 0.00 0.00 6.77 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 * Residues marked with a * may have inaccurate shift predictions.