NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 V 4.0694 8.0544 120.6466 62.8029 32.7601 174.1421 3 Q 4.4766 9.0132 129.0895 53.7771 32.1181 172.1718 4 L 5.1873 9.4481 127.1435 53.0544 44.7579 175.6565 5 V 4.6263 8.4002 116.0105 59.7853 34.8382 175.2203 6 Q 5.2048 8.9676 124.5195 54.1229 31.0518 175.4688 7 S 4.4472 8.4292 116.2161 58.0215 64.2959 173.8849 8 G 4.0327 8.4658 107.7704 45.0860 0.0000 173.2872 9 A 4.5141 8.4205 121.5504 52.6100 19.2377 176.9280 10 E 4.5835 9.1802 122.6282 55.5955 33.6316 174.7937 11 V 4.7070 8.4515 126.1105 59.8861 33.3800 172.3471 12 K 4.7341 9.1707 127.6200 54.2090 36.3535 176.7017 13 R 4.8242 8.3520 122.5476 55.0638 31.4998 174.6293 14 P 4.5133 0.0000 0.0000 64.7779 31.7729 176.9508 15 G 3.9456 8.9115 113.9456 45.9230 0.0000 174.6752 16 S 4.4517 7.8589 119.9224 59.4746 63.6686 179.2406 17 S 5.3436 8.4224 117.3370 57.9419 64.5820 174.5691 18 V 4.3680 8.5258 121.6057 60.0244 34.3125 174.8115 19 T 4.8302 8.3385 119.4590 61.9579 70.8509 173.2248 20 V 4.1816 8.7076 130.2459 62.0721 33.6142 175.5067 21 S 5.2063 9.1779 126.0403 57.4181 65.6687 170.5192 22 C 4.9164 8.9052 122.7173 55.3489 41.7694 172.4416 23 K 4.8952 8.7997 128.8758 54.5162 33.6245 175.0975 24 A 4.5999 8.8706 130.9976 52.0302 19.0891 176.5157 25 S 4.5042 9.5579 120.4476 57.8243 65.4102 176.0604 26 G 4.0478 8.9941 113.7815 45.1655 0.0000 172.7236 27 G 3.9203 8.3201 109.8701 44.4517 0.0000 173.0756 28 S 4.6416 8.3782 112.9890 57.5102 63.1718 172.8331 29 F 4.7440 8.9302 128.6572 60.5596 41.5192 177.7763 30 S 4.1208 8.4612 116.6529 60.8626 61.9406 177.2620 31 T 4.3794 7.5302 106.9200 61.0817 69.1690 173.4517 32 Y 4.6525 7.0021 119.0105 55.8579 40.3784 175.2199 33 A 4.1064 9.0848 126.6023 51.9879 19.7113 175.9009 34 L 4.5724 8.8840 125.8804 53.5325 44.1003 175.4130 35 S 5.1257 8.5435 122.6634 56.5946 66.2655 173.1747 36 W 4.9446 8.6706 122.6714 55.3587 31.7124 175.6125 37 V 5.0203 9.0382 122.8929 61.8229 34.9093 173.4195 38 R 4.9993 9.2795 124.1497 54.6853 33.3438 175.0307 39 Q 4.7996 8.9734 121.1034 54.7837 31.4107 173.5600 40 A 4.6164 8.5221 128.4493 50.2973 20.0654 174.6412 41 P 4.1701 0.0000 0.0000 64.3767 31.6485 176.6861 42 G 3.9130 9.0017 109.9054 46.1001 0.0000 172.5424 43 R 4.7107 7.8459 118.5199 53.5174 33.1481 175.5893 44 G 3.9073 8.3191 107.2732 45.3270 0.0000 173.3733 45 L 4.6714 8.2456 120.1087 54.6616 42.6439 176.7336 46 E 4.8987 9.4297 120.5030 54.4853 33.0629 174.2484 47 W 4.7055 9.3339 134.3666 57.8818 31.3426 175.0857 48 M 4.4193 8.8688 125.6877 54.7837 34.0781 176.3470 49 G 3.2992 5.5067 103.8999 46.5154 0.0000 170.6819 50 G 4.6478 8.1317 106.5197 45.9055 0.0000 172.5948 51 V 5.0473 8.7466 118.6098 60.4259 35.2076 173.7551 52 I 4.2652 8.5352 125.6184 59.6124 37.8524 175.1221 53 P 4.1691 0.0000 0.0000 65.3399 31.6617 178.2424 54 L 3.9324 7.8265 119.6194 57.8026 41.7595 178.5727 55 L 4.7286 7.3703 115.5082 55.0143 43.2861 176.5781 56 T 3.3932 7.5870 111.0466 64.7519 66.4334 174.6343 57 I 4.2458 8.1092 122.9291 60.6937 37.8337 177.4584 58 T 4.7785 8.1090 117.1756 60.6493 71.3107 174.5922 59 N 4.6111 8.4070 121.4616 53.3289 41.4576 172.4088 60 Y 5.4018 8.3271 123.7278 56.0121 40.5657 175.6849 61 A 4.5248 8.9281 125.4730 51.4183 18.9005 176.8684 62 P 4.3749 0.0000 0.0000 65.7351 31.6495 178.7884 63 R 3.8849 7.9543 112.9319 58.0423 29.7422 177.1104 64 F 4.6571 8.1971 116.8519 57.7474 40.0618 175.8358 65 Q 4.0711 7.4272 119.8150 57.6518 28.7786 176.6952 66 G 4.1224 9.0391 110.7715 45.1179 0.0000 174.0391 67 R 4.5409 8.8975 116.9533 55.5780 32.6415 175.3915 68 I 4.6858 7.4664 118.4936 59.3566 40.7482 174.8495 69 T 4.6053 8.3267 123.7049 62.1229 72.9191 172.7178 70 I 5.6053 9.2991 127.3363 58.9224 39.7696 175.0977 71 T 5.0144 8.7123 115.2801 60.1263 72.8801 172.3181 72 A 5.3547 8.5897 122.5354 50.4424 22.4954 174.9061 73 D 4.7823 9.3539 122.2549 52.8327 41.8697 177.6261 74 R 4.2553 8.9091 126.4034 59.2930 30.5831 179.3024 75 S 4.1681 8.2821 111.8735 60.8966 63.1687 174.8695 76 T 4.2689 7.8506 108.0934 60.2213 68.8320 174.3767 77 S 2.0000 6.8669 115.5889 59.4516 61.2341 171.2911 78 T 4.8951 7.1454 115.6151 61.7382 70.8803 174.0757 79 A 5.2870 8.9596 128.2666 50.8107 22.3044 175.1893 80 Y 5.2354 9.2543 116.5415 56.1887 42.5918 174.2812 81 L 4.5113 8.8843 128.5431 53.7099 44.5956 175.2652 82 E 4.8547 8.7968 125.2202 54.6594 32.2449 170.9113 83 L 4.7405 8.8256 127.9830 52.4517 44.2049 175.4314 84 N 4.8887 8.8469 124.0344 51.1792 40.8668 174.7235 85 S 3.5995 8.2757 112.2510 59.4205 60.6826 172.0738 86 L 4.4019 7.9434 123.6711 55.9212 42.7470 177.9170 87 R 4.9549 8.7082 117.8311 53.9419 33.7839 175.4734 88 P 4.3059 0.0000 0.0000 65.9128 31.4457 178.6559 89 E 4.0863 8.1760 114.5439 58.8804 29.4826 177.1641 90 D 4.7027 8.5439 118.5010 54.9698 40.5665 176.2785 91 T 4.6443 8.3713 117.7900 63.5322 69.2081 173.4704 92 A 4.3445 8.3535 127.0694 50.9818 23.3353 174.3785 93 V 4.3217 8.3738 119.4468 62.5493 33.0598 174.4059 94 Y 4.8953 9.0544 126.4726 56.7942 39.6766 174.1622 95 Y 5.3394 9.6579 124.0582 56.7147 40.3741 172.6566 96 C 4.2851 8.9087 118.1677 54.1430 42.7801 172.3407 97 A 4.4466 8.3121 123.0420 49.9793 22.2816 174.7901 98 R 4.9405 8.5466 122.6166 53.8105 33.2414 175.0934 99 E 4.6656 8.6209 123.1383 56.7712 30.4857 176.6038 100 G 4.1496 8.6616 108.8492 45.5221 0.0000 172.5582 101 T 5.2198 8.1245 110.1187 59.9683 71.8470 173.5340 102 T 3.7765 8.4084 119.1483 64.6794 68.8441 174.0352 103 G 3.5778 9.1553 120.1722 45.6490 0.0000 172.8924 *107 L 4.1390 7.9468 118.3841 54.3936 43.7226 176.0185 108 G 4.0431 8.3384 112.4917 44.2433 0.0000 172.6845 109 K 4.0916 8.3078 120.7615 56.1666 33.0377 174.2157 110 P 5.1519 0.0000 0.0000 62.7803 31.7041 176.1297 111 I 4.1256 8.8440 115.8767 60.5306 38.7155 176.2598 112 G 4.2099 8.7286 115.9292 45.6448 0.0000 174.1768 113 A 3.5904 7.5458 123.1710 52.0219 18.7104 176.7530 114 F 4.8033 7.9707 120.2441 57.1025 38.0145 175.2976 115 A 4.3105 8.6847 126.6625 53.8445 19.4371 176.9423 116 H 5.1311 8.2552 112.6676 53.8766 32.0477 173.3393 117 W 5.0854 8.9190 121.7017 54.7726 32.7450 175.5290 118 G 4.1400 9.2076 111.9395 45.3369 0.0000 173.5189 119 Q 4.4644 8.8314 115.8530 55.8885 28.9823 175.6758 120 G 3.6991 8.8652 108.2742 45.8541 0.0000 173.2548 121 T 4.5891 8.4467 117.6798 61.0781 72.0421 173.0912 122 L 4.5685 8.6284 129.1924 54.9869 43.6173 175.4209 123 V 4.8170 8.9290 127.1761 61.6258 33.8960 174.2762 124 T 4.7053 8.3771 125.7389 62.0041 70.3617 174.2583 125 V 4.5203 8.4126 128.3717 61.8884 31.9320 174.9343 126 S 4.7101 8.7390 126.2683 56.9833 63.4517 175.0154 127 S 4.2879 8.9594 124.0182 60.9131 62.5373 170.6702 128 L 4.2388 7.8392 123.2977 55.1985 41.3192 176.7845 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 2 V 8.05 4.07 1.57 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 0.73 0.00 0.00 0.75 0.00 0.00 3 Q 9.01 4.48 0.00 2.12 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.63 6.63 0.00 0.00 0.00 0.00 0.00 2.24 2.42 0.00 4 L 9.45 5.19 0.00 1.52 1.47 0.80 0.81 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 5 V 8.40 4.63 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 0.80 0.00 0.00 0.99 0.00 0.00 6 Q 8.97 5.20 0.00 2.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.94 0.00 0.00 0.00 0.00 0.00 2.35 2.34 0.00 7 S 8.43 4.45 0.00 3.93 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 8 G 8.47 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 9 A 8.42 4.51 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 10 E 9.18 4.58 0.00 1.99 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 2.17 2.24 0.00 11 V 8.45 4.71 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 0.81 0.00 0.00 0.93 0.00 0.00 12 K 9.17 4.73 0.00 1.57 1.64 0.00 1.59 0.00 0.00 1.65 0.00 0.00 2.85 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.29 1.42 7.81 13 R 8.35 4.82 0.00 1.50 1.79 0.00 3.26 0.00 0.00 3.34 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.22 0.00 14 P 0.00 4.51 0.00 2.03 2.03 0.00 3.62 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 2.03 2.09 0.00 15 G 8.91 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 16 S 7.86 4.45 0.00 3.48 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 17 S 8.42 5.34 0.00 3.37 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 18 V 8.53 4.37 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 0.39 0.00 0.00 0.71 0.00 0.00 19 T 8.34 4.83 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 20 V 8.71 4.18 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 1.00 0.00 0.00 0.58 0.00 0.00 21 S 9.18 5.21 0.00 3.39 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 C 8.91 4.92 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 23 K 8.80 4.90 0.00 1.80 1.59 0.00 1.63 0.00 0.00 1.60 0.00 0.00 2.78 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.23 1.37 7.81 24 A 8.87 4.60 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 9.56 4.50 0.00 3.71 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 26 G 8.99 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 G 8.32 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 28 S 8.38 4.64 0.00 3.98 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 F 8.93 4.74 0.00 3.09 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 30 S 8.46 4.12 0.00 3.69 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 31 T 7.53 4.38 3.78 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 1.05 0.00 0.00 32 Y 7.00 4.65 0.00 2.96 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 A 9.08 4.11 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 34 L 8.88 4.57 0.00 1.53 1.39 0.76 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 35 S 8.54 5.13 0.00 2.96 3.57 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 36 W 8.67 4.94 0.00 3.06 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 37 V 9.04 5.02 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 1.33 0.00 0.00 1.13 0.00 0.00 38 R 9.28 5.00 0.00 1.07 1.49 0.00 2.48 0.00 0.00 2.96 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.44 0.00 39 Q 8.97 4.80 0.00 2.25 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.98 0.00 0.00 0.00 0.00 0.00 2.32 2.54 0.00 40 A 8.52 4.62 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 41 P 0.00 4.17 0.00 2.06 2.07 0.00 3.85 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.14 0.00 42 G 9.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 R 7.85 4.71 0.00 1.95 1.89 0.00 3.19 0.00 0.00 3.25 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.76 0.00 44 G 8.32 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 L 8.25 4.67 0.00 1.67 1.82 0.93 0.87 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 46 E 9.43 4.90 0.00 2.17 2.15 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 2.28 2.46 0.00 47 W 9.33 4.71 0.00 3.51 3.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 M 8.87 4.42 0.00 1.47 1.91 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 1.91 0.00 49 G 5.51 3.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.13 4.65 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 0.00 0.00 0.00 51 V 8.75 5.05 2.15 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 0.80 0.00 0.00 0.95 0.00 0.00 52 I 8.54 4.27 1.82 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.68 0.81 0.00 0.00 53 P 0.00 4.17 0.00 1.98 1.96 0.00 3.48 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 1.14 1.70 0.00 54 L 7.83 3.93 0.00 1.67 1.67 0.90 0.76 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 55 L 7.37 4.73 0.00 1.60 1.59 0.91 0.90 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 56 T 7.59 3.39 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 57 I 8.11 4.25 1.85 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 1.26 0.85 0.89 0.00 0.00 58 T 8.11 4.78 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 59 N 8.41 4.61 0.00 2.92 2.88 0.00 0.00 7.45 7.59 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 60 Y 8.33 5.40 0.00 3.14 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 A 8.93 4.52 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 0.00 0.00 0.00 0.00 0.00 62 P 0.00 4.37 0.00 2.23 2.20 0.00 3.77 0.00 0.00 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.20 0.00 63 R 7.95 3.88 0.00 1.63 1.92 0.00 2.82 0.00 0.00 2.88 7.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.64 0.00 64 F 8.20 4.66 0.00 3.20 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 65 Q 7.43 4.07 0.00 2.31 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.75 0.00 0.00 0.00 0.00 0.00 2.57 2.55 0.00 66 G 9.04 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 0.00 0.00 0.00 67 R 8.90 4.54 0.00 1.74 2.10 0.00 3.10 0.00 0.00 3.11 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.71 0.00 68 I 7.47 4.69 1.64 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.53 -0.10 0.00 0.00 69 T 8.33 4.61 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 1.24 0.00 0.00 70 I 9.30 5.61 2.11 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 1.63 1.16 0.00 0.00 71 T 8.71 5.01 4.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 72 A 8.59 5.35 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 73 D 9.35 4.78 0.00 2.92 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 R 8.91 4.26 0.00 2.00 2.08 0.00 3.29 0.00 0.00 3.44 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.73 0.00 75 S 8.28 4.17 0.00 3.97 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 76 T 7.85 4.27 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 1.23 0.00 0.00 77 S 6.87 2.00 0.00 3.70 3.32 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 78 T 7.15 4.90 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.00 0.00 79 A 8.96 5.29 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 80 Y 9.25 5.24 0.00 3.16 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 81 L 8.88 4.51 0.00 0.27 0.13 0.45 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 82 E 8.80 4.85 0.00 1.67 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 2.15 2.09 0.00 83 L 8.83 4.74 0.00 1.26 1.27 0.78 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 84 N 8.85 4.89 0.00 2.57 2.67 0.00 0.00 7.11 8.10 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 85 S 8.28 3.60 0.00 3.93 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 86 L 7.94 4.40 0.00 1.74 1.57 0.86 0.61 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 87 R 8.71 4.95 0.00 1.69 1.71 0.00 3.29 0.00 0.00 3.17 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.47 0.00 88 P 0.00 4.31 0.00 2.18 2.17 0.00 3.58 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.11 0.00 89 E 8.18 4.09 0.00 2.10 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.40 0.00 90 D 8.54 4.70 0.00 2.89 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 91 T 8.37 4.64 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 1.28 0.00 0.00 92 A 8.35 4.34 0.95 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 93 V 8.37 4.32 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 0.20 0.00 0.00 0.88 0.00 0.00 94 Y 9.05 4.90 0.00 2.98 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 95 Y 9.66 5.34 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 96 C 8.91 4.29 0.00 1.64 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 97 A 8.31 4.45 -0.79 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 98 R 8.55 4.94 0.00 1.66 1.69 0.00 3.12 0.00 0.00 3.18 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.43 0.00 99 E 8.62 4.67 0.00 2.22 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 2.43 2.33 0.00 100 G 8.66 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 T 8.12 5.22 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 0.80 0.00 0.00 102 T 8.41 3.78 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 1.21 0.00 0.00 103 G 9.16 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *107 L 7.95 4.14 0.00 1.73 1.71 1.04 1.00 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 0.00 108 G 8.34 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 K 8.31 4.09 0.00 1.88 1.73 0.00 1.73 0.00 0.00 1.83 0.00 0.00 2.91 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.54 1.51 7.81 110 P 0.00 5.15 0.00 2.07 2.35 0.00 3.75 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.28 0.00 111 I 8.84 4.13 1.85 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.70 1.00 0.00 0.00 112 G 8.73 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 0.00 0.00 0.00 0.00 113 A 7.55 3.59 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 F 7.97 4.80 0.00 3.06 2.42 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 0.00 115 A 8.68 4.31 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 H 8.26 5.13 0.00 3.03 3.16 0.00 5.56 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 W 8.92 5.09 0.00 3.10 3.13 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 0.00 118 G 9.21 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 Q 8.83 4.46 0.00 2.27 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.70 0.00 0.00 0.00 0.00 0.00 2.37 2.34 0.00 120 G 8.87 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 0.00 0.00 0.00 121 T 8.45 4.59 4.32 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 1.27 0.00 0.00 122 L 8.63 4.57 0.00 1.78 1.56 0.98 0.83 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 0.00 123 V 8.93 4.82 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 0.84 0.00 0.00 0.71 0.00 0.00 124 T 8.38 4.71 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 1.23 0.00 0.00 125 V 8.41 4.52 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 0.75 0.00 0.00 1.00 0.00 0.00 126 S 8.74 4.71 0.00 3.88 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 0.00 127 S 8.96 4.29 0.00 3.67 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 0.00 128 L 7.84 4.24 0.00 1.63 1.62 0.92 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.