NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 S 4.4421 8.1927 115.4160 58.0909 64.3531 171.3423 2 V 4.2937 7.9919 118.8215 60.1557 34.2310 174.6845 3 Q 3.9876 9.5349 129.7529 56.2741 29.6541 174.5153 4 P 4.3421 0.0000 0.0000 63.2127 32.3006 175.9189 5 N 4.2092 8.8828 118.6518 54.0435 36.1014 174.7161 6 F 4.3429 8.4965 119.2999 58.5492 40.1846 174.1334 7 Q 4.2082 8.3079 127.6626 53.7914 29.0466 175.9123 8 Q 3.8662 8.2863 125.3035 59.0687 29.2270 177.6833 9 D 4.3990 7.9596 119.6192 56.2283 39.2007 178.0419 10 K 4.1827 7.4768 117.5866 57.5613 32.2857 177.8434 11 F 5.1491 8.0143 119.7147 57.9901 39.8587 175.3971 12 L 4.3028 6.8705 116.5252 55.4924 42.7108 176.2235 13 G 3.6580 8.6053 104.6674 44.0075 0.0000 171.8633 14 R 4.5968 7.9129 120.7473 55.2205 31.0355 177.2266 15 W 5.0998 9.0338 125.5640 54.8939 33.7681 174.0177 16 F 5.1396 9.6549 120.9019 56.0512 41.3541 175.5961 17 S 4.4321 9.0628 119.4245 58.1676 61.8648 173.2938 18 A 4.4096 8.9710 127.8375 53.2260 20.3924 177.1447 19 G 3.9570 7.4118 100.3639 44.3762 0.0000 171.5709 20 L 5.2324 8.7869 122.3776 53.2779 46.4064 174.7350 21 A 5.3864 9.0132 126.2403 49.4542 22.1978 174.9779 22 S 5.0443 8.4072 116.3431 56.6486 65.7679 173.1278 23 N 4.8472 8.6790 122.3416 52.9534 38.2797 174.5537 24 S 4.7976 8.1511 116.0473 56.9675 63.3904 174.6994 25 S 4.1987 8.9044 125.1755 61.3729 62.6473 176.2739 26 W 4.1474 8.3524 130.5685 60.5452 30.4418 177.6598 27 L 3.6542 8.3617 120.1989 57.9844 41.5902 178.8743 28 R 3.8650 8.1505 118.0914 59.4895 29.9245 178.8966 29 E 3.8986 8.3603 118.4110 59.2171 29.1939 179.5323 30 K 3.6379 7.3443 117.3966 59.3871 32.4267 179.2845 31 K 3.9178 8.0075 118.5302 59.2142 31.7423 179.2806 32 A 4.0746 7.8911 119.6100 54.1857 18.3584 178.4781 33 A 4.3220 7.3423 117.5538 51.6396 18.9102 176.5071 34 L 4.9472 7.1405 116.5269 52.9742 45.5924 175.7691 35 S 4.9885 8.5933 115.6629 57.0665 65.4740 173.8758 36 M 4.2799 9.0039 125.0476 55.6557 32.5236 175.5515 37 A 4.9546 9.1745 125.5899 52.4126 19.3417 177.0616 38 K 4.5746 7.7094 109.8441 55.2764 36.9708 174.7087 39 S 5.2806 9.3610 116.5785 56.7188 66.8626 173.3806 40 V 4.7240 8.8021 122.6685 61.1089 34.4440 174.2020 41 V 4.6896 8.7947 128.1342 61.3148 33.1567 174.3254 42 A 5.0254 8.7593 128.6901 49.3038 22.9887 173.2691 43 P 4.7988 0.0000 0.0000 62.6570 32.1497 176.6532 44 A 4.4557 8.7968 127.5023 51.0148 19.7361 178.3544 45 T 4.0064 8.4571 109.2135 63.5797 68.9015 173.0133 46 D 5.1679 7.7168 122.5421 52.6118 43.7531 176.4605 47 G 4.0775 8.8634 108.4323 46.5206 0.0000 174.0414 48 G 4.6125 7.7687 109.5413 45.0607 0.0000 172.7704 49 L 5.3756 8.7493 119.7972 53.0778 46.4335 175.4866 50 N 5.1442 9.5639 120.4322 51.7773 40.7527 173.7212 51 L 4.8724 8.9774 127.1912 53.8936 44.0195 175.1000 52 T 4.9986 8.7698 124.7891 62.1624 70.5532 173.8701 53 S 5.2634 9.2873 123.7658 57.1205 65.5114 173.3805 54 T 5.1216 9.1173 121.8009 61.8147 71.1575 173.4340 55 F 5.3763 8.5604 119.9548 55.7296 42.4582 172.4682 56 L 5.0811 9.3135 121.9381 53.3818 44.0937 174.8823 57 R 4.8033 8.9928 126.7340 54.6668 32.9004 175.5074 58 K 3.7813 9.5705 127.4483 57.9804 29.6885 174.7383 59 N 4.2522 8.2328 108.9717 53.9966 36.7867 174.2599 60 Q 4.6202 7.9439 118.1180 53.9502 30.8289 174.4017 61 C 4.8725 8.6155 120.7063 57.1316 41.2708 172.8554 62 E 4.7854 8.9330 122.1787 54.7483 33.9283 174.4603 63 T 5.0780 8.0942 110.2925 60.1709 72.2774 173.3264 64 R 4.8268 9.2424 121.7219 54.8953 34.5442 174.1216 65 T 5.1113 8.6960 119.1540 62.0287 71.2548 173.3097 66 M 4.7982 9.0373 126.0055 53.3393 34.9439 174.6199 67 L 4.6785 8.8866 126.4593 54.5731 43.2398 175.9353 68 L 4.8422 9.2736 128.2037 53.3873 42.8894 176.1849 69 Q 4.6806 9.1847 124.3124 54.6870 30.1817 174.4201 70 P 4.5733 0.0000 0.0000 62.8168 32.0615 175.9519 71 A 4.5876 8.5450 123.7921 51.7836 19.6160 177.5558 72 G 3.9780 9.7821 106.1297 46.0752 0.0000 174.1251 73 S 4.6286 7.3202 112.9020 56.0629 66.0558 173.3887 74 L 4.2255 8.3030 122.7018 56.3688 41.9559 177.8372 75 G 2.9927 8.8292 111.6915 44.4898 0.0000 172.3418 76 S 5.0122 7.3496 116.4571 56.9474 65.2758 173.0631 77 Y 5.3609 9.2085 121.3204 56.3464 42.9217 173.9421 78 S 5.2639 9.5893 114.3817 56.8927 66.3006 171.8506 79 Y 5.1193 9.5211 127.4859 55.8812 41.4580 174.1532 80 R 4.6224 8.1018 126.1770 54.4939 32.2102 175.2282 *86 S 4.2737 8.2167 119.0153 58.7144 64.2036 173.0945 87 T 4.8701 7.8087 118.0200 62.0348 72.1238 172.8179 88 Y 5.3262 9.3095 121.9171 56.2330 42.2191 174.7321 89 S 5.1052 9.3796 118.8678 57.6734 65.3519 173.1501 90 V 4.9389 9.0553 123.1958 61.2979 34.3268 174.1836 91 S 5.1372 9.3005 123.9635 56.6989 66.6819 173.7973 92 V 3.8549 8.3071 124.8927 62.2112 30.7751 176.4748 93 V 3.8210 8.4670 129.2875 64.8479 32.3054 176.0478 94 E 4.9340 7.7094 119.6265 55.3860 32.9818 174.0250 95 T 4.1101 8.6613 119.5135 61.0274 70.5138 172.7579 96 D 4.6380 7.1198 125.4244 52.7674 39.9908 176.3319 97 Y 4.4751 7.8950 123.0571 58.7362 37.2152 169.9291 98 D 4.8307 8.0829 114.5777 53.2906 40.5513 175.7901 99 Q 4.7112 8.4171 117.4569 57.4848 31.8629 174.4424 100 Y 5.8727 8.8231 115.0976 55.8651 42.2486 173.3634 101 A 4.6742 9.3923 121.3653 50.3574 23.2152 174.9878 102 L 5.0917 9.2925 122.2145 53.1241 43.8825 175.6673 103 L 5.2705 8.9529 124.4057 53.1584 44.9727 175.0199 104 Y 5.3673 9.1451 122.6775 56.1436 42.2707 174.1742 105 S 5.8443 8.7189 121.8142 56.0035 66.9497 173.1227 106 Q 4.9409 8.4489 121.4751 53.8452 33.3797 174.7151 107 G 4.0468 9.0078 110.9151 46.8323 0.0000 173.3946 108 S 4.8843 9.0496 117.6890 57.9232 65.1633 174.0691 109 K 4.5349 7.2014 121.0380 56.8976 35.7561 176.6277 110 G 4.0048 8.7324 114.9283 44.4770 0.0000 171.8347 111 P 4.3455 0.0000 0.0000 65.2395 30.9924 178.5572 112 G 3.7576 8.0527 104.1599 46.7634 0.0000 175.2513 113 E 4.0841 8.3285 121.0412 59.2394 29.1870 178.5913 114 D 4.4604 8.0223 117.8897 55.2238 41.3848 175.7958 115 F 5.0646 8.1718 123.5139 57.0584 41.1098 174.8467 116 R 4.7565 8.5784 124.0098 54.6599 34.6128 173.9898 117 M 4.9455 8.5091 121.4188 54.2192 36.2205 173.0769 118 A 5.5295 9.0183 127.8129 50.6157 22.2581 175.3405 119 T 4.8001 9.1518 117.5810 61.5544 72.9265 172.7608 120 L 4.6268 7.7504 128.0765 53.7186 43.6364 174.5128 121 Y 5.2742 8.8921 124.9930 56.5841 40.4576 174.8966 122 S 5.5775 9.4445 117.2407 56.8076 65.6798 174.9576 123 R 4.3835 9.4579 125.2174 58.0279 30.3434 176.8520 124 T 4.6603 7.5666 108.9453 59.3182 71.0662 174.3020 125 Q 3.2117 7.9064 124.9488 58.0731 29.1448 175.7785 126 T 4.3267 7.3297 108.2844 58.8312 68.8476 172.1030 127 P 4.4875 0.0000 0.0000 61.9551 32.6816 177.3125 128 R 4.0113 8.4534 118.7838 56.4311 32.0003 177.7590 129 A 3.9245 8.5361 122.8659 55.5275 18.2874 179.9423 130 E 3.9140 8.0929 117.2084 59.1848 29.7382 178.8666 131 L 3.8706 7.7306 118.8394 57.6404 41.7460 179.3773 132 K 4.2369 7.8913 118.1923 59.5866 31.8477 179.3221 133 E 4.0597 8.3405 118.9760 59.1136 29.3786 179.1831 134 K 3.9050 8.3002 119.9467 59.4692 32.1545 178.6825 135 F 4.4165 8.3659 120.8815 61.7162 39.3198 177.2559 136 T 3.6755 8.3284 115.2210 66.5169 68.2716 176.4301 137 A 3.9681 8.3003 122.8783 55.0690 18.5200 179.4791 138 F 4.1313 8.3253 119.0545 61.6832 39.5368 177.1301 139 C 3.9674 8.1267 116.6745 62.7080 27.8539 176.2778 140 K 3.9145 8.1687 119.9300 59.4536 31.4176 179.2691 141 A 3.9717 7.7683 119.8242 54.6433 18.2925 178.6616 142 Q 4.0663 7.2936 113.8172 55.4928 28.9533 176.6580 143 G 3.7286 7.5614 108.2661 45.3547 0.0000 173.7856 144 F 4.3352 7.6429 118.6077 56.7123 39.7800 175.9308 145 T 4.2052 8.3442 114.8649 61.1510 69.9140 175.2859 146 E 3.9828 8.8083 122.5050 59.8082 29.6672 179.3663 147 D 4.4473 8.0770 117.3023 56.7981 41.2178 176.9862 148 T 4.1600 7.9433 108.1485 61.8407 69.3856 174.0459 149 I 4.3432 7.2459 123.9978 60.4426 37.4109 175.4451 150 V 4.4656 8.6071 120.4382 59.2937 36.1171 174.8540 151 F 5.1399 8.5352 120.9956 55.5870 40.5507 175.7626 152 L 4.3269 8.3494 124.5178 53.5969 42.4986 175.5217 153 P 4.3741 0.0000 0.0000 63.5802 32.0709 175.1533 154 Q 5.2317 8.6889 121.5654 54.4686 31.5802 174.6259 155 T 4.7431 8.7345 115.6378 60.6935 70.1240 173.7243 156 D 4.6061 8.8425 125.3061 55.1076 41.3732 177.0300 157 K 4.2056 7.8366 119.6613 56.9585 32.7878 176.7773 158 C 4.2015 8.7111 114.4764 57.8590 37.6006 173.4437 159 M 4.2041 7.5122 124.8965 55.7978 31.7554 175.7717 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 S 8.19 4.44 0.00 4.02 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 2 V 7.99 4.29 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 0.69 0.00 0.00 0.88 0.00 0.00 3 Q 9.53 3.99 0.00 2.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.67 6.61 0.00 0.00 0.00 0.00 0.00 2.50 2.59 0.00 4 P 0.00 4.34 0.00 2.03 2.01 0.00 3.92 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.15 0.00 5 N 8.88 4.21 0.00 2.94 2.94 0.00 0.00 6.93 7.45 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 6 F 8.50 4.34 0.00 3.13 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 7 Q 8.31 4.21 0.00 1.36 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.88 6.56 0.00 0.00 0.00 0.00 0.00 2.29 2.11 0.00 8 Q 8.29 3.87 0.00 2.32 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.05 6.89 0.00 0.00 0.00 0.00 0.00 2.62 2.82 0.00 9 D 7.96 4.40 0.00 2.87 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 10 K 7.48 4.18 0.00 1.01 1.54 0.00 1.39 0.00 0.00 0.91 0.00 0.00 2.42 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.25 1.14 7.81 11 F 8.01 5.15 0.00 3.20 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 12 L 6.87 4.30 0.00 1.72 1.58 0.94 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 13 G 8.61 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 R 7.91 4.60 0.00 1.62 1.57 0.00 3.04 0.00 0.00 2.91 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 1.24 0.00 15 W 9.03 5.10 0.00 2.97 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 16 F 9.65 5.14 0.00 3.10 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 9.06 4.43 0.00 3.76 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 A 8.97 4.41 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 19 G 7.41 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 20 L 8.79 5.23 0.00 1.53 1.31 0.84 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 21 A 9.01 5.39 0.30 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 22 S 8.41 5.04 0.00 3.81 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 23 N 8.68 4.85 0.00 2.74 2.93 0.00 0.00 6.75 8.27 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 24 S 8.15 4.80 0.00 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 0.00 25 S 8.90 4.20 0.00 4.01 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 26 W 8.35 4.15 0.00 3.42 3.27 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 27 L 8.36 3.65 0.00 2.11 1.90 0.98 1.16 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 28 R 8.15 3.86 0.00 2.06 1.95 0.00 3.17 0.00 0.00 3.39 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 2.03 0.00 29 E 8.36 3.90 0.00 2.01 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 2.30 2.40 0.00 30 K 7.34 3.64 0.00 1.29 1.38 0.00 1.35 0.00 0.00 1.30 0.00 0.00 2.62 0.00 0.00 2.83 0.00 0.00 0.00 0.00 0.30 0.21 7.81 31 K 8.01 3.92 0.00 1.76 1.72 0.00 1.49 0.00 0.00 1.41 0.00 0.00 2.81 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.52 1.49 7.81 32 A 7.89 4.07 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 33 A 7.34 4.32 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 34 L 7.14 4.95 0.00 1.54 1.75 0.42 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 35 S 8.59 4.99 0.00 3.81 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 0.00 36 M 9.00 4.28 0.00 2.04 2.21 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.65 0.00 37 A 9.17 4.95 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 38 K 7.71 4.57 0.00 1.40 1.74 0.00 1.31 0.00 0.00 1.76 0.00 0.00 2.79 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.38 1.42 7.81 39 S 9.36 5.28 0.00 3.89 3.73 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 40 V 8.80 4.72 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 0.96 0.00 0.00 0.85 0.00 0.00 41 V 8.79 4.69 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.60 0.00 0.00 42 A 8.76 5.03 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 43 P 0.00 4.80 0.00 1.98 2.05 0.00 3.69 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 2.05 2.14 0.00 44 A 8.80 4.46 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 T 8.46 4.01 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 1.23 0.00 0.00 46 D 7.72 5.17 0.00 2.74 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 G 8.86 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 48 G 7.77 4.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 L 8.75 5.38 0.00 1.27 1.43 0.75 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 50 N 9.56 5.14 0.00 2.60 2.74 0.00 0.00 6.52 6.08 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 51 L 8.98 4.87 0.00 1.62 1.46 0.73 0.45 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 52 T 8.77 5.00 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 53 S 9.29 5.26 0.00 3.85 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 54 T 9.12 5.12 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 55 F 8.56 5.38 0.00 3.23 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 L 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0.00 3.28 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.96 0.00 65 T 8.70 5.11 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 1.24 0.00 0.00 66 M 9.04 4.80 0.00 1.60 1.80 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.22 0.00 67 L 8.89 4.68 0.00 1.71 1.70 1.05 1.06 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 68 L 9.27 4.84 0.00 1.44 1.52 0.70 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 69 Q 9.18 4.68 0.00 2.10 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.96 0.00 0.00 0.00 0.00 0.00 2.45 2.43 0.00 70 P 0.00 4.57 0.00 1.96 2.01 0.00 3.71 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 2.20 2.38 0.00 71 A 8.55 4.59 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 72 G 9.78 3.98 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 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8.22 4.27 0.00 3.82 3.39 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 87 T 7.81 4.87 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 1.29 0.00 0.00 88 Y 9.31 5.33 0.00 3.01 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 89 S 9.38 5.11 0.00 3.95 4.07 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 90 V 9.06 4.94 2.25 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 1.01 0.00 0.00 1.06 0.00 0.00 91 S 9.30 5.14 0.00 3.88 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 92 V 8.31 3.85 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 0.57 0.00 0.00 0.21 0.00 0.00 93 V 8.47 3.82 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 1.06 0.00 0.00 1.08 0.00 0.00 94 E 7.71 4.93 0.00 2.01 1.74 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 2.43 2.36 0.00 95 T 8.66 4.11 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 0.51 0.00 0.00 96 D 7.12 4.64 0.00 2.83 2.72 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 97 Y 7.90 4.48 0.00 3.27 3.40 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 98 D 8.08 4.83 0.00 2.77 2.79 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 99 Q 8.42 4.71 0.00 2.66 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.78 0.00 0.00 0.00 0.00 0.00 2.43 2.43 0.00 100 Y 8.82 5.87 0.00 3.18 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 0.00 101 A 9.39 4.67 0.81 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 0.00 102 L 9.29 5.09 0.00 1.27 1.14 0.76 0.74 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.44 0.00 0.00 120 L 7.75 4.63 0.00 0.28 0.62 0.97 1.15 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 0.00 121 Y 8.89 5.27 0.00 2.51 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 0.00 122 S 9.44 5.58 0.00 4.04 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 0.00 123 R 9.46 4.38 0.00 1.71 1.85 0.00 2.61 0.00 0.00 2.25 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.48 0.00 124 T 7.57 4.66 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 1.23 0.00 0.00 125 Q 7.91 3.21 0.00 0.93 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.97 0.00 0.00 0.00 0.00 0.00 2.12 2.06 0.00 126 T 7.33 4.33 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 1.11 0.00 0.00 127 P 0.00 4.49 0.00 2.21 2.14 0.00 3.72 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 136 T 8.33 3.68 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 1.22 0.00 0.00 137 A 8.30 3.97 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 F 8.33 4.13 0.00 3.15 3.22 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 0.00 139 C 8.13 3.97 0.00 2.76 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 0.00 140 K 8.17 3.91 0.00 1.89 1.81 0.00 1.65 0.00 0.00 1.64 0.00 0.00 3.14 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.43 1.55 7.81 141 A 7.77 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 0.00 142 Q 7.29 4.07 0.00 1.97 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 5.87 0.00 0.00 0.00 0.00 0.00 1.36 1.45 0.00 143 G 7.56 3.73 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 0.00 0.00 0.00 144 F 7.64 4.34 0.00 3.10 2.85 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 0.00 145 T 8.34 4.21 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 0.00 146 E 8.81 3.98 0.00 2.05 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 0.00 2.40 2.34 0.00 147 D 8.08 4.45 0.00 2.67 2.74 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 0.00 148 T 7.94 4.16 4.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 149 I 7.25 4.34 1.87 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.65 0.63 0.00 0.00 150 V 8.61 4.47 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 0.68 0.00 0.00 0.86 0.00 0.00 151 F 8.54 5.14 0.00 2.91 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 0.00 152 L 8.35 4.33 0.00 1.54 1.57 0.86 0.97 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 0.00 153 P 0.00 4.37 0.00 2.12 2.20 0.00 3.64 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 2.22 2.00 0.00 154 Q 8.69 5.23 0.00 1.92 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.78 0.00 0.00 0.00 0.00 0.00 2.44 2.25 0.00 155 T 8.73 4.74 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 1.29 0.00 0.00 156 D 8.84 4.61 0.00 2.71 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 0.00 157 K 7.84 4.21 0.00 1.86 1.74 0.00 1.77 0.00 0.00 1.65 0.00 0.00 2.88 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.46 1.42 7.81 158 C 8.71 4.20 0.00 3.14 3.20 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 0.00 0.00 0.00 159 M 7.51 4.20 0.00 1.81 2.14 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.63 0.00 * Residues marked with a * may have inaccurate shift predictions.