NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- *8 Q 4.3591 8.3293 119.1239 53.8410 31.1663 174.6993 9 V 4.1076 7.1623 115.5657 60.8719 33.8363 171.6298 10 E 3.6581 9.5683 123.6816 56.5721 28.7751 175.7222 11 A 4.0764 7.6668 120.4193 52.2744 18.9781 178.0328 12 I 3.8056 7.7652 112.6840 62.1874 40.7326 174.5894 13 K 4.2958 8.9914 119.3952 56.9418 32.5569 176.7727 14 R 5.3128 8.5476 120.6951 53.4377 33.0657 176.3062 15 G 5.2768 7.4592 123.5636 45.5332 0.0000 171.5255 16 T 3.8708 5.9833 121.9888 62.2032 68.7803 172.4854 17 V 4.5675 8.5866 126.6598 61.2125 34.6795 174.5071 18 I 4.4704 7.9197 128.5221 60.6753 36.9209 174.7610 19 D 4.8769 8.3106 128.9900 53.5553 44.1553 175.4828 20 H 4.1167 8.3269 112.2985 57.4356 26.4175 174.8721 21 I 4.4052 7.2148 119.3252 58.9626 39.3136 174.4130 22 P 4.2212 0.0000 0.0000 62.3974 31.6979 174.8234 23 A 3.9949 8.5506 124.5580 53.6283 17.9033 177.1566 24 Q 3.7658 9.2996 122.4690 58.5464 26.7331 175.9400 25 I 4.2757 7.6916 120.0257 62.8531 38.0837 177.5059 26 G 3.8624 8.2141 106.3677 47.9635 0.0000 174.8842 27 F 3.9945 8.5706 122.1716 61.3957 39.1107 177.4544 28 K 4.2959 8.4698 118.0620 59.2838 31.1135 178.9549 29 L 4.4404 8.1815 118.2605 56.7517 41.8670 178.5989 30 L 4.7543 7.9411 116.5257 54.6540 44.8239 178.0313 31 S 4.4249 8.0662 111.5273 59.7592 63.8112 175.6509 32 L 3.9988 8.4332 121.0892 57.7661 41.7867 177.5639 33 F 4.4633 8.1695 113.6905 57.0168 40.1469 175.7791 34 K 4.6769 6.9364 116.9652 56.7195 29.6369 174.3217 35 L 4.5461 7.5728 115.8899 55.4181 43.2459 179.2686 36 T 4.3023 7.8462 107.3140 62.0586 68.7302 174.7857 37 E 4.7410 8.0436 117.7814 56.4653 29.6317 174.7158 38 T 4.7013 7.3581 111.8150 60.6868 71.2880 172.5515 39 D 4.8129 8.6379 122.0975 54.1285 41.4064 175.9909 40 Q 4.6302 7.3540 119.1487 53.7387 31.7309 175.1278 41 R 4.0096 8.2987 120.0919 56.9941 31.0605 176.4762 42 I 5.6647 7.7081 117.3185 60.9932 38.1464 172.6934 43 T 4.3476 7.7970 123.5552 63.2928 70.2611 175.3528 44 I 4.5916 7.5272 127.6409 59.2975 39.7682 176.4062 45 G 4.5126 7.7186 105.9397 46.5550 0.0000 173.0520 46 L 4.6112 8.1501 124.7356 55.9011 42.2787 176.6459 47 N 4.2369 8.6079 113.4112 54.4118 36.4816 174.8080 48 L 4.5346 7.3145 116.7643 52.6723 43.2116 175.1625 49 P 4.5108 0.0000 0.0000 63.0055 31.9132 176.0503 50 S 4.6828 8.2324 114.1101 56.9659 66.0651 174.0433 51 G 4.1482 8.4093 109.6509 45.6268 0.0000 173.9198 52 E 4.4505 7.3931 116.2925 56.2344 32.9251 176.1600 53 M 4.5352 7.8260 127.2333 55.3767 36.2214 175.8125 54 G 3.9044 8.5953 115.5817 46.6781 0.0000 172.1920 55 R 4.9084 8.2134 122.1519 54.7711 31.9428 173.0825 56 K 4.8763 7.7919 115.0246 58.5602 35.8921 173.8915 57 D 4.8650 8.3407 117.5445 53.6524 44.4586 175.1909 58 L 5.1685 8.3480 121.3182 52.8230 42.9103 175.2223 59 I 4.6438 8.2290 120.8972 59.5130 40.5831 174.3762 60 K 4.5454 8.5179 126.2374 55.1623 33.6734 175.4353 61 I 5.3567 7.6475 123.8044 58.6497 39.8684 174.2926 62 E 4.6582 8.5286 127.4386 55.3508 31.7441 176.1453 63 N 4.5910 9.8676 122.9883 53.9896 37.3893 174.1031 64 T 4.9249 7.3635 112.8693 62.1066 73.2241 173.1760 65 F 5.0552 8.5308 122.4654 56.7266 41.9809 174.2956 66 L 4.6855 8.5590 128.2670 55.9014 42.7538 174.1616 67 S 4.2407 7.9497 121.9234 59.4725 66.3240 173.8634 68 E 4.4513 8.4618 114.6144 57.3824 31.7241 176.9601 69 D 4.3126 7.9211 117.7205 55.3892 38.9638 177.5196 70 Q 4.1846 7.5772 118.0147 56.5065 29.5493 177.5199 71 V 3.9085 8.7158 118.7254 65.1696 31.4425 177.5963 72 D 5.1903 7.6858 119.6595 57.0168 40.6730 178.4593 73 Q 4.2354 7.9557 117.0534 58.1268 28.9952 177.9370 74 L 4.1167 7.5522 118.7249 56.2978 42.2864 178.7249 75 A 3.8156 8.3900 110.4167 54.7237 17.7046 179.1026 76 L 4.0287 9.5129 124.5628 58.3031 41.1228 179.0329 77 Y 4.0915 7.9494 119.4397 60.1991 38.6635 176.1227 78 A 4.6229 8.6562 121.6438 50.4763 22.8018 175.0500 79 P 4.1261 0.0000 0.0000 65.9560 31.6163 177.6746 80 Q 4.0481 8.0278 113.7372 55.4737 29.0161 174.2684 81 A 4.0703 7.1664 121.3297 53.4486 18.7654 177.7288 82 T 4.5370 7.8105 120.1068 61.6690 68.5897 173.0757 83 V 3.7099 7.9949 123.7826 62.1562 32.9177 175.4683 84 N 4.9145 9.5431 124.8220 51.8678 39.2160 174.4792 85 R 4.6747 8.4375 123.6124 55.5524 31.0421 175.8745 86 I 5.2152 8.1451 126.1143 58.7557 38.5798 176.3335 87 D 4.9084 8.5573 131.2183 53.2445 39.4076 174.0549 88 N 4.1740 9.4718 122.7073 54.3633 37.3202 174.2787 89 Y 3.4958 8.4336 117.4004 57.9150 37.6680 169.7204 90 E 4.5407 8.0056 121.3393 53.8505 30.6423 175.0298 91 V 4.1944 8.3657 127.0844 63.0133 32.1313 174.0676 92 V 4.2200 8.7500 125.9594 64.5238 33.8811 176.6904 93 G 3.9780 7.7010 109.7246 44.5530 0.0000 173.9568 94 K 5.4150 7.5122 117.9228 55.9392 32.6890 178.0501 95 S 4.1537 7.8624 113.9548 58.7635 63.7643 174.1157 96 R 4.6479 8.1373 122.5466 53.8381 31.6592 173.8554 97 P 4.5643 0.0000 0.0000 63.6252 32.3587 175.0105 98 S 4.8798 8.7096 121.2443 56.3891 66.7170 173.3321 99 L 4.9571 8.5280 124.9506 52.8215 42.0150 174.6449 100 P 4.4308 0.0000 0.0000 62.5701 31.7069 176.0219 101 E 4.0617 8.7587 117.4881 59.4519 29.6455 177.7412 102 R 4.2242 7.7800 118.4395 55.8478 30.9035 175.5367 103 I 4.5810 8.3802 125.2848 59.8087 39.7189 174.1309 104 D 5.0411 8.5952 126.2847 51.4603 43.8643 175.0463 105 N 5.0024 7.6700 121.0290 53.3973 36.8395 175.1014 106 V 4.3553 8.1075 123.3357 62.0356 34.0791 171.2395 107 L 4.4373 7.7181 120.6700 54.3832 45.6919 175.3168 108 V 4.1617 7.6703 116.8509 58.9088 31.0991 174.7823 109 C 3.9592 7.8580 122.9247 58.7135 32.1572 171.7346 110 P 4.4868 0.0000 0.0000 63.3359 32.2830 176.1191 111 N 4.5798 7.7849 120.1488 51.7386 37.1688 175.2056 112 S 3.6597 7.9100 116.2312 60.5479 63.8901 176.0599 113 N 4.2900 8.1064 118.7273 56.5279 38.8809 174.0243 114 C 4.2837 8.3010 123.4106 56.6428 41.0100 173.9337 115 I 3.4054 8.3858 127.5299 62.7939 38.0778 177.4922 116 S 4.4346 8.6837 113.5401 59.7542 61.9497 174.2710 117 H 4.5446 8.6674 116.2220 58.2777 30.3752 175.6011 118 A 4.3370 7.8680 119.3371 52.5259 19.0686 176.6694 119 E 4.6247 7.6944 115.4641 53.1675 31.9899 173.8977 120 P 4.2343 0.0000 0.0000 63.5130 32.2047 175.4003 121 V 4.1487 7.9119 119.3222 60.4766 33.6892 176.2582 122 S 4.3397 8.2771 119.7542 57.6054 65.5093 173.4087 123 S 4.3494 8.7280 120.9485 58.6450 60.9144 172.2549 124 S 5.2792 8.5631 119.7951 54.9193 66.5371 172.2055 125 F 5.5713 8.9311 125.8282 57.7221 40.1417 172.5128 126 A 4.7467 8.8250 120.8229 51.7084 22.2058 175.6289 127 V 4.6251 7.5646 104.8482 61.6386 33.7709 172.9703 128 R 4.1284 8.2004 124.3247 54.1371 28.2352 173.8702 129 K 3.8201 8.1547 118.2375 56.6470 32.5722 176.4443 130 R 4.7313 8.2412 121.5152 53.8465 33.6160 177.0529 131 A 4.6143 8.4324 121.0377 52.5316 18.6451 178.0986 132 N 4.9743 8.5722 125.3785 55.2588 38.6918 176.9296 133 D 4.8764 8.7508 116.6208 51.9080 40.9862 174.9098 134 I 4.0564 7.8717 117.4246 61.2212 37.3513 176.1184 135 A 4.6986 7.1997 122.5302 52.9661 19.2019 177.9062 136 L 4.4502 8.0588 116.0394 55.7793 43.2065 175.3966 137 K 3.8426 8.5581 126.0405 55.7659 33.7202 175.5284 138 C 2.4500 8.2191 126.8668 59.3516 32.1540 174.3241 139 K 3.9363 8.8875 125.9173 58.8144 32.3694 177.2479 140 Y 4.3037 8.1941 113.3089 58.9633 38.6115 176.4806 141 C 4.8956 7.9738 114.8412 55.5176 42.1509 173.4846 142 E 4.1534 8.1540 117.2438 55.3580 28.1221 174.3105 143 K 3.7847 7.6957 117.0760 55.3129 31.5401 175.9715 144 E 4.1185 8.0948 126.5380 55.8780 29.5989 175.1790 145 F 5.3923 8.3864 130.6263 56.5812 43.2293 174.7045 146 S 4.9152 8.8242 116.6666 58.1645 65.2992 175.2426 147 H 4.0661 9.4933 121.3528 58.6244 28.4660 176.4240 148 N 4.2450 8.0038 116.5395 56.6269 38.6974 176.2254 149 V 3.6903 8.2644 117.0435 65.9333 32.1006 178.2014 150 V 3.5080 7.9635 117.8728 66.0630 31.1872 177.0592 151 L 4.1515 8.6419 118.0049 56.2725 41.9230 177.4752 152 A 4.1593 7.6409 121.4410 51.5301 18.9388 177.1418 153 N 4.4730 8.5636 115.8064 53.7481 38.5485 175.4303 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 *8 Q 8.33 4.36 0.00 2.09 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.65 0.00 0.00 0.00 0.00 0.00 2.18 1.93 0.00 9 V 7.16 4.11 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 0.63 0.00 0.00 0.92 0.00 0.00 10 E 9.57 3.66 0.00 2.07 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 2.20 2.20 0.00 11 A 7.67 4.08 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 I 7.77 3.81 1.76 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 1.07 0.80 0.00 0.00 13 K 8.99 4.30 0.00 1.79 1.76 0.00 1.72 0.00 0.00 1.91 0.00 0.00 2.94 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.99 1.63 7.81 14 R 8.55 5.31 0.00 1.90 2.23 0.00 3.66 0.00 0.00 3.33 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.59 0.00 15 G 7.46 5.28 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 0.00 16 T 5.98 3.87 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 1.13 0.00 0.00 17 V 8.59 4.57 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 0.84 0.00 0.00 18 I 7.92 4.47 1.86 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.74 0.91 0.00 0.00 19 D 8.31 4.88 0.00 2.84 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 20 H 8.33 4.12 0.00 3.22 3.30 0.00 5.88 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 I 7.21 4.41 2.00 0.00 0.00 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 1.63 1.81 1.00 0.00 0.00 22 P 0.00 4.22 0.00 2.14 1.97 0.00 3.64 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.11 0.00 23 A 8.55 3.99 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 24 Q 9.30 3.77 0.00 2.23 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.73 6.75 0.00 0.00 0.00 0.00 0.00 2.47 2.34 0.00 25 I 7.69 4.28 1.98 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.83 0.55 0.00 0.00 26 G 8.21 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 27 F 8.57 3.99 0.00 3.15 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 28 K 8.47 4.30 0.00 2.27 2.06 0.00 1.74 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.54 1.54 7.81 29 L 8.18 4.44 0.00 1.97 1.79 1.03 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 30 L 7.94 4.75 0.00 1.68 1.63 0.92 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 31 S 8.07 4.42 0.00 3.96 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 32 L 8.43 4.00 0.00 1.60 1.84 0.80 0.84 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 33 F 8.17 4.46 0.00 3.14 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 34 K 6.94 4.68 0.00 1.96 2.25 0.00 1.68 0.00 0.00 1.99 0.00 0.00 3.04 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.63 1.52 7.81 35 L 7.57 4.55 0.00 1.77 1.67 0.80 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 36 T 7.85 4.30 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 1.17 0.00 0.00 37 E 8.04 4.74 0.00 1.93 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 2.23 2.25 0.00 38 T 7.36 4.70 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 1.26 0.00 0.00 39 D 8.64 4.81 0.00 2.65 2.63 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 7.35 4.63 0.00 1.86 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.82 0.00 0.00 0.00 0.00 0.00 2.30 2.27 0.00 41 R 8.30 4.01 0.00 1.97 1.81 0.00 3.14 0.00 0.00 3.31 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.59 0.00 42 I 7.71 5.66 1.82 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 1.49 0.91 0.86 0.00 0.00 43 T 7.80 4.35 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 1.18 0.00 0.00 44 I 7.53 4.59 1.78 0.00 0.00 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 1.15 1.07 0.89 0.00 0.00 45 G 7.72 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 0.00 0.00 0.00 0.00 46 L 8.15 4.61 0.00 2.04 1.71 1.12 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 47 N 8.61 4.24 0.00 2.94 2.97 0.00 0.00 6.96 8.02 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 48 L 7.31 4.53 0.00 1.65 1.56 0.91 0.99 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 49 P 0.00 4.51 0.00 2.03 1.99 0.00 3.63 0.00 0.00 3.70 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 50 S 8.23 4.68 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 51 G 8.41 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 52 E 7.39 4.45 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 2.18 2.23 0.00 53 M 7.83 4.54 0.00 1.95 1.96 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.54 0.00 54 G 8.60 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 55 R 8.21 4.91 0.00 1.98 1.94 0.00 3.08 0.00 0.00 3.28 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.57 0.00 56 K 7.79 4.88 0.00 1.79 1.93 0.00 1.50 0.00 0.00 1.72 0.00 0.00 2.92 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.30 1.42 7.81 57 D 8.34 4.86 0.00 2.56 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 58 L 8.35 5.17 0.00 1.77 1.69 0.88 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 59 I 8.23 4.64 1.82 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.79 0.85 0.00 0.00 60 K 8.52 4.55 0.00 1.90 1.66 0.00 1.56 0.00 0.00 1.56 0.00 0.00 2.80 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.31 1.48 7.81 61 I 7.65 5.36 1.84 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 1.00 1.28 0.82 0.00 0.00 62 E 8.53 4.66 0.00 1.96 1.84 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 2.25 2.27 0.00 63 N 9.87 4.59 0.00 2.88 2.98 0.00 0.00 6.81 7.78 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 64 T 7.36 4.92 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 1.25 0.00 0.00 65 F 8.53 5.06 0.00 2.89 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 66 L 8.56 4.69 0.00 1.67 1.52 0.88 0.72 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 67 S 7.95 4.24 0.00 3.92 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 68 E 8.46 4.45 0.00 2.02 1.86 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 2.26 2.31 0.00 69 D 7.92 4.31 0.00 2.90 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 70 Q 7.58 4.18 0.00 2.19 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.89 6.76 0.00 0.00 0.00 0.00 0.00 2.05 1.76 0.00 71 V 8.72 3.91 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 1.04 0.00 0.00 0.94 0.00 0.00 72 D 7.69 5.19 0.00 2.91 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 73 Q 7.96 4.24 0.00 2.20 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.96 0.00 0.00 0.00 0.00 0.00 2.51 2.82 0.00 74 L 7.55 4.12 0.00 1.91 1.82 1.01 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 75 A 8.39 3.82 1.30 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 76 L 9.51 4.03 0.00 1.84 1.86 1.21 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 0.00 0.00 0.00 0.00 0.00 0.00 77 Y 7.95 4.09 0.00 3.18 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 78 A 8.66 4.62 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 P 0.00 4.13 0.00 2.21 2.22 0.00 3.80 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 2.02 1.98 0.00 80 Q 8.03 4.05 0.00 2.21 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.01 0.00 0.00 0.00 0.00 0.00 2.62 2.41 0.00 81 A 7.17 4.07 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 82 T 7.81 4.54 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 1.23 0.00 0.00 83 V 7.99 3.71 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 1.05 0.00 0.00 0.98 0.00 0.00 84 N 9.54 4.91 0.00 2.69 2.82 0.00 0.00 6.57 7.74 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 85 R 8.44 4.67 0.00 2.13 2.28 0.00 3.14 0.00 0.00 3.22 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.88 0.00 86 I 8.15 5.22 1.85 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 1.34 1.48 1.01 0.00 0.00 87 D 8.56 4.91 0.00 2.72 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 88 N 9.47 4.17 0.00 3.05 2.97 0.00 0.00 7.24 7.55 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 89 Y 8.43 3.50 0.00 3.03 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 E 8.01 4.54 0.00 2.06 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 0.00 2.24 2.24 0.00 91 V 8.37 4.19 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 0.85 0.00 0.00 0.95 0.00 0.00 92 V 8.75 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 0.84 0.00 0.00 1.10 0.00 0.00 93 G 7.70 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 K 7.51 5.41 0.00 1.77 1.84 0.00 1.86 0.00 0.00 2.37 0.00 0.00 3.00 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.46 1.44 7.81 95 S 7.86 4.15 0.00 3.86 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 96 R 8.14 4.65 0.00 1.79 1.81 0.00 3.29 0.00 0.00 3.27 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.67 0.00 97 P 0.00 4.56 0.00 2.31 2.26 0.00 3.70 0.00 0.00 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.16 0.00 98 S 8.71 4.88 0.00 3.74 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 99 L 8.53 4.96 0.00 1.77 1.89 0.95 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 100 P 0.00 4.43 0.00 2.22 2.13 0.00 3.80 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.09 0.00 101 E 8.76 4.06 0.00 2.10 2.14 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 2.29 2.31 0.00 102 R 7.78 4.22 0.00 1.86 1.88 0.00 3.21 0.00 0.00 3.24 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.68 0.00 103 I 8.38 4.58 2.22 0.00 0.00 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 1.55 1.66 1.05 0.00 0.00 104 D 8.60 5.04 0.00 2.69 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 N 7.67 5.00 0.00 2.82 2.81 0.00 0.00 6.16 7.68 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 0.00 106 V 8.11 4.36 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 0.61 0.00 0.00 0.97 0.00 0.00 107 L 7.72 4.44 0.00 1.56 1.27 0.91 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 108 V 7.67 4.16 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 0.00 0.00 0.92 0.00 0.00 109 C 7.86 3.96 0.00 2.51 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 P 0.00 4.49 0.00 1.93 2.00 0.00 3.75 0.00 0.00 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.75 0.00 111 N 7.78 4.58 0.00 3.00 2.96 0.00 0.00 7.17 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 S 7.91 3.66 0.00 3.80 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 0.00 113 N 8.11 4.29 0.00 2.72 3.08 0.00 0.00 7.07 7.63 0.00 0.00 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 C 8.30 4.28 0.00 3.15 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 0.00 115 I 8.39 3.41 1.89 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.18 0.92 0.00 0.00 116 S 8.68 4.43 0.00 3.66 3.64 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 0.00 117 H 8.67 4.54 0.00 3.04 3.32 0.00 5.84 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 A 7.87 4.34 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 0.00 119 E 7.69 4.62 0.00 1.90 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 2.19 2.22 0.00 120 P 0.00 4.23 0.00 2.01 2.03 0.00 3.60 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.12 0.00 121 V 7.91 4.15 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 0.70 0.00 0.00 0.87 0.00 0.00 122 S 8.28 4.34 0.00 3.74 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 0.00 123 S 8.73 4.35 0.00 3.83 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 0.00 124 S 8.56 5.28 0.00 4.09 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 0.00 125 F 8.93 5.57 0.00 2.85 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 0.00 126 A 8.83 4.75 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 0.00 127 V 7.56 4.63 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 0.76 0.00 0.00 1.01 0.00 0.00 128 R 8.20 4.13 0.00 1.77 1.87 0.00 3.26 0.00 0.00 3.19 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.58 0.00 129 K 8.15 3.82 0.00 1.77 1.81 0.00 1.69 0.00 0.00 1.79 0.00 0.00 3.08 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.46 1.56 7.81 130 R 8.24 4.73 0.00 1.83 1.78 0.00 3.12 0.00 0.00 3.34 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.85 0.00 131 A 8.43 4.61 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 0.00 132 N 8.57 4.97 0.00 2.53 1.87 0.00 0.00 6.99 8.35 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 0.00 133 D 8.75 4.88 0.00 3.00 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 0.00 134 I 7.87 4.06 1.31 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.78 0.87 0.00 0.00 135 A 7.20 4.70 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 0.00 136 L 8.06 4.45 0.00 2.08 1.94 1.39 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 0.00 0.00 0.00 0.00 0.00 0.00 137 K 8.56 3.84 0.00 2.02 1.53 0.00 1.76 0.00 0.00 1.77 0.00 0.00 2.71 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.24 1.15 7.81 138 C 8.22 2.45 0.00 3.03 2.65 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 0.00 139 K 8.89 3.94 0.00 2.04 2.26 0.00 1.80 0.00 0.00 1.75 0.00 0.00 2.46 0.00 0.00 2.72 0.00 0.00 0.00 0.00 0.56 1.17 7.81 140 Y 8.19 4.30 0.00 3.11 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 C 7.97 4.90 0.00 3.11 3.16 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 0.00 142 E 8.15 4.15 0.00 1.92 1.86 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 2.13 2.21 0.00 143 K 7.70 3.78 0.00 1.90 1.11 0.00 1.94 0.00 0.00 1.56 0.00 0.00 3.13 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.70 1.69 7.81 144 E 8.09 4.12 0.00 1.77 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 2.19 2.31 0.00 145 F 8.39 5.39 0.00 3.28 2.95 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 0.00 146 S 8.82 4.92 0.00 4.05 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 0.00 147 H 9.49 4.07 0.00 3.41 3.83 0.00 5.50 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 N 8.00 4.24 0.00 2.70 2.90 0.00 0.00 6.86 7.68 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 0.00 149 V 8.26 3.69 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 0.97 0.00 0.00 0.95 0.00 0.00 150 V 7.96 3.51 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 0.73 0.00 0.00 1.07 0.00 0.00 151 L 8.64 4.15 0.00 1.65 1.72 1.05 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 152 A 7.64 4.16 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 0.00 153 N 8.56 4.47 0.00 2.67 2.72 0.00 0.00 6.79 7.56 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 * Residues marked with a * may have inaccurate shift predictions.