NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 29 S 4.3620 8.1776 115.4194 59.1780 64.2776 174.9387 30 E 3.8858 9.6526 118.1064 56.6375 29.6066 172.4262 31 Y 4.8762 8.0094 118.3518 57.8339 47.0582 177.5027 32 Q 3.9400 8.4041 120.3177 59.0162 29.1666 177.9800 33 L 3.9413 7.8174 119.6732 57.6005 41.7040 179.3673 34 V 3.4008 7.5545 117.6189 66.1570 31.5475 178.1869 35 V 3.5894 7.7029 118.0757 65.9223 31.2476 177.7384 36 N 4.3497 8.3898 116.3313 55.7587 38.2525 177.4128 37 A 4.0946 7.9510 122.4457 55.1499 18.5633 179.5913 38 V 3.7609 8.2232 117.2512 66.4223 31.5663 178.1549 39 R 4.0438 8.1877 117.6259 59.5840 29.7788 179.2381 40 K 3.9877 7.9105 116.6206 59.2032 32.4154 178.9493 41 L 3.9506 8.2111 120.8174 58.3250 41.7971 179.0077 42 Q 3.7553 8.0001 116.8610 58.9723 28.2894 178.4085 43 E 4.1874 8.3902 118.5956 58.0441 29.4025 178.9876 44 S 4.1877 7.6540 113.9895 59.5359 63.2130 175.4630 45 G 3.8252 7.5435 110.7179 45.2187 0.0000 174.3386 46 F 4.6883 7.6305 117.7528 59.7920 40.2234 174.8010 47 Y 5.1397 8.0829 120.0710 56.4720 39.7522 175.0001 48 W 4.2429 8.9794 127.1498 54.5422 30.1646 175.5882 49 S 3.8488 7.9330 119.3812 58.5601 62.8217 173.3322 50 A 3.8049 8.5116 125.1377 53.4942 15.8571 177.7375 51 V 4.5151 7.2289 115.8058 61.6896 34.2696 175.9389 52 T 4.5178 9.1295 118.9519 60.3823 71.6792 175.9308 53 G 3.7278 8.5764 106.8889 48.0375 0.0000 175.9330 54 G 3.6273 8.0213 107.8231 47.5970 0.0000 175.5255 55 E 3.9965 8.2296 120.6649 58.7623 29.4269 179.1833 56 A 3.7983 8.1521 121.1175 55.1563 18.4642 179.0219 57 N 4.1677 7.9212 114.8425 56.6821 38.4617 177.3284 58 L 3.9358 7.3938 117.7963 58.0832 41.8861 179.4786 59 L 3.9775 7.9839 117.4910 57.1039 41.7733 178.7084 60 L 4.3480 7.8405 117.0998 54.5735 41.9574 178.2973 61 S 3.9222 7.7368 113.8700 61.2466 62.1836 174.9804 62 A 4.5504 7.8445 118.5367 51.8295 18.9749 176.1945 63 E 4.5583 7.5955 117.2956 54.6003 31.3456 174.6614 64 P 4.3967 0.0000 0.0000 62.1090 32.1687 175.6970 65 A 4.2553 8.2799 122.5841 54.1259 18.8229 178.3430 66 G 4.3597 10.0342 110.5819 46.1073 0.0000 173.4420 67 T 5.3133 8.0082 117.6246 63.0147 69.6464 173.7737 68 F 5.5694 8.1810 119.4448 55.6197 42.1060 172.7926 69 L 5.0121 9.0960 118.5330 54.7685 44.2876 174.3680 70 I 5.2372 9.0807 121.0147 59.8745 40.2133 175.0933 71 R 5.1744 9.0648 121.3596 54.7274 33.6776 173.6052 72 D 5.2754 8.8332 119.0554 54.4945 41.4141 176.6656 73 S 4.6037 8.9002 118.7421 58.1080 62.9968 174.2365 74 S 4.4808 8.7492 119.3957 58.7038 63.4363 173.8780 75 D 4.5749 8.0507 122.2680 53.7913 41.7636 176.6223 76 Q 4.0363 8.8564 126.3634 58.9890 29.1486 177.4468 77 R 4.6252 8.2615 113.9666 55.9101 30.3401 175.4657 78 H 4.9764 7.7576 113.2301 54.2117 32.7281 173.6605 79 F 4.3625 8.9576 122.4215 60.0740 39.8369 175.4387 80 F 5.8603 8.1610 115.5194 56.1076 43.4573 174.0289 81 T 5.0735 9.3663 117.3705 61.8399 72.9332 172.6660 82 L 4.8347 9.0848 128.3146 54.2352 43.8433 175.1771 83 S 5.3964 9.2171 123.1040 56.6870 65.7166 173.4810 84 V 4.8155 8.7540 124.2717 59.5205 34.2608 174.7076 85 K 4.5282 9.3236 127.4246 56.7008 32.9535 176.2142 86 T 4.6739 8.6440 119.3044 59.6406 71.1603 175.6405 87 Q 4.0403 8.8325 119.3043 58.8917 28.2340 177.8218 88 S 4.5800 7.9418 112.8513 58.1515 63.3842 173.7783 89 G 3.8106 7.9234 107.3868 44.2543 0.0000 173.1607 90 T 4.5435 8.1263 115.4666 63.5097 68.7380 174.8268 91 K 4.7579 9.3420 125.9727 54.6169 35.8298 174.8499 92 N 5.4396 8.6129 118.6281 51.5394 41.9842 173.9673 93 L 4.6507 9.0536 123.3233 52.5707 45.0031 176.3213 94 R 4.2861 8.6052 123.6054 56.5495 31.3271 175.8254 95 I 4.7813 8.5269 124.1183 60.5134 39.0035 175.6647 96 Q 4.5874 9.3971 126.8412 54.2691 32.3669 174.0150 *98 E 3.7486 8.5198 117.7485 57.7954 30.3940 176.7899 99 G 3.7941 9.4376 110.5233 46.0490 0.0000 174.2140 100 G 3.7248 8.1547 105.4118 45.2696 0.0000 173.6444 101 S 4.8028 7.3835 113.9891 56.4603 65.8322 173.6208 102 F 5.2968 9.4336 121.8890 56.6255 41.0529 175.1458 103 S 5.1681 9.0940 115.5819 57.2687 66.7535 172.9463 104 L 4.7580 8.4744 121.0308 53.6720 42.6033 176.5835 105 Q 4.2271 8.4901 124.4411 56.1522 29.4155 175.9446 106 S 4.7467 8.4868 120.1209 55.9684 64.9035 172.8798 107 D 4.5105 8.5553 127.0497 53.3699 41.5259 175.2343 108 P 4.3193 0.0000 0.0000 65.3542 31.3635 177.2759 109 R 4.1798 8.5256 117.1947 56.9152 30.1879 176.9826 110 S 4.2448 7.9045 115.4419 59.5231 63.1786 174.6991 111 T 4.2959 8.5545 113.4847 62.3571 69.5317 174.5766 112 Q 4.7371 7.6688 120.5909 52.9476 31.3710 173.3978 113 P 4.3996 0.0000 0.0000 62.3509 31.9691 176.2437 114 V 3.6782 8.0848 119.7754 61.8700 31.7715 174.1356 115 P 4.2109 0.0000 0.0000 62.6787 31.8651 175.7186 116 R 4.6660 7.5252 118.7343 54.3935 33.9538 174.8004 117 F 4.9530 8.6146 117.6328 56.2354 42.8954 174.8387 118 D 4.9128 8.8889 123.9296 53.9117 39.6108 177.6639 *120 V 3.7363 7.7447 121.4953 62.0829 33.5051 177.2774 121 L 4.1518 7.9244 121.7729 58.0121 41.9198 178.9333 122 K 3.9446 7.9468 118.0384 59.1590 31.9040 178.5660 123 L 2.4400 7.4784 118.9022 57.8014 42.1063 178.6637 124 V 3.3714 7.6328 117.9533 66.2973 31.4677 177.2715 125 H 4.0647 8.1585 117.7749 59.7797 29.3386 176.5943 126 H 4.0232 7.6916 118.9772 58.3783 29.7507 175.2019 127 Y 4.6621 7.4963 117.0817 58.1217 38.1976 175.3159 128 M 4.7097 7.5891 120.6661 52.2094 31.3451 173.9765 129 P 4.4227 0.0000 0.0000 61.0152 32.9322 175.5431 130 P 4.4256 0.0000 0.0000 62.9662 32.0210 176.7468 131 Q 4.0698 8.1367 121.4203 54.3399 27.3878 173.1093 *141 A 3.7012 7.7794 121.7272 51.4609 20.1259 175.8778 142 Y 4.9184 7.7873 119.1725 56.4099 41.8982 173.9748 143 Y 5.3099 8.6030 116.7187 56.4160 42.3310 174.9381 144 I 4.6398 9.0254 114.6881 59.3294 40.8992 174.5386 145 Y 4.1866 8.5670 122.3923 57.2315 37.9026 175.5886 *150 K 3.7656 8.3217 125.9847 56.0562 32.2068 173.2597 151 I 4.6420 8.2999 125.9782 57.7981 40.2011 172.7050 152 P 4.2792 0.0000 0.0000 63.5207 31.6088 175.1554 153 L 4.3976 8.4438 126.4105 53.8818 43.1146 175.9801 154 V 4.3266 8.0911 125.9570 61.2674 34.2053 174.0418 155 L 4.8638 8.9580 129.0659 54.3290 42.9878 177.2316 156 S 4.6171 9.6873 115.5329 59.5341 66.1439 174.1526 157 R 4.9236 7.9751 116.6063 53.0885 32.5697 172.6866 158 P 3.6910 0.0000 0.0000 62.0992 32.2467 175.7625 159 L 4.1793 8.3841 125.4507 55.2544 42.4559 176.4480 160 S 4.8734 8.5440 120.2797 56.4452 65.1841 173.9021 161 S 4.4394 8.2146 116.3088 59.0911 63.0040 173.8181 162 N 4.5042 8.9489 120.7544 53.7175 37.8691 174.6110 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 29 S 8.18 4.36 0.00 4.03 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 30 E 9.65 3.89 0.00 2.38 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 0.00 2.20 2.44 0.00 31 Y 8.01 4.88 0.00 3.07 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 Q 8.40 3.94 0.00 2.29 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.69 0.00 0.00 0.00 0.00 0.00 2.45 2.52 0.00 33 L 7.82 3.94 0.00 1.69 1.64 0.90 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 34 V 7.55 3.40 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 0.99 0.00 0.00 0.82 0.00 0.00 35 V 7.70 3.59 1.71 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 0.95 0.00 0.00 0.18 0.00 0.00 36 N 8.39 4.35 0.00 2.90 2.86 0.00 0.00 6.82 7.08 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 37 A 7.95 4.09 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 38 V 8.22 3.76 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 1.17 0.00 0.00 1.30 0.00 0.00 39 R 8.19 4.04 0.00 2.15 1.98 0.00 3.19 0.00 0.00 3.17 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.78 0.00 40 K 7.91 3.99 0.00 1.88 1.92 0.00 1.62 0.00 0.00 1.89 0.00 0.00 3.11 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.53 1.52 7.81 41 L 8.21 3.95 0.00 1.70 1.63 0.37 -0.52 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 42 Q 8.00 3.76 0.00 2.15 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.75 0.00 0.00 0.00 0.00 0.00 2.07 2.28 0.00 43 E 8.39 4.19 0.00 2.15 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 0.00 2.32 2.52 0.00 44 S 7.65 4.19 0.00 4.00 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 G 7.54 3.83 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 0.00 0.00 0.00 46 F 7.63 4.69 0.00 3.12 3.15 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 47 Y 8.08 5.14 0.00 2.98 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 48 W 8.98 4.24 0.00 2.95 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 49 S 7.93 3.85 0.00 3.85 3.63 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 50 A 8.51 3.80 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 51 V 7.23 4.52 2.31 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 0.81 0.00 0.00 1.15 0.00 0.00 52 T 9.13 4.52 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 1.27 0.00 0.00 53 G 8.58 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 54 G 8.02 3.63 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 0.00 0.00 0.00 55 E 8.23 4.00 0.00 2.26 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.32 0.00 56 A 8.15 3.80 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 57 N 7.92 4.17 0.00 2.98 2.88 0.00 0.00 7.08 6.73 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 58 L 7.39 3.94 0.00 1.82 1.69 0.90 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 59 L 7.98 3.98 0.00 1.42 1.34 0.51 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 60 L 7.84 4.35 0.00 1.68 1.63 0.85 0.52 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 61 S 7.74 3.92 0.00 3.87 4.09 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 62 A 7.84 4.55 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 63 E 7.60 4.56 0.00 2.07 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 2.23 2.29 0.00 64 P 0.00 4.40 0.00 2.22 2.18 0.00 3.69 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 2.07 1.96 0.00 65 A 8.28 4.26 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 G 10.03 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 0.00 0.00 0.00 0.00 67 T 8.01 5.31 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 1.15 0.00 0.00 68 F 8.18 5.57 0.00 3.16 3.06 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 69 L 9.10 5.01 0.00 1.56 1.41 0.81 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 70 I 9.08 5.24 2.08 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.85 1.00 0.00 0.00 71 R 9.06 5.17 0.00 2.04 2.06 0.00 2.97 0.00 0.00 3.17 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.72 0.00 72 D 8.83 5.28 0.00 2.70 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 S 8.90 4.60 0.00 3.97 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 74 S 8.75 4.48 0.00 4.03 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 75 D 8.05 4.57 0.00 2.76 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 76 Q 8.86 4.04 0.00 2.07 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 7.15 0.00 0.00 0.00 0.00 0.00 2.36 2.41 0.00 77 R 8.26 4.63 0.00 1.80 1.83 0.00 3.14 0.00 0.00 3.21 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.58 0.00 78 H 7.76 4.98 0.00 3.18 3.21 0.00 5.65 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 F 8.96 4.36 0.00 2.46 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 0.00 0.00 0.00 0.00 80 F 8.16 5.86 0.00 3.22 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 81 T 9.37 5.07 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 1.30 0.00 0.00 82 L 9.08 4.83 0.00 1.68 1.64 0.86 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 83 S 9.22 5.40 0.00 3.73 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 84 V 8.75 4.82 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 0.78 0.00 0.00 0.94 0.00 0.00 85 K 9.32 4.53 0.00 1.86 1.76 0.00 1.49 0.00 0.00 1.86 0.00 0.00 2.98 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.63 1.43 7.81 86 T 8.64 4.67 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 1.20 0.00 0.00 87 Q 8.83 4.04 0.00 2.19 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 7.51 0.00 0.00 0.00 0.00 0.00 2.35 2.42 0.00 88 S 7.94 4.58 0.00 3.87 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 G 7.92 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 90 T 8.13 4.54 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 1.24 0.00 0.00 91 K 9.34 4.76 0.00 1.57 1.66 0.00 1.62 0.00 0.00 1.65 0.00 0.00 3.05 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.51 1.52 7.81 92 N 8.61 5.44 0.00 2.55 2.68 0.00 0.00 6.73 7.85 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 93 L 9.05 4.65 0.00 1.40 1.45 0.79 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 94 R 8.61 4.29 0.00 1.78 1.54 0.00 2.88 0.00 0.00 3.01 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.59 0.00 95 I 8.53 4.78 2.28 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 1.29 0.62 1.30 0.00 0.00 96 Q 9.40 4.59 0.00 2.00 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.57 0.00 0.00 0.00 0.00 0.00 2.40 2.40 0.00 *98 E 8.52 3.75 0.00 2.04 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 2.25 2.31 0.00 99 G 9.44 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 0.00 100 G 8.15 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 S 7.38 4.80 0.00 3.66 3.80 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 0.00 102 F 9.43 5.30 0.00 3.16 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 0.00 103 S 9.09 5.17 0.00 3.93 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 0.00 104 L 8.47 4.76 0.00 1.37 1.45 -0.03 0.73 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 0.00 105 Q 8.49 4.23 0.00 2.18 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.57 6.60 0.00 0.00 0.00 0.00 0.00 2.39 2.20 0.00 106 S 8.49 4.75 0.00 3.84 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 0.00 107 D 8.56 4.51 0.00 2.81 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 0.00 108 P 0.00 4.32 0.00 2.22 2.18 0.00 3.82 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.99 0.00 109 R 8.53 4.18 0.00 2.01 2.08 0.00 3.11 0.00 0.00 3.11 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.57 0.00 110 S 7.90 4.24 0.00 3.89 3.99 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 0.00 111 T 8.55 4.30 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 1.26 0.00 0.00 112 Q 7.67 4.74 0.00 2.11 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 7.07 0.00 0.00 0.00 0.00 0.00 2.36 2.36 0.00 113 P 0.00 4.40 0.00 2.15 2.05 0.00 3.78 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 1.98 1.95 0.00 114 V 8.08 3.68 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 0.93 0.00 0.00 115 P 0.00 4.21 0.00 1.86 1.86 0.00 3.71 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.87 0.00 116 R 7.53 4.67 0.00 1.57 1.72 0.00 3.11 0.00 0.00 3.16 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.57 0.00 117 F 8.61 4.95 0.00 3.21 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 0.00 118 D 8.89 4.91 0.00 2.84 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 *120 V 7.74 3.74 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.51 0.00 0.00 121 L 7.92 4.15 0.00 1.87 1.76 1.13 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 122 K 7.95 3.94 0.00 1.94 1.98 0.00 2.00 0.00 0.00 1.89 0.00 0.00 2.95 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.59 1.54 7.81 123 L 7.48 2.44 0.00 1.38 1.62 0.90 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 124 V 7.63 3.37 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 0.82 0.00 0.00 0.20 0.00 0.00 125 H 8.16 4.06 0.00 3.27 3.40 0.00 5.64 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 0.00 126 H 7.69 4.02 0.00 2.96 2.87 0.00 5.98 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 Y 7.50 4.66 0.00 2.87 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 0.00 128 M 7.59 4.71 0.00 1.98 2.05 0.00 0.00 0.00 0.00 0.00 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.58 0.00 129 P 0.00 4.42 0.00 2.07 1.88 0.00 3.73 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.80 0.00 130 P 0.00 4.43 0.00 2.18 2.07 0.00 3.67 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.91 0.00 131 Q 8.14 4.07 0.00 2.02 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.53 0.00 0.00 0.00 0.00 0.00 2.29 2.34 0.00 *141 A 7.78 3.70 1.04 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 0.00 142 Y 7.79 4.92 0.00 3.04 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 0.00 143 Y 8.60 5.31 0.00 2.73 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 I 9.03 4.64 1.91 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 1.50 0.73 0.91 0.00 0.00 145 Y 8.57 4.19 0.00 3.01 2.96 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 *150 K 8.32 3.77 0.00 1.24 1.55 0.00 1.30 0.00 0.00 0.61 0.00 0.00 2.92 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.94 1.16 7.81 151 I 8.30 4.64 1.90 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.31 0.92 0.00 0.00 152 P 0.00 4.28 0.00 2.06 2.08 0.00 3.92 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.13 0.00 153 L 8.44 4.40 0.00 1.56 1.62 0.81 0.61 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 0.00 154 V 8.09 4.33 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 0.94 0.00 0.00 0.85 0.00 0.00 155 L 8.96 4.86 0.00 1.37 1.03 0.05 0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 156 S 9.69 4.62 0.00 3.85 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 0.00 157 R 7.98 4.92 0.00 1.83 2.06 0.00 3.18 0.00 0.00 3.40 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.56 0.00 158 P 0.00 3.69 0.00 2.08 2.28 0.00 3.82 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 1.98 2.13 0.00 159 L 8.38 4.18 0.00 1.43 1.45 0.83 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 160 S 8.54 4.87 0.00 4.03 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 0.00 161 S 8.21 4.44 0.00 3.76 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 0.00 162 N 8.95 4.50 0.00 2.81 3.10 0.00 0.00 6.80 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.