NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 T 4.3044 8.1744 117.3748 63.0312 69.5705 173.3325 3 D 4.3108 8.5655 126.8898 52.5728 41.8494 173.9201 4 Q 4.4311 8.6783 124.5603 54.8897 32.2949 173.0255 5 A 4.4819 8.6289 125.7430 50.9590 19.7866 176.2122 6 T 4.5910 8.2492 113.6261 59.2212 71.1573 172.4326 7 P 4.4818 0.0000 0.0000 62.7797 32.7443 174.4978 8 N 5.1379 8.8155 122.6227 51.9124 39.7375 174.4287 9 L 4.4889 8.3986 123.6678 51.8040 46.2472 173.7441 10 P 3.9459 0.0000 0.0000 61.6417 32.8387 175.1768 11 S 4.7933 8.5026 117.2024 56.9835 64.8442 174.4944 12 R 3.9034 9.5713 127.7736 58.5852 30.4866 176.6364 13 D 5.0079 7.6609 116.3180 52.2058 44.7717 176.7590 14 F 4.3688 8.6435 125.1773 61.0365 39.2101 177.7733 15 D 4.4133 8.2280 118.0061 57.3770 40.3939 178.7186 16 S 4.1015 7.7812 114.7151 62.0782 63.3603 176.8316 17 T 3.9019 7.9110 117.6934 66.5280 68.1610 176.6142 18 A 4.0408 7.9868 122.4026 55.3433 18.2197 179.3975 19 A 3.9276 8.0090 119.1276 55.2120 18.3795 179.4751 20 F 3.9314 8.2117 118.5576 61.9127 39.4368 176.9535 21 Y 4.1081 7.6067 115.1302 60.9256 37.4377 177.8506 22 E 4.1303 8.5056 119.7399 58.9617 29.7518 178.5068 23 R 4.0879 7.4562 117.7880 59.0184 30.1779 177.4874 24 L 4.7421 6.6188 115.3099 54.6037 41.7974 178.5284 25 G 3.9314 8.4244 107.5554 45.8102 0.0000 174.0128 26 F 4.7440 8.1607 119.1224 56.1495 37.7551 175.8226 27 G 3.7507 8.3127 110.3582 46.0487 0.0000 170.3904 28 I 4.7047 8.4984 123.6660 60.7719 34.9668 176.2232 29 V 3.9393 8.3709 118.8801 63.3401 32.6761 176.5175 30 F 4.8966 8.1517 120.9179 56.3111 42.4073 173.2804 31 R 4.5257 7.7820 126.3668 54.9672 33.0214 171.7469 32 D 4.5983 7.9401 122.8933 52.9536 41.5935 175.4435 33 A 4.6872 7.5155 121.0130 52.4973 26.3000 178.6518 34 G 4.1158 8.3816 102.8133 47.9757 0.0000 173.7135 35 W 5.8233 8.8997 129.1149 56.0258 35.0071 174.2402 36 M 4.8942 8.5245 124.9948 54.5177 34.6068 173.5909 37 I 4.6727 8.8864 128.4588 60.2239 39.1403 175.1111 38 L 4.9550 8.9297 128.5575 53.0944 43.6353 175.6600 39 Q 5.1790 8.8563 125.5372 53.3394 31.6596 175.6526 40 R 3.9836 7.9549 128.7536 55.8590 28.9851 178.9149 41 G 3.8896 8.6784 116.8313 46.3047 0.0000 172.4306 42 D 4.5011 9.2464 123.5481 56.4217 42.1936 177.3799 43 L 4.2958 7.4974 119.8792 54.5419 39.4728 173.5074 44 M 4.6600 8.1735 121.0925 54.7743 33.4270 174.7087 45 L 4.5558 8.8511 126.3840 53.0741 44.8529 175.6687 46 E 4.4111 8.5014 124.7758 55.0696 30.7511 175.6122 47 F 4.5711 8.6699 125.9155 55.6043 40.2060 175.6156 48 F 4.9921 8.1651 119.9071 55.6693 39.8128 175.2024 49 A 4.6397 9.1979 123.2653 52.7439 18.1081 176.9653 50 H 5.0997 8.6967 123.0541 54.6629 28.3660 171.6544 51 P 4.3421 0.0000 0.0000 64.8217 32.5057 178.6038 52 G 3.9402 7.9144 109.8841 44.1853 0.0000 172.3986 53 L 4.5144 7.3365 119.6078 53.1822 44.9980 174.8800 54 D 4.6383 8.5577 125.5477 52.3978 41.4582 174.9342 55 P 4.4257 0.0000 0.0000 64.7357 31.6352 178.1066 56 L 3.9368 7.8838 117.0338 57.8751 41.6051 177.8548 57 A 4.3867 8.1180 117.8202 52.6111 17.9556 178.2730 58 S 4.6018 7.2202 114.4763 58.4012 61.0539 174.3518 59 W 4.4165 8.3090 129.9160 55.2881 27.4966 176.9170 60 F 4.9167 7.7996 116.8434 55.6112 41.4924 174.6914 61 S 5.4755 8.5999 117.6994 56.7418 65.9348 173.5170 62 C 4.7420 8.5327 115.1671 57.4403 33.0797 172.6157 63 C 5.2191 8.6535 121.0561 58.6207 29.1643 173.2308 64 L 4.3093 8.5827 123.8783 53.9428 42.3107 176.0403 65 R 4.6627 8.5730 124.7302 55.1219 29.6257 174.6413 66 L 4.5791 8.6054 123.4237 53.1566 43.0097 177.5927 67 D 4.4523 9.0046 123.7358 55.9560 41.2920 175.7846 68 D 5.1040 7.8801 118.1020 52.1777 43.0497 175.3623 69 L 4.2968 8.9114 127.4385 56.8179 42.9654 178.6380 70 A 4.0405 8.4545 121.6689 55.3346 18.4332 178.3601 71 E 3.8927 8.0323 115.9142 60.1455 29.4921 178.8999 72 F 4.1599 8.2405 119.7550 61.3042 39.7294 176.7861 73 Y 3.6601 7.9680 118.6066 60.5636 38.6524 177.7992 74 R 3.8745 8.0333 119.0436 59.1781 30.1332 178.4703 75 Q 3.8173 8.3356 119.6727 59.5389 28.7088 178.3293 76 C 3.6507 7.3310 117.2168 62.8823 27.9330 176.5175 77 K 3.8430 7.1971 117.9943 59.3461 31.6573 179.3121 78 S 4.2260 7.8229 113.5961 61.4400 63.1872 176.6631 79 V 3.7171 7.6636 115.5839 63.4029 32.6134 174.8751 80 G 3.0514 6.9811 104.9788 45.0304 0.0000 173.2352 81 I 4.6640 7.4439 119.0857 59.5187 41.0857 176.8567 82 Q 4.1549 8.6557 125.9382 55.6870 30.3247 174.9820 83 E 4.6518 8.7009 123.9770 55.6069 29.7482 175.3244 84 T 4.7397 8.1582 121.2145 60.6350 70.0802 173.6578 85 S 4.2793 9.1332 123.8426 60.9223 63.3533 174.2980 86 S 4.6472 9.2111 115.3028 54.6465 63.3292 172.8084 87 G 4.3875 7.7505 117.5020 44.7826 0.0000 171.4866 88 Y 4.8334 7.3664 119.4730 54.8647 40.1314 172.9529 89 P 4.7914 0.0000 0.0000 62.6288 32.5646 175.7582 90 R 5.0907 8.7602 116.9953 54.7042 33.3180 173.7441 91 I 5.2031 8.3245 113.0469 59.6070 41.3740 173.8663 92 H 5.2406 8.8393 119.4087 53.7862 32.6054 173.2532 93 A 3.7044 8.6966 123.4321 51.0253 19.4352 176.1482 94 P 4.2722 0.0000 0.0000 63.2601 30.2978 175.7654 95 E 4.5302 8.2810 123.6820 54.4863 31.9384 175.6665 96 L 4.3725 8.3172 122.5258 54.7065 42.4970 176.6327 97 Q 4.3834 7.9158 123.7260 54.6574 31.7262 177.0524 *98 E 4.4225 8.3959 118.6493 53.5481 28.7126 174.2501 99 W 4.9141 7.3028 124.6107 56.8488 34.9610 175.8913 100 G 4.1961 7.2631 106.5257 43.7239 0.0000 173.8460 101 G 3.5452 7.5726 106.4387 44.6561 0.0000 174.0482 102 T 5.1009 8.2074 112.1539 60.6530 71.9853 171.9643 103 M 5.2960 8.4389 126.4705 54.0136 35.2739 174.3619 104 A 4.9359 8.8783 127.5127 50.6981 22.3057 174.9740 105 A 5.2998 8.7746 120.1018 50.2818 22.4424 175.7294 106 L 5.0538 8.8285 121.8963 53.5519 45.6892 175.1820 107 V 5.0893 9.2681 127.0720 60.5408 33.8600 175.1069 108 D 4.1216 8.2844 126.8740 51.1190 41.8413 175.0095 109 P 4.0596 0.0000 0.0000 65.8465 31.7605 177.8863 110 D 4.2891 8.0387 118.0304 55.6937 41.4106 176.8735 111 G 3.9230 7.6925 106.3598 46.3257 0.0000 173.8195 112 T 4.5876 8.3621 115.2217 61.6711 71.6815 175.4633 113 L 4.6167 8.8504 130.2735 53.9876 42.1535 174.0010 114 L 4.6771 9.0775 125.0357 53.7241 43.1778 176.3671 115 R 4.2818 8.7749 125.3971 55.2670 31.1959 176.3272 116 L 4.4480 9.2044 126.9832 53.7686 41.9858 175.4632 117 I 4.7454 8.5088 125.2872 60.2200 39.0182 174.9100 118 Q 4.6115 8.7805 129.0525 55.5256 29.1545 175.4227 119 N 4.6468 8.7146 124.5852 53.7030 39.4129 175.4540 120 E 4.8991 8.2718 121.4425 55.1551 32.1528 175.5246 121 L 4.1288 8.5949 118.5583 58.8145 42.2119 178.2461 122 L 4.3276 7.6007 118.8794 53.7596 40.0530 177.8782 123 A 4.3291 7.5494 124.0982 51.3882 17.0152 177.8547 124 G 3.7857 7.7843 109.2415 43.8624 0.0000 169.3002 125 I 3.7721 7.8601 124.3040 61.4296 37.2527 176.6225 126 S 4.3268 8.5633 119.5122 58.4507 63.1315 174.1358 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 T 8.17 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 1.21 0.00 0.00 3 D 8.57 4.31 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 4 Q 8.68 4.43 0.00 2.16 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.83 6.61 0.00 0.00 0.00 0.00 0.00 2.23 2.37 0.00 5 A 8.63 4.48 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 6 T 8.25 4.59 4.29 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 1.28 0.00 0.00 7 P 0.00 4.48 0.00 2.06 2.22 0.00 3.79 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 1.99 1.97 0.00 8 N 8.82 5.14 0.00 2.78 2.93 0.00 0.00 7.06 8.24 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 9 L 8.40 4.49 0.00 0.27 0.46 0.40 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 10 P 0.00 3.95 0.00 1.62 1.00 0.00 3.26 0.00 0.00 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.26 0.00 11 S 8.50 4.79 0.00 3.96 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 12 R 9.57 3.90 0.00 1.82 1.96 0.00 3.16 0.00 0.00 3.12 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.70 0.00 13 D 7.66 5.01 0.00 2.75 2.49 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.64 4.37 0.00 3.06 2.93 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 15 D 8.23 4.41 0.00 2.72 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 16 S 7.78 4.10 0.00 3.99 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 17 T 7.91 3.90 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 0.74 0.00 0.00 18 A 7.99 4.04 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 19 A 8.01 3.93 1.42 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 0.00 0.00 20 F 8.21 3.93 0.00 2.97 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 21 Y 7.61 4.11 0.00 3.08 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 22 E 8.51 4.13 0.00 2.09 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 2.35 2.40 0.00 23 R 7.46 4.09 0.00 1.79 1.86 0.00 3.11 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.83 0.00 24 L 6.62 4.74 0.00 2.22 2.11 0.54 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 25 G 8.42 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 26 F 8.16 4.74 0.00 3.07 3.05 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 27 G 8.31 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 I 8.50 4.70 1.89 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 1.21 0.72 0.90 0.00 0.00 29 V 8.37 3.94 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 0.80 0.00 0.00 1.17 0.00 0.00 30 F 8.15 4.90 0.00 3.04 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 31 R 7.78 4.53 0.00 1.65 1.64 0.00 3.19 0.00 0.00 3.28 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.59 0.00 32 D 7.94 4.60 0.00 2.78 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 0.00 0.00 0.00 0.00 33 A 7.52 4.69 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 G 8.38 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 35 W 8.90 5.82 0.00 3.60 3.26 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 36 M 8.52 4.89 0.00 1.46 0.57 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.22 0.00 37 I 8.89 4.67 2.11 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 1.49 1.48 1.01 0.00 0.00 38 L 8.93 4.96 0.00 1.50 1.62 0.44 0.57 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 39 Q 8.86 5.18 0.00 2.12 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.95 7.26 0.00 0.00 0.00 0.00 0.00 2.37 2.17 0.00 40 R 7.95 3.98 0.00 0.84 0.94 0.00 3.21 0.00 0.00 2.96 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.36 0.00 41 G 8.68 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 0.00 0.00 0.00 42 D 9.25 4.50 0.00 2.66 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 43 L 7.50 4.30 0.00 1.56 1.81 0.67 1.02 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 44 M 8.17 4.66 0.00 2.07 2.02 0.00 0.00 0.00 0.00 0.00 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.63 0.00 45 L 8.85 4.56 0.00 1.65 1.37 0.12 0.70 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 46 E 8.50 4.41 0.00 1.94 1.60 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 2.41 2.35 0.00 47 F 8.67 4.57 0.00 2.77 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 48 F 8.17 4.99 0.00 3.18 2.45 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 0.00 0.00 0.00 0.00 49 A 9.20 4.64 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 50 H 8.70 5.10 0.00 2.86 2.93 0.00 5.96 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 P 0.00 4.34 0.00 2.22 2.16 0.00 3.88 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 2.02 1.96 0.00 52 G 7.91 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 0.00 0.00 0.00 53 L 7.34 4.51 0.00 1.38 1.40 0.84 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 54 D 8.56 4.64 0.00 2.80 2.55 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 0.00 55 P 0.00 4.43 0.00 1.24 1.47 0.00 3.71 0.00 0.00 4.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 2.02 0.00 56 L 7.88 3.94 0.00 1.82 1.70 0.94 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 57 A 8.12 4.39 1.42 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 0.00 0.00 58 S 7.22 4.60 0.00 4.15 3.97 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 0.00 0.00 0.00 59 W 8.31 4.42 0.00 3.07 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 60 F 7.80 4.92 0.00 2.86 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 S 8.60 5.48 0.00 4.01 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 62 C 8.53 4.74 0.00 3.02 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 63 C 8.65 5.22 0.00 2.90 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 64 L 8.58 4.31 0.00 1.60 1.54 0.85 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 65 R 8.57 4.66 0.00 1.71 2.04 0.00 3.21 0.00 0.00 3.25 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.69 0.00 66 L 8.61 4.58 0.00 1.80 1.80 0.97 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 67 D 9.00 4.45 0.00 2.68 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 68 D 7.88 5.10 0.00 2.59 2.54 0.00 0.00 0.00 0.00 0.00 0.00 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 8.91 4.30 0.00 1.84 1.67 1.11 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 70 A 8.45 4.04 1.42 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 0.00 0.00 71 E 8.03 3.89 0.00 2.03 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 0.00 2.35 2.53 0.00 72 F 8.24 4.16 0.00 3.23 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 73 Y 7.97 3.66 0.00 3.25 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 74 R 8.03 3.87 0.00 2.18 1.96 0.00 3.24 0.00 0.00 3.27 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.71 0.00 75 Q 8.34 3.82 0.00 2.23 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.80 6.90 0.00 0.00 0.00 0.00 0.00 2.17 2.33 0.00 76 C 7.33 3.65 0.00 2.60 2.58 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 77 K 7.20 3.84 0.00 1.62 1.77 0.00 1.77 0.00 0.00 1.75 0.00 0.00 3.10 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.26 1.18 7.81 78 S 7.82 4.23 0.00 3.97 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 79 V 7.66 3.72 1.89 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 0.82 0.00 0.00 0.75 0.00 0.00 80 G 6.98 3.05 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 81 I 7.44 4.66 1.80 0.00 0.00 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.47 0.97 0.00 0.00 82 Q 8.66 4.15 0.00 2.11 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 7.07 0.00 0.00 0.00 0.00 0.00 2.39 2.34 0.00 83 E 8.70 4.65 0.00 2.03 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 2.47 0.00 84 T 8.16 4.74 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 1.29 0.00 0.00 85 S 9.13 4.28 0.00 4.04 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 86 S 9.21 4.65 0.00 3.86 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 87 G 7.75 4.39 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 0.00 88 Y 7.37 4.83 0.00 2.98 2.81 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 89 P 0.00 4.79 0.00 2.18 1.64 0.00 3.60 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.88 0.00 90 R 8.76 5.09 0.00 1.99 2.02 0.00 2.94 0.00 0.00 3.44 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.54 0.00 91 I 8.32 5.20 1.90 0.00 0.00 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.92 0.90 0.00 0.00 92 H 8.84 5.24 0.00 3.13 3.22 0.00 5.64 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 93 A 8.70 3.70 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 94 P 0.00 4.27 0.00 1.81 1.93 0.00 3.27 0.00 0.00 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.71 0.00 95 E 8.28 4.53 0.00 1.88 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 2.29 2.45 0.00 96 L 8.32 4.37 0.00 1.55 1.48 0.86 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 97 Q 7.92 4.38 0.00 1.05 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.97 7.61 0.00 0.00 0.00 0.00 0.00 2.10 1.77 0.00 *98 E 8.40 4.42 0.00 1.99 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 2.22 1.86 0.00 99 W 7.30 4.91 0.00 3.40 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 0.00 100 G 7.26 4.20 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 0.00 0.00 0.00 101 G 7.57 3.55 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 0.00 0.00 0.00 0.00 102 T 8.21 5.10 4.11 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 0.00 0.00 0.00 1.15 0.00 0.00 103 M 8.44 5.30 0.00 2.20 2.18 0.00 0.00 0.00 0.00 0.00 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.67 0.00 104 A 8.88 4.94 1.23 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 0.00 0.00 0.00 105 A 8.77 5.30 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 0.00 106 L 8.83 5.05 0.00 1.95 1.70 1.01 1.17 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 0.00 107 V 9.27 5.09 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 1.07 0.00 0.00 0.96 0.00 0.00 108 D 8.28 4.12 0.00 1.86 2.58 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 0.00 109 P 0.00 4.06 0.00 1.92 2.05 0.00 3.02 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.70 0.00 110 D 8.04 4.29 0.00 2.86 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 0.00 111 G 7.69 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 0.00 112 T 8.36 4.59 4.56 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 0.00 0.00 1.22 0.00 0.00 113 L 8.85 4.62 0.00 1.76 1.58 0.92 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 114 L 9.08 4.68 0.00 2.04 1.78 1.18 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 115 R 8.77 4.28 0.00 1.85 1.98 0.00 3.13 0.00 0.00 3.20 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.80 0.00 116 L 9.20 4.45 0.00 1.75 1.85 1.34 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 117 I 8.51 4.75 1.99 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.90 1.16 0.00 0.00 118 Q 8.78 4.61 0.00 2.06 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.74 7.14 0.00 0.00 0.00 0.00 0.00 2.34 2.38 0.00 119 N 8.71 4.65 0.00 2.82 2.78 0.00 0.00 7.37 7.48 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 0.00 120 E 8.27 4.90 0.00 1.98 1.93 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 2.24 2.37 0.00 121 L 8.59 4.13 0.00 1.65 1.74 0.93 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 122 L 7.60 4.33 0.00 1.67 1.66 0.94 0.79 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 A 7.55 4.33 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 0.00 124 G 7.78 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 0.00 125 I 7.86 3.77 1.88 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 1.48 0.72 0.92 0.00 0.00 126 S 8.56 4.33 0.00 3.98 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 * Residues marked with a * may have inaccurate shift predictions.