NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 L 4.5091 8.1844 120.6353 55.1488 42.1832 176.4938 5 T 4.1481 8.5949 118.7912 60.1631 69.9620 171.2325 6 E 3.9673 9.4965 124.1559 59.9286 29.3950 179.2784 7 E 3.9981 8.0681 117.6622 59.1159 29.5343 179.3133 8 Q 3.5904 7.7447 117.9045 58.8176 28.8375 178.4700 9 I 3.7744 7.5219 120.2538 64.3918 37.0926 178.3850 10 A 3.9424 7.8942 121.1713 54.8885 18.0851 179.2708 11 E 4.1042 7.5242 116.4845 58.9653 29.8068 178.9835 12 F 4.9897 7.8617 117.9604 60.1703 39.0262 177.8444 13 K 3.5771 8.4684 119.7712 59.5298 31.8423 178.8542 14 E 4.0233 8.1054 118.3271 59.1419 28.8023 179.3047 15 A 4.1534 8.3267 121.1749 54.9934 18.5407 179.0744 16 F 3.2090 8.6180 119.6615 61.5453 39.0864 177.2644 17 S 4.0994 7.9990 112.9338 62.0079 62.7881 176.5856 18 L 4.0685 7.5108 119.7027 57.8199 41.3423 179.4899 19 F 4.2250 7.7087 116.3076 59.7024 39.8153 176.7422 20 D 4.4868 7.6200 119.9513 52.4423 38.2614 176.0917 21 K 3.8533 8.1106 124.7315 58.9741 32.6432 177.6159 22 D 4.4235 7.8684 114.4718 53.4579 40.0668 175.8602 23 G 3.7926 7.6220 107.2840 47.1330 0.0000 173.7855 24 D 4.6807 8.5495 115.3839 52.6840 40.2441 177.3768 25 G 4.1991 9.4479 108.4919 45.5114 0.0000 173.3846 26 T 5.1583 8.1793 108.3020 60.0491 72.3553 173.3662 27 I 4.5811 9.0473 125.5447 60.3010 38.9762 175.4288 28 T 4.8046 8.8011 118.0108 60.1947 71.0858 176.0444 29 T 3.9125 8.5512 112.6626 64.9972 68.3738 176.3145 30 K 3.9459 8.0081 121.8907 59.2283 32.1430 178.4968 31 E 4.0376 7.9609 118.4272 59.0088 29.4272 178.8753 32 L 4.2677 8.1762 120.7708 57.9768 42.1606 179.2537 33 G 3.6110 8.4643 106.1343 48.0135 0.0000 175.7830 34 T 3.9011 7.7144 118.2867 66.3912 68.3086 176.9088 35 V 3.4756 7.5869 120.1625 66.1984 31.5130 177.9360 36 M 4.0771 8.2152 118.5026 58.5527 31.8081 178.9854 37 R 4.6601 8.3891 119.8010 59.0382 30.0260 179.2384 38 S 4.1476 7.8005 113.7847 61.2773 62.8492 175.8432 39 L 4.3317 7.3363 119.0148 54.4880 41.5529 177.6221 40 G 3.9075 7.9442 107.4433 45.4290 0.0000 173.5091 41 Q 4.6203 8.0793 118.6904 54.1467 30.6101 174.4067 42 N 5.2571 8.2480 119.0354 50.9659 39.1557 171.3225 43 P 4.6134 0.0000 0.0000 61.2054 33.1659 177.6891 44 T 4.0376 7.9955 110.3931 61.8557 70.3908 175.1578 45 E 4.0200 8.7068 121.8886 58.8075 29.8877 178.8838 46 A 4.1139 7.8755 120.7157 55.5074 18.7183 179.2493 47 E 4.1399 8.0139 116.6802 59.4041 29.4373 179.4753 48 L 4.0132 7.9110 119.1182 58.2133 41.5936 179.6920 49 Q 4.0239 8.0205 117.2723 58.7781 28.6730 178.0898 50 D 4.3639 8.1707 119.5887 57.7425 40.6232 178.7943 51 M 4.0478 7.8314 117.7361 58.4344 32.2389 178.4115 52 I 3.8624 7.8455 119.8932 64.7817 36.8066 178.3609 53 N 4.3149 9.1062 118.0385 56.1185 38.0308 177.0094 54 E 4.2178 8.0258 119.8620 58.6869 29.6504 178.2613 55 V 4.1763 6.9575 115.2997 61.2566 31.8324 175.4461 56 D 4.4624 8.2983 120.7758 53.6854 39.8030 176.3793 57 A 4.0686 8.6346 129.8289 54.8880 18.5472 178.5439 58 D 4.4450 8.2708 112.2772 53.8620 40.1156 177.3824 59 G 3.9228 7.7861 107.2241 45.6671 0.0000 173.7520 60 N 4.4897 8.5451 114.9424 52.9335 37.0670 176.1337 61 G 3.9105 8.7272 106.7861 46.1494 0.0000 172.8602 62 T 4.9318 7.6212 107.3866 59.8260 72.6910 172.8966 63 I 4.9017 8.4935 121.6178 59.6100 40.2931 175.3596 64 D 5.5035 9.1212 125.9667 51.4284 42.5761 177.0724 65 F 3.4734 8.4912 119.3607 61.0227 39.0723 174.9077 66 P 3.9533 0.0000 0.0000 65.6638 31.1657 178.4570 67 E 3.9327 8.0762 117.0714 59.0356 29.3517 178.8192 68 F 3.9430 8.2752 120.8136 61.4430 39.4715 177.0526 69 L 3.8338 8.0405 120.0948 58.2316 41.8682 178.9560 70 T 3.7669 7.7429 115.8053 66.6792 68.3175 176.2577 71 M 3.8317 7.6945 119.6252 58.7965 32.3696 177.7824 72 M 3.5309 7.6038 118.6855 58.3594 31.8408 178.6868 73 A 3.9038 7.4896 118.8060 55.1532 18.6865 179.3513 74 R 3.9270 7.4680 115.4171 59.5112 30.2605 178.4556 75 K 4.0451 7.8494 117.3231 59.0700 33.2087 178.5231 76 M 4.3777 7.4597 117.1778 53.3594 28.7442 176.7076 *78 D 4.2776 7.3830 118.0490 54.9088 42.6323 175.5195 79 T 4.0695 8.3340 121.2615 64.6586 67.3510 174.8765 80 D 4.7570 8.1237 118.9314 55.1832 41.1889 177.5353 81 S 4.6208 7.6193 116.6706 59.5974 62.6484 175.7606 82 E 4.0863 7.8633 121.2593 59.3283 29.1635 178.7255 83 E 3.9851 8.0002 118.7531 59.8054 29.0612 179.4259 84 E 4.1016 8.1997 117.7705 59.4177 29.5854 179.3290 85 I 4.0006 7.7542 119.5549 64.5374 37.0963 178.6992 86 R 4.2309 8.5649 119.2556 59.2189 29.6173 178.7648 87 E 4.0400 8.2048 118.3733 59.1603 29.8348 178.3860 88 A 4.3582 8.6320 121.2862 55.0465 18.4124 179.2775 89 F 3.2288 8.6103 119.2593 61.4476 39.2139 177.6223 90 R 3.8205 7.8001 116.0525 59.0329 29.8324 178.8864 91 V 3.7079 7.3080 117.6878 66.1363 31.6158 177.8277 92 F 4.1956 8.1796 115.7896 59.3575 40.5836 176.4367 93 D 4.4507 7.7277 120.0166 52.6662 37.5070 176.7366 94 K 3.9426 7.8169 121.9263 58.8532 31.8610 178.1028 95 D 4.4818 8.3556 116.3744 52.9068 39.9109 177.2621 96 G 3.7403 7.7978 107.7199 46.8282 0.0000 174.1337 97 N 4.5714 7.9418 112.7026 52.5759 37.7573 175.8896 98 G 3.9747 9.5230 108.0931 45.2946 0.0000 172.9838 99 Y 5.2087 7.6394 115.9571 56.2170 42.1820 175.0636 100 I 4.4751 9.1675 124.9768 60.4531 38.5024 176.0833 101 S 4.8488 9.2318 122.6438 57.2749 64.7336 175.3453 102 A 3.9860 8.7956 121.3929 55.2636 18.0005 179.5746 103 A 3.9493 8.0060 118.5906 55.5133 18.6529 179.4434 104 E 3.9149 7.9433 116.8823 59.4857 29.5466 179.4520 105 L 4.2255 8.2577 120.3891 58.1520 42.1559 178.7299 106 R 3.8752 8.2840 118.9773 59.8321 30.1141 177.5709 107 H 4.0023 8.6844 118.1068 59.4734 29.3262 177.2952 108 V 3.4000 7.5696 119.1854 66.3122 31.3502 177.9749 109 M 4.1266 8.0810 118.6942 58.3788 31.6411 178.9269 110 T 4.1815 8.0416 111.6729 64.2998 68.8987 176.5308 111 N 4.2656 7.8026 117.6591 55.1121 38.5816 176.2577 112 L 4.3522 7.1477 117.9761 54.4230 42.2612 177.2919 113 G 3.9887 8.0055 107.4661 44.8241 0.0000 173.7243 114 E 3.9497 8.3867 122.1238 55.6847 30.1522 175.3072 115 K 4.6120 8.5185 127.3497 54.9421 32.7012 175.3020 116 L 5.0982 8.2744 125.8535 53.1178 45.2348 176.2211 117 T 4.5678 8.8265 112.0540 59.9848 71.0856 175.5332 118 D 4.4179 8.4819 121.2617 57.4039 40.3417 178.6958 119 E 4.0179 8.1174 119.5714 59.0509 29.6982 178.4290 120 E 4.0297 8.1406 118.9483 59.1070 29.5632 179.3406 121 V 3.6515 7.7112 117.9714 66.0177 31.7395 177.6001 122 D 4.3994 8.1553 118.7756 57.3281 40.5440 178.5204 123 E 3.9835 7.9770 119.5877 59.5080 29.3524 178.6295 124 M 4.0642 8.0712 118.7650 58.3393 31.9578 178.9535 125 I 3.8173 7.8480 119.8926 64.4803 37.2533 178.2392 126 R 3.9211 8.1754 117.8856 59.7462 30.0402 178.3036 127 E 4.0425 8.2834 117.3290 58.9580 29.6852 178.1209 128 A 4.4781 7.4127 118.4283 53.3080 19.7222 177.7637 129 D 4.6998 8.3352 116.7905 54.1152 40.0368 175.8192 130 I 3.8793 8.0950 126.5033 63.8799 37.5251 177.2454 131 D 4.4906 8.4014 116.8628 53.2622 39.7094 176.9313 132 G 3.8688 8.0889 107.9466 46.6502 0.0000 173.9010 133 D 4.5014 8.0617 115.6636 52.6541 39.6239 177.3844 134 G 3.9318 9.7036 108.5490 45.8064 0.0000 172.9309 135 Q 4.6493 7.9455 115.8733 54.5120 32.6319 174.4040 136 V 4.6978 8.7674 120.0564 61.4273 33.4869 175.2422 137 N 5.1589 9.5483 127.0993 52.0729 39.5517 175.5206 138 Y 3.1825 8.3390 118.2415 60.5767 38.4760 177.4589 139 E 3.7534 8.1573 119.7709 59.2747 29.9521 178.4814 140 E 3.9844 8.5762 118.6954 59.2354 29.4562 179.1459 141 F 4.1261 8.1979 120.9413 61.0080 39.2298 177.3235 142 V 3.2397 7.3173 117.1929 66.0538 31.5562 177.5614 143 Q 4.0062 7.7312 119.3337 59.0424 28.6575 177.6435 144 M 4.1532 7.4458 116.2029 57.1950 31.6264 177.3130 145 M 3.9706 7.3200 118.4548 56.2317 32.3903 176.0565 146 T 3.9419 7.2703 115.1791 61.7693 70.8796 172.3135 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 4 L 8.18 4.51 0.00 1.67 1.80 0.95 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 5 T 8.59 4.15 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 1.22 0.00 0.00 6 E 9.50 3.97 0.00 2.07 1.99 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 2.40 2.49 0.00 7 E 8.07 4.00 0.00 1.93 1.94 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 2.37 2.31 0.00 8 Q 7.74 3.59 0.00 2.19 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.91 0.00 0.00 0.00 0.00 0.00 2.33 2.37 0.00 9 I 7.52 3.77 1.93 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.91 1.22 0.00 0.00 10 A 7.89 3.94 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 11 E 7.52 4.10 0.00 1.88 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 2.28 2.35 0.00 12 F 7.86 4.99 0.00 3.51 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 13 K 8.47 3.58 0.00 0.82 1.70 0.00 0.84 0.00 0.00 0.76 0.00 0.00 2.79 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.14 1.29 7.81 14 E 8.11 4.02 0.00 2.18 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 0.00 2.33 2.31 0.00 15 A 8.33 4.15 1.81 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 16 F 8.62 3.21 0.00 2.58 3.07 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 17 S 8.00 4.10 0.00 4.14 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 18 L 7.51 4.07 0.00 1.71 1.63 0.94 1.15 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 19 F 7.71 4.23 0.00 2.88 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 20 D 7.62 4.49 0.00 2.14 2.37 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 21 K 8.11 3.85 0.00 1.72 1.81 0.00 1.80 0.00 0.00 1.74 0.00 0.00 3.01 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.40 1.41 7.81 22 D 7.87 4.42 0.00 2.85 2.77 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 23 G 7.62 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 24 D 8.55 4.68 0.00 2.81 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 25 G 9.45 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 26 T 8.18 5.16 4.31 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 1.30 0.00 0.00 27 I 9.05 4.58 1.86 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 0.97 0.32 0.93 0.00 0.00 28 T 8.80 4.80 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 29 T 8.55 3.91 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 30 K 8.01 3.95 0.00 1.90 1.85 0.00 1.60 0.00 0.00 1.82 0.00 0.00 3.04 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.51 1.59 7.81 31 E 7.96 4.04 0.00 2.24 2.17 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 2.32 2.31 0.00 32 L 8.18 4.27 0.00 1.98 1.72 0.97 1.29 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 33 G 8.46 3.61 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 34 T 7.71 3.90 4.38 0.00 0.00 0.00 0.00 0.00 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 35 V 7.59 3.48 2.22 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 0.83 0.00 0.00 0.67 0.00 0.00 36 M 8.22 4.08 0.00 2.09 2.24 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 3.05 0.00 37 R 8.39 4.66 0.00 2.02 1.96 0.00 3.19 0.00 0.00 3.26 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.57 0.00 38 S 7.80 4.15 0.00 3.93 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 39 L 7.34 4.33 0.00 1.67 1.65 0.95 1.09 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 40 G 7.94 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 41 Q 8.08 4.62 0.00 2.18 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.95 6.74 0.00 0.00 0.00 0.00 0.00 2.30 2.43 0.00 42 N 8.25 5.26 0.00 2.62 2.68 0.00 0.00 7.05 7.69 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 43 P 0.00 4.61 0.00 2.21 2.04 0.00 3.58 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.08 0.00 44 T 8.00 4.04 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 1.25 0.00 0.00 45 E 8.71 4.02 0.00 1.99 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 0.00 2.30 2.39 0.00 46 A 7.88 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 47 E 8.01 4.14 0.00 2.00 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 0.00 2.34 2.36 0.00 48 L 7.91 4.01 0.00 1.88 1.75 1.01 1.04 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 49 Q 8.02 4.02 0.00 2.27 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.75 0.00 0.00 0.00 0.00 0.00 2.39 2.41 0.00 50 D 8.17 4.36 0.00 2.85 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 51 M 7.83 4.05 0.00 2.03 2.39 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.60 0.00 52 I 7.85 3.86 2.00 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.98 0.93 0.00 0.00 53 N 9.11 4.31 0.00 2.79 2.87 0.00 0.00 7.08 7.54 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 54 E 8.03 4.22 0.00 2.18 2.00 0.00 0.00 0.00 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 2.52 0.00 55 V 6.96 4.18 1.99 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 0.74 0.00 0.00 0.94 0.00 0.00 56 D 8.30 4.46 0.00 2.85 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 57 A 8.63 4.07 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 58 D 8.27 4.45 0.00 2.78 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 59 G 7.79 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 60 N 8.55 4.49 0.00 2.86 2.95 0.00 0.00 6.90 6.64 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 61 G 8.73 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 62 T 7.62 4.93 4.41 0.00 0.00 0.00 0.00 0.00 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 63 I 8.49 4.90 2.00 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.69 1.15 0.00 0.00 64 D 9.12 5.50 0.00 2.78 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 65 F 8.49 3.47 0.00 2.06 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 66 P 0.00 3.95 0.00 2.13 2.01 0.00 3.79 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.17 0.00 67 E 8.08 3.93 0.00 2.18 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 0.00 2.31 2.29 0.00 68 F 8.28 3.94 0.00 3.42 3.19 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 69 L 8.04 3.83 0.00 0.96 1.42 1.15 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 70 T 7.74 3.77 4.31 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 1.14 0.00 0.00 71 M 7.69 3.83 0.00 1.98 1.87 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.33 0.00 72 M 7.60 3.53 0.00 0.85 1.71 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.89 0.00 73 A 7.49 3.90 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 74 R 7.47 3.93 0.00 1.87 1.93 0.00 3.24 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.63 0.00 75 K 7.85 4.05 0.00 1.77 1.77 0.00 1.72 0.00 0.00 1.71 0.00 0.00 3.17 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.38 1.51 7.81 76 M 7.46 4.38 0.00 2.16 2.12 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.73 0.00 *78 D 7.38 4.28 0.00 2.83 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 79 T 8.33 4.07 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 80 D 8.12 4.76 0.00 2.76 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 81 S 7.62 4.62 0.00 3.91 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 82 E 7.86 4.09 0.00 2.06 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 0.00 2.39 2.55 0.00 83 E 8.00 3.99 0.00 1.98 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 0.00 2.34 2.38 0.00 84 E 8.20 4.10 0.00 2.29 2.06 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 2.42 2.50 0.00 85 I 7.75 4.00 2.17 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 1.56 1.14 1.02 0.00 0.00 86 R 8.56 4.23 0.00 2.07 1.98 0.00 2.97 0.00 0.00 2.82 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.88 0.00 87 E 8.20 4.04 0.00 2.24 2.21 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 2.39 2.37 0.00 88 A 8.63 4.36 1.77 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 0.00 0.00 89 F 8.61 3.23 0.00 3.10 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 90 R 7.80 3.82 0.00 1.84 1.99 0.00 3.25 0.00 0.00 3.19 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 2.00 0.00 91 V 7.31 3.71 2.39 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 0.70 0.00 0.00 1.02 0.00 0.00 92 F 8.18 4.20 0.00 2.70 2.92 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 93 D 7.73 4.45 0.00 1.89 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 0.00 0.00 0.00 94 K 7.82 3.94 0.00 1.71 1.79 0.00 1.72 0.00 0.00 1.75 0.00 0.00 2.96 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.52 1.22 7.81 95 D 8.36 4.48 0.00 2.84 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 96 G 7.80 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 0.00 0.00 0.00 97 N 7.94 4.57 0.00 2.92 2.99 0.00 0.00 7.08 6.88 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 98 G 9.52 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 0.00 0.00 0.00 99 Y 7.64 5.21 0.00 2.83 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 0.00 100 I 9.17 4.48 1.92 0.00 0.00 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.19 1.00 0.00 0.00 101 S 9.23 4.85 0.00 3.92 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 0.00 102 A 8.80 3.99 1.36 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 0.00 103 A 8.01 3.95 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 0.00 104 E 7.94 3.91 0.00 2.16 2.22 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 2.29 2.31 0.00 105 L 8.26 4.23 0.00 1.98 1.91 1.24 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 106 R 8.28 3.88 0.00 1.93 2.22 0.00 3.18 0.00 0.00 3.10 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.66 0.00 107 H 8.68 4.00 0.00 3.24 3.41 0.00 5.64 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 V 7.57 3.40 1.54 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 0.36 0.00 0.00 0.48 0.00 0.00 109 M 8.08 4.13 0.00 2.12 2.13 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 2.95 0.00 110 T 8.04 4.18 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 1.30 0.00 0.00 111 N 7.80 4.27 0.00 2.76 2.93 0.00 0.00 7.05 7.26 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 0.00 112 L 7.15 4.35 0.00 1.75 1.65 0.89 0.87 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 0.00 113 G 8.01 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 0.00 0.00 0.00 114 E 8.39 3.95 0.00 2.03 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 2.31 2.25 0.00 115 K 8.52 4.61 0.00 1.74 1.71 0.00 1.76 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.35 1.43 7.81 116 L 8.27 5.10 0.00 1.63 1.52 0.95 0.94 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 0.00 117 T 8.83 4.57 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 0.00 118 D 8.48 4.42 0.00 2.75 2.77 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 0.00 119 E 8.12 4.02 0.00 2.04 1.94 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 2.38 2.40 0.00 120 E 8.14 4.03 0.00 2.28 1.99 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 2.34 2.32 0.00 121 V 7.71 3.65 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 1.11 0.00 0.00 0.96 0.00 0.00 122 D 8.16 4.40 0.00 2.95 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 0.00 123 E 7.98 3.98 0.00 2.15 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 2.31 2.35 0.00 124 M 8.07 4.06 0.00 2.16 2.28 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.79 2.62 0.00 125 I 7.85 3.82 2.02 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 1.57 0.78 0.98 0.00 0.00 126 R 8.18 3.92 0.00 1.95 2.04 0.00 3.17 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.87 0.00 127 E 8.28 4.04 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 2.32 2.33 0.00 128 A 7.41 4.48 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 0.00 129 D 8.34 4.70 0.00 2.80 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 0.00 130 I 8.09 3.88 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 1.47 0.85 0.92 0.00 0.00 131 D 8.40 4.49 0.00 2.81 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 0.00 132 G 8.09 3.87 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 0.00 0.00 0.00 133 D 8.06 4.50 0.00 2.76 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 G 9.70 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 0.00 135 Q 7.95 4.65 0.00 2.18 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.63 0.00 0.00 0.00 0.00 0.00 2.26 2.08 0.00 136 V 8.77 4.70 2.22 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 1.19 0.00 0.00 1.02 0.00 0.00 137 N 9.55 5.16 0.00 2.81 3.22 0.00 0.00 6.19 8.15 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 0.00 138 Y 8.34 3.18 0.00 2.04 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 0.00 139 E 8.16 3.75 0.00 2.13 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 0.00 2.39 2.45 0.00 140 E 8.58 3.98 0.00 2.32 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 2.45 2.43 0.00 141 F 8.20 4.13 0.00 3.24 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 0.00 142 V 7.32 3.24 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 0.73 0.00 0.00 0.30 0.00 0.00 143 Q 7.73 4.01 0.00 2.04 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.60 0.00 0.00 0.00 0.00 0.00 2.31 2.31 0.00 144 M 7.45 4.15 0.00 2.15 2.08 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.31 0.00 145 M 7.32 3.97 0.00 1.82 1.78 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.46 0.00 146 T 7.27 3.94 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 1.24 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.