NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 T 4.3915 8.0333 112.9203 60.0524 70.6124 174.2068 6 E 3.8421 8.7805 117.7927 61.7369 29.1139 175.9277 7 E 4.0808 8.6101 119.9001 59.6204 29.7939 179.1236 8 Q 3.8298 7.9627 120.2414 60.5325 28.2585 181.4336 9 I 4.1211 8.1660 120.8851 64.6653 37.2302 178.5212 10 A 4.1173 8.4421 121.7683 54.7490 18.0164 179.2513 11 E 3.8844 8.4983 118.7705 59.6431 29.7292 178.7349 12 F 4.8406 8.4856 118.1300 60.9095 38.9354 177.9445 13 K 4.1971 8.5934 121.5276 60.3375 31.8597 179.2733 14 E 4.0522 8.3108 117.0471 61.1728 29.7712 180.5933 15 A 4.5328 8.6605 121.6130 55.1835 18.5553 179.1766 16 F 3.2746 8.7333 119.5702 61.8063 39.1226 177.7144 17 S 4.2158 8.5086 113.2457 61.2981 62.5934 176.3256 18 L 4.0563 8.0254 121.8677 57.5175 41.3188 179.2924 19 F 4.1971 7.7363 116.3805 59.8021 40.7253 177.3341 20 D 4.7250 7.6836 120.4986 52.9331 37.8387 176.1117 21 K 3.8591 8.1250 123.0916 59.0928 32.5677 178.3834 22 D 4.3727 8.1685 115.9890 54.1361 39.5693 176.8300 23 G 3.9044 7.9032 107.4804 46.6624 0.0000 173.9584 24 D 4.5023 8.3719 117.5411 53.2427 39.5809 177.2725 25 G 4.1546 10.2592 110.2685 45.5175 0.0000 172.8978 26 T 5.3265 8.0037 108.3097 60.2357 72.4819 173.6383 27 I 4.7216 9.3850 125.2551 59.6136 38.7044 175.9568 28 T 4.5942 8.5102 118.3345 60.6495 70.8474 175.9567 29 T 3.9211 8.4763 111.6228 64.7183 68.6266 176.4126 30 K 3.9642 7.9604 122.0945 59.4177 32.2846 178.5747 31 E 4.0197 8.1021 118.5048 58.9914 29.3290 179.1463 32 L 4.1886 7.9100 120.3567 58.2469 42.1715 179.3593 33 G 3.6696 8.1949 105.5685 47.7533 0.0000 175.8710 34 T 3.8398 7.7819 118.1034 66.6481 68.5644 176.7939 35 V 3.4695 7.6861 119.9373 66.1848 31.4365 177.8796 36 M 4.0374 8.1120 118.2488 58.6785 31.6615 178.9137 37 R 4.7604 7.8900 118.1358 58.8375 30.3992 178.9007 38 S 4.2970 8.1391 114.8926 61.6308 62.7054 177.9831 39 L 4.4889 7.7059 119.3511 54.6955 41.7628 178.0119 40 G 3.8654 7.9343 105.3148 46.2613 0.0000 174.4835 41 Q 4.5392 7.9799 118.8217 54.6718 30.8022 174.9772 42 N 4.9224 8.0375 116.5217 51.8600 39.0485 172.3766 43 P 4.7010 0.0000 0.0000 61.6770 32.9631 177.6123 44 T 4.2779 8.3184 112.4763 60.8234 71.0728 175.4270 45 E 3.8530 8.7923 122.2529 59.7476 29.3670 178.7235 46 A 3.9838 8.0938 119.7931 55.5204 17.8336 179.0459 47 E 3.8963 7.8346 115.8620 59.7536 29.6008 179.6470 48 L 4.0251 8.0407 118.7208 57.9625 41.6242 179.7512 49 Q 3.9591 8.4081 118.0081 59.2439 28.7780 178.3585 50 D 4.4259 8.3123 120.0115 57.7603 40.5996 179.1019 51 M 4.0538 8.3496 118.4102 58.6476 32.4621 178.7294 52 I 3.8746 7.9582 119.8212 64.2500 37.0452 178.3026 53 N 4.4601 8.6473 118.0911 56.0908 38.1658 177.0618 54 E 4.0348 8.0874 119.3283 58.6466 29.5766 178.2350 55 V 4.2681 7.0784 107.5029 60.7504 32.9272 175.8106 56 D 4.7013 7.6298 120.9706 52.8782 39.4695 175.7592 57 A 4.1089 9.2537 129.8601 55.0085 18.9708 179.0711 58 D 4.6294 8.4739 113.2952 52.7801 39.4015 176.5742 59 G 4.0165 7.7380 105.1845 46.7995 0.0000 173.9590 60 N 4.5523 8.3319 114.0866 52.7202 37.1525 177.0519 61 G 4.0533 9.1317 109.7521 45.7001 0.0000 173.5937 62 T 4.7333 7.5030 107.9204 59.7237 72.2258 173.2522 63 I 4.8279 8.4710 122.2876 59.4077 40.4272 174.8046 64 D 5.2311 9.2877 129.7105 52.0590 42.0870 177.1845 65 F 3.3866 8.1053 120.4913 60.9078 38.9785 175.3359 66 P 3.9369 0.0000 0.0000 65.3278 31.0713 177.9588 67 E 3.9633 7.9537 117.9405 58.8956 29.3331 178.7359 68 F 4.0026 8.1534 120.7988 61.2686 39.5393 176.7444 69 L 3.3026 8.0338 120.2956 58.5302 41.4106 179.2382 70 T 3.6959 7.1378 114.6232 66.6456 68.6614 176.0875 71 M 3.9478 7.5259 119.8298 58.9618 32.1255 178.1416 72 M 3.4929 7.8127 118.1160 57.5378 31.9641 177.7791 73 A 4.4153 7.3735 118.7546 51.5130 20.0320 177.6504 74 R 3.7568 7.1275 116.4973 56.1657 30.6498 176.6723 75 K 4.0550 8.3964 122.5820 56.1346 31.7488 175.9045 76 M 4.2407 8.5471 129.5781 54.9889 33.0462 177.3043 *77 K 4.1680 8.5695 131.1715 56.4453 33.8105 173.6754 78 D 4.7039 8.8509 123.9799 57.0519 38.9122 179.5668 79 T 3.8677 7.9583 111.2859 64.0311 68.5537 175.8113 80 D 4.3709 7.9029 121.2309 57.1667 41.0448 178.4964 81 S 4.1328 8.7168 116.2503 61.5616 62.7794 176.1406 82 E 3.9698 8.3219 121.9512 59.5334 29.3075 178.4724 83 E 3.9442 7.9438 119.1594 59.3092 29.6962 178.2894 84 E 3.9945 8.7029 119.5918 59.5709 29.6277 178.9720 85 I 4.0325 8.3893 120.2127 64.3954 37.1487 178.6200 86 R 4.2169 8.6007 119.3730 59.5369 29.7080 178.9752 87 E 4.0757 8.3797 117.0146 59.2535 29.6282 179.0414 88 A 4.3284 8.3201 120.9718 55.1793 18.5771 179.2917 89 F 3.2265 8.8240 119.5761 61.4240 39.2397 177.4310 90 R 4.2317 8.0712 115.7311 58.3670 29.8312 178.5611 91 V 3.7805 7.6875 118.1089 65.4525 31.6802 177.6818 92 F 4.1229 7.8888 116.3829 59.7274 40.6001 177.2351 93 D 4.6818 7.9493 120.6230 54.0870 37.1205 176.5204 94 K 3.9369 7.9300 122.5673 59.3923 33.1878 179.0879 95 D 4.4047 8.4236 117.3205 53.3879 39.5179 176.1527 96 G 3.9437 7.6662 108.1854 46.9817 0.0000 173.8172 97 N 4.7327 8.8558 114.3781 51.8843 37.5863 175.6039 98 G 3.9936 9.1357 106.0174 46.4487 0.0000 173.4609 99 Y 4.9504 8.1188 115.5723 56.1858 41.8993 174.8430 100 I 4.3273 9.2322 126.3466 60.0279 37.8550 176.2081 101 S 4.9629 9.0223 122.3251 57.4404 66.0297 174.3725 102 A 4.1413 8.4514 121.5662 54.6267 18.2010 179.6400 103 A 3.8976 7.8824 119.3474 55.4147 18.6086 179.5378 104 E 3.9953 8.1475 117.1146 59.5544 29.5647 179.3996 105 L 4.1853 7.9427 120.0846 58.0156 42.0734 179.0666 106 R 3.8876 8.1493 118.8493 59.5733 30.0549 178.0972 107 H 4.1527 8.1673 115.9478 58.9834 28.6888 177.6068 108 V 3.4325 7.8514 119.7025 66.4874 31.1978 177.6469 109 M 4.0248 8.2177 118.0583 59.0752 31.8964 179.1395 110 T 4.0579 8.1051 115.5602 66.6970 68.4027 176.7322 111 N 4.3746 8.4460 117.9275 56.0995 38.6745 176.9359 112 L 4.0711 7.8592 118.4298 55.7768 41.7527 178.0057 113 G 3.9663 7.9402 108.0576 45.0173 0.0000 174.1387 114 E 3.8722 7.5940 122.2617 57.0385 29.7878 177.1509 *115 K 4.4886 8.3654 125.3662 52.9052 32.5742 173.0118 116 L 5.0284 8.0635 123.4048 51.5237 46.0030 176.7702 117 T 4.4640 8.6594 111.1941 60.8124 71.6384 175.7027 118 D 4.4260 8.5234 121.2282 57.4876 40.7513 179.0593 119 E 3.9949 8.0878 118.9187 59.2384 29.5041 178.9203 120 E 3.9561 8.1669 118.6738 59.2701 29.4694 179.3806 121 V 3.5877 8.1103 118.6201 66.3955 31.6510 177.6623 122 D 4.3626 8.2541 118.4789 57.3954 40.5187 178.7748 123 E 3.9035 8.2529 119.7169 59.5682 29.8066 178.6429 124 M 4.0157 8.2261 119.0227 58.5286 31.9550 178.8946 125 I 3.7148 8.0691 120.0596 64.2588 37.0765 178.2022 126 R 3.9416 8.1534 121.0507 60.3986 29.9930 178.6590 127 E 4.1067 8.6987 116.6743 60.9768 29.7951 180.4176 128 A 4.5154 7.7802 119.5066 53.1227 20.0745 178.3684 129 D 4.8060 7.9363 118.6831 53.1072 38.6371 176.4561 130 I 3.7173 8.5767 124.7444 63.8991 37.6347 177.0479 131 D 4.6654 8.5733 118.3091 52.9221 39.2339 176.4915 132 G 3.9310 7.5403 106.3290 47.1351 0.0000 174.0577 133 D 4.6226 8.2028 117.1842 52.5220 39.4860 177.7469 134 G 4.0217 8.8860 108.1035 46.0084 0.0000 173.5416 135 Q 4.6723 7.7820 115.8389 54.5646 32.4665 174.6755 136 V 4.6022 8.7479 120.8229 61.5279 33.2849 175.4200 137 N 4.8074 9.0967 126.7379 52.1513 39.5160 175.4937 138 Y 3.2789 8.4708 118.5668 60.7954 38.5662 177.8346 139 E 3.7891 8.1648 117.6650 59.2648 29.4652 178.7957 140 E 3.9400 8.8664 120.3113 59.0987 29.6150 178.7547 141 F 4.0750 8.2401 120.8027 61.1964 39.5191 177.4032 142 V 3.2767 7.7820 118.1906 66.0004 31.1165 177.6723 143 Q 3.8900 7.9294 118.2641 59.3799 28.8224 177.7339 144 M 4.0848 7.6694 118.2881 58.4547 32.4837 177.7708 145 M 4.0137 8.0527 117.7698 56.8722 32.1128 176.4732 146 T 4.1300 7.3903 113.6273 61.5692 69.0142 173.6969 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 5 T 8.03 4.39 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 6 E 8.78 3.84 0.00 2.13 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 0.00 2.42 2.54 0.00 7 E 8.61 4.08 0.00 1.95 1.85 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 2.39 2.30 0.00 8 Q 7.96 3.83 0.00 2.05 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.91 0.00 0.00 0.00 0.00 0.00 2.37 2.04 0.00 9 I 8.17 4.12 2.10 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.91 1.10 0.00 0.00 10 A 8.44 4.12 1.41 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 0.00 0.00 0.00 11 E 8.50 3.88 0.00 2.09 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 2.30 2.34 0.00 12 F 8.49 4.84 0.00 3.66 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 13 K 8.59 4.20 0.00 2.00 1.86 0.00 1.47 0.00 0.00 1.37 0.00 0.00 2.67 0.00 0.00 2.81 0.00 0.00 0.00 0.00 0.30 1.08 7.81 14 E 8.31 4.05 0.00 2.11 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 2.27 2.21 0.00 15 A 8.66 4.53 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 F 8.73 3.27 0.00 3.20 3.28 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 17 S 8.51 4.22 0.00 4.09 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 L 8.03 4.06 0.00 1.59 1.40 0.91 0.72 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 19 F 7.74 4.20 0.00 2.74 2.84 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 20 D 7.68 4.73 0.00 2.30 2.47 0.00 0.00 0.00 0.00 0.00 0.00 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 8.13 3.86 0.00 1.86 1.85 0.00 1.76 0.00 0.00 1.81 0.00 0.00 2.92 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.56 1.36 7.81 22 D 8.17 4.37 0.00 2.81 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 23 G 7.90 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 24 D 8.37 4.50 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 25 G 10.26 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 26 T 8.00 5.33 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 1.31 0.00 0.00 27 I 9.39 4.72 1.72 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.42 1.21 0.84 0.00 0.00 28 T 8.51 4.59 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 29 T 8.48 3.92 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 1.26 0.00 0.00 30 K 7.96 3.96 0.00 1.84 1.84 0.00 1.72 0.00 0.00 1.81 0.00 0.00 2.94 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.50 1.53 7.81 31 E 8.10 4.02 0.00 2.05 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 2.32 2.30 0.00 32 L 7.91 4.19 0.00 1.90 1.87 1.05 1.27 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 33 G 8.19 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 T 7.78 3.84 4.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 35 V 7.69 3.47 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 0.62 0.00 0.00 0.80 0.00 0.00 36 M 8.11 4.04 0.00 2.13 2.22 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.80 2.64 0.00 37 R 7.89 4.76 0.00 1.95 1.98 0.00 3.13 0.00 0.00 3.07 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.59 0.00 38 S 8.14 4.30 0.00 4.03 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 39 L 7.71 4.49 0.00 1.68 1.60 0.82 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 40 G 7.93 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 41 Q 7.98 4.54 0.00 2.15 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.86 0.00 0.00 0.00 0.00 0.00 2.30 2.43 0.00 42 N 8.04 4.92 0.00 2.58 2.66 0.00 0.00 7.06 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 4.70 0.00 2.09 2.06 0.00 3.78 0.00 0.00 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.04 0.00 44 T 8.32 4.28 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 1.26 0.00 0.00 45 E 8.79 3.85 0.00 2.02 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 2.39 2.36 0.00 46 A 8.09 3.98 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 47 E 7.83 3.90 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 2.34 2.37 0.00 48 L 8.04 4.03 0.00 1.86 1.74 0.93 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 49 Q 8.41 3.96 0.00 2.24 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 2.62 2.55 0.00 50 D 8.31 4.43 0.00 2.84 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 8.35 4.05 0.00 1.94 2.36 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 2.64 2.59 0.00 52 I 7.96 3.87 2.04 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 1.53 0.72 0.98 0.00 0.00 53 N 8.65 4.46 0.00 2.84 2.86 0.00 0.00 6.88 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 54 E 8.09 4.03 0.00 2.21 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 2.34 2.40 0.00 55 V 7.08 4.27 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 0.62 0.00 0.00 0.92 0.00 0.00 56 D 7.63 4.70 0.00 2.78 2.61 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 57 A 9.25 4.11 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 58 D 8.47 4.63 0.00 2.84 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 59 G 7.74 4.02 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 0.00 60 N 8.33 4.55 0.00 2.94 3.27 0.00 0.00 6.97 6.59 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 61 G 9.13 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 0.00 0.00 0.00 62 T 7.50 4.73 4.27 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 1.23 0.00 0.00 63 I 8.47 4.83 1.91 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.61 0.95 0.00 0.00 64 D 9.29 5.23 0.00 2.88 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 65 F 8.11 3.39 0.00 2.16 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 66 P 0.00 3.94 0.00 2.24 2.25 0.00 3.65 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.06 0.00 67 E 7.95 3.96 0.00 2.30 2.15 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 2.31 2.40 0.00 68 F 8.15 4.00 0.00 3.39 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 69 L 8.03 3.30 0.00 0.95 1.27 0.87 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 70 T 7.14 3.70 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 1.13 0.00 0.00 71 M 7.53 3.95 0.00 1.82 1.85 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.32 0.00 72 M 7.81 3.49 0.00 0.51 0.91 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.00 0.00 73 A 7.37 4.42 1.31 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 0.00 0.00 0.00 74 R 7.13 3.76 0.00 1.93 1.85 0.00 3.10 0.00 0.00 3.11 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.68 0.00 75 K 8.40 4.06 0.00 1.69 1.75 0.00 1.66 0.00 0.00 1.64 0.00 0.00 3.05 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.42 1.48 7.81 76 M 8.55 4.24 0.00 2.01 1.96 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.61 0.00 *77 K 8.57 4.17 0.00 1.80 1.68 0.00 1.88 0.00 0.00 1.87 0.00 0.00 2.91 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.44 1.07 7.81 78 D 8.85 4.70 0.00 2.94 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 79 T 7.96 3.87 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 1.22 0.00 0.00 80 D 7.90 4.37 0.00 2.93 2.76 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 81 S 8.72 4.13 0.00 4.00 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 82 E 8.32 3.97 0.00 2.15 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 2.42 2.53 0.00 83 E 7.94 3.94 0.00 2.21 2.16 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 2.33 2.40 0.00 84 E 8.70 3.99 0.00 2.07 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 2.41 2.44 0.00 85 I 8.39 4.03 2.18 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.89 1.11 0.00 0.00 86 R 8.60 4.22 0.00 2.06 1.96 0.00 3.04 0.00 0.00 2.92 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 2.02 0.00 87 E 8.38 4.08 0.00 2.20 2.09 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 2.59 2.52 0.00 88 A 8.32 4.33 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 89 F 8.82 3.23 0.00 3.11 3.33 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 90 R 8.07 4.23 0.00 2.09 2.01 0.00 3.23 0.00 0.00 3.42 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.90 0.00 91 V 7.69 3.78 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 0.59 0.00 0.00 0.98 0.00 0.00 92 F 7.89 4.12 0.00 2.70 2.84 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 93 D 7.95 4.68 0.00 1.80 2.26 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 94 K 7.93 3.94 0.00 1.86 1.88 0.00 1.57 0.00 0.00 1.69 0.00 0.00 3.04 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.49 1.41 7.81 95 D 8.42 4.40 0.00 2.84 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 G 7.67 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 97 N 8.86 4.73 0.00 2.98 2.99 0.00 0.00 6.81 6.28 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 98 G 9.14 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 99 Y 8.12 4.95 0.00 2.96 2.97 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 0.00 100 I 9.23 4.33 1.98 0.00 0.00 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 -0.09 0.90 0.00 0.00 101 S 9.02 4.96 0.00 4.06 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 0.00 102 A 8.45 4.14 1.38 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 0.00 0.00 0.00 103 A 7.88 3.90 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 8.15 4.00 0.00 2.09 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 2.36 2.35 0.00 105 L 7.94 4.19 0.00 1.97 1.73 1.16 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 106 R 8.15 3.89 0.00 2.08 2.02 0.00 3.09 0.00 0.00 3.21 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.65 0.00 107 H 8.17 4.15 0.00 3.39 3.28 0.00 5.69 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 0.00 108 V 7.85 3.43 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 0.56 0.00 0.00 0.81 0.00 0.00 109 M 8.22 4.02 0.00 2.10 2.20 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 2.70 3.13 0.00 110 T 8.11 4.06 4.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 111 N 8.45 4.37 0.00 2.71 2.82 0.00 0.00 7.10 7.88 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 0.00 112 L 7.86 4.07 0.00 1.82 1.65 0.73 1.14 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 0.00 113 G 7.94 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 0.00 114 E 7.59 3.87 0.00 2.02 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 2.36 2.43 0.00 *115 K 8.37 4.49 0.00 1.79 1.61 0.00 1.75 0.00 0.00 1.70 0.00 0.00 2.91 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.30 1.25 7.81 116 L 8.06 5.03 0.00 1.55 1.55 0.94 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 117 T 8.66 4.46 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 1.28 0.00 0.00 118 D 8.52 4.43 0.00 2.74 2.76 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 0.00 119 E 8.09 3.99 0.00 2.06 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 2.46 0.00 120 E 8.17 3.96 0.00 2.27 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 2.33 2.32 0.00 121 V 8.11 3.59 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 0.00 122 D 8.25 4.36 0.00 2.94 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 0.00 123 E 8.25 3.90 0.00 2.18 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 2.31 2.35 0.00 124 M 8.23 4.02 0.00 2.11 2.29 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.79 2.61 0.00 125 I 8.07 3.71 2.06 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 0.88 0.94 0.00 0.00 126 R 8.15 3.94 0.00 1.98 2.16 0.00 3.27 0.00 0.00 3.27 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.67 0.00 127 E 8.70 4.11 0.00 2.07 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 2.20 0.00 128 A 7.78 4.52 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 7.94 4.81 0.00 2.96 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 0.00 130 I 8.58 3.72 1.88 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 1.35 0.52 0.92 0.00 0.00 131 D 8.57 4.67 0.00 2.89 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 0.00 132 G 7.54 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 0.00 133 D 8.20 4.62 0.00 2.77 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 0.00 134 G 8.89 4.02 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 0.00 135 Q 7.78 4.67 0.00 2.26 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.61 6.64 0.00 0.00 0.00 0.00 0.00 2.47 2.49 0.00 136 V 8.75 4.60 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 1.14 0.00 0.00 1.00 0.00 0.00 137 N 9.10 4.81 0.00 2.81 3.15 0.00 0.00 6.18 7.60 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 0.00 138 Y 8.47 3.28 0.00 2.37 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 0.00 139 E 8.16 3.79 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 2.45 2.43 0.00 140 E 8.87 3.94 0.00 2.25 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.76 0.00 141 F 8.24 4.08 0.00 3.30 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 V 7.78 3.28 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 0.81 0.00 0.00 0.27 0.00 0.00 143 Q 7.93 3.89 0.00 2.23 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.75 0.00 0.00 0.00 0.00 0.00 2.34 2.37 0.00 144 M 7.67 4.08 0.00 1.94 2.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.62 0.00 145 M 8.05 4.01 0.00 1.74 1.79 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.31 0.00 146 T 7.39 4.13 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 1.16 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.