NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 13 L 4.4521 8.1693 120.6391 54.8183 44.0581 177.7513 14 E 4.3785 8.0773 117.3904 54.0130 27.1445 172.8263 15 E 4.7003 9.1185 122.2095 57.0954 31.4487 178.2831 16 Y 4.3640 8.0948 114.9975 58.6187 39.2290 174.6431 17 A 4.6583 7.4020 121.1332 51.8971 23.1111 176.9637 18 S 4.7110 8.0886 114.3853 58.8610 62.5660 176.8671 19 A 4.4372 8.7167 122.7862 53.1804 19.4666 177.3553 20 E 4.4814 8.0548 115.9260 54.8175 26.4223 176.7835 21 D 4.8953 7.8557 129.1277 54.1609 42.1154 179.0078 22 I 3.5955 7.1572 118.9369 64.5802 37.5594 177.2864 23 S 4.3488 7.8183 116.5928 58.7246 62.4598 176.5083 24 R 3.8216 6.8810 118.8172 58.7841 30.0890 178.1117 25 V 3.7135 9.0552 118.2782 64.2021 30.7947 177.4847 26 R 3.8571 6.9449 120.4737 59.4456 30.7197 177.8935 27 A 4.1187 7.5437 118.6049 54.6626 18.3977 178.6020 28 E 4.2943 8.0474 115.8687 57.0101 30.8893 177.3327 29 L 4.9498 7.3690 117.3781 55.4855 40.9905 176.6158 30 L 4.5134 8.4341 119.8019 54.8154 43.4571 176.5608 31 T 4.1997 7.7540 112.8288 62.1383 68.8630 173.4169 32 C 4.2295 8.6861 122.1100 59.9858 25.7693 173.3082 33 P 4.2978 0.0000 0.0000 65.0594 31.2281 176.7664 34 E 4.4839 7.8646 116.9261 55.2689 30.1397 175.2021 35 L 3.7996 7.5630 120.0625 55.3722 42.6344 176.2847 36 N 4.4302 8.5460 124.0895 53.6544 38.2961 175.2419 37 T 4.2485 8.3509 116.4672 63.0055 69.2471 176.0233 38 S 4.5233 7.9145 115.8699 59.1259 63.7272 174.3622 39 L 4.5879 7.9383 119.5732 54.6580 43.7881 176.8039 40 A 4.5352 8.2724 119.0258 51.3149 20.2596 176.2364 41 G 4.3479 8.2902 101.3641 44.8743 0.0000 172.7785 42 T 4.7429 8.5312 114.5348 61.3692 71.2449 173.5790 43 I 4.4740 8.1939 119.8152 60.3798 38.4056 175.5011 44 I 4.5282 8.8363 117.7362 60.6213 39.2264 175.0048 45 E 4.7955 7.7176 122.8144 55.3980 32.8762 173.3880 46 I 5.0927 8.1256 125.3526 60.0142 41.7591 172.9384 47 D 4.4499 9.0895 125.3455 53.0497 44.5868 174.6585 48 K 3.9299 8.7149 120.5484 58.2305 32.1598 176.5999 49 N 4.4320 9.3412 119.2514 53.8644 36.3895 172.6024 50 Y 5.2410 8.0021 118.3453 56.5064 42.7000 173.5133 51 A 4.7753 7.4782 125.3408 50.5303 23.4112 174.9680 52 K 4.8894 8.9756 121.3549 54.6396 35.9589 175.2499 53 S 5.0560 8.9704 119.9233 56.9684 67.4362 172.4609 54 I 4.9115 8.5988 119.8850 59.3215 41.0640 174.4579 55 L 4.7810 8.7850 128.5512 53.3037 44.4495 175.1236 56 I 4.5265 8.2696 128.2333 60.1682 37.8690 176.0365 57 T 4.1459 8.2531 118.6895 61.8612 69.2688 173.9543 58 T 4.6958 8.0599 113.5435 59.3399 71.9976 174.1070 59 S 4.2421 8.4672 115.7162 60.5023 63.1285 174.4748 60 E 4.1369 7.3923 121.6414 56.6098 29.0620 177.1023 *62 V 4.0694 7.6198 110.1217 61.4417 32.8875 175.9138 63 A 4.3524 9.0872 125.8477 53.4481 19.5078 176.4986 64 D 4.7141 7.5336 113.9140 52.4107 42.3721 174.9789 65 D 4.7374 8.6123 116.5650 53.8423 39.2442 176.6638 66 Q 4.3895 9.5428 117.9906 55.9752 29.4319 176.5126 67 G 3.9167 7.9378 106.9008 44.8704 0.0000 172.9846 68 L 4.4192 7.8473 122.6401 54.9641 43.2663 175.5941 69 I 4.5817 8.1683 127.5869 59.8889 38.5894 175.6338 70 F 4.4149 9.1601 129.2321 58.8575 39.8560 175.6517 71 D 4.2199 8.4648 125.4861 57.3939 40.4596 178.7466 72 A 3.8566 6.6896 120.5355 54.9708 18.2601 179.4653 73 F 3.7635 7.9918 115.8908 60.4228 38.8216 178.0208 74 I 3.6847 7.9455 119.9880 64.1541 36.9286 178.0012 75 F 3.8662 8.2428 120.8396 61.0983 39.2633 176.5866 76 A 3.9525 8.8031 121.0546 55.3856 18.2121 179.5186 77 A 4.6097 8.2728 120.1333 54.8351 18.4001 179.7353 78 A 3.7987 7.8398 119.5141 55.0232 18.4145 179.3029 79 N 3.9536 8.1317 115.9386 56.8409 38.9629 176.5577 80 Y 4.2694 8.0165 121.0017 60.8758 39.0030 178.1926 81 V 3.3241 7.8398 119.8833 64.3861 30.9986 178.0989 82 A 3.8947 8.0597 121.5498 55.2840 18.1719 179.7135 83 Q 3.8066 8.0806 116.1103 58.9023 28.5103 178.7944 84 A 3.9238 7.8011 121.5016 54.8165 18.4042 179.4952 85 S 4.3026 7.7978 112.2903 60.6403 63.1843 175.7479 86 I 4.0802 7.2023 115.1277 59.9303 39.4439 174.9453 87 N 4.0550 8.1793 119.0516 54.3845 37.6834 173.1348 88 K 4.7522 7.4181 115.4721 54.4090 34.8193 176.9625 89 E 3.8043 8.6345 122.9732 58.4667 29.8015 176.4540 90 F 5.0541 7.6683 118.2645 55.6574 41.1686 174.4502 91 S 5.2177 8.4339 116.8911 56.9454 66.3651 173.3292 92 V 4.6381 8.6639 119.5668 61.5946 35.2662 173.2796 93 I 4.9249 8.3375 118.8157 59.8169 38.8564 175.4396 94 I 4.4596 8.4108 116.3774 60.4517 39.0419 175.2332 95 G 4.3035 7.6797 106.4640 46.1500 0.0000 172.4552 96 S 5.2638 8.4588 114.0759 56.9623 66.2088 173.8274 97 K 4.4196 9.1805 122.4558 55.1558 34.7210 174.6384 98 C 4.9158 8.4498 124.2633 57.6794 32.0423 173.4883 99 F 4.2572 8.5373 120.5907 55.5412 41.3963 174.4977 100 F 4.9275 8.5860 122.8594 56.0460 38.9851 175.2263 101 Y 4.3815 8.5874 122.4612 60.5166 38.2532 176.5030 102 A 4.6954 7.6629 119.5007 50.2333 21.9997 173.8308 103 P 4.7258 0.0000 0.0000 62.4426 32.8470 176.0670 104 L 4.4546 8.4977 120.7083 54.4955 43.4939 175.4857 105 K 4.9679 9.1083 122.4266 54.0460 35.1806 175.2782 106 L 3.9830 8.6408 128.8205 57.1216 42.2827 176.9943 107 G 4.1066 8.8605 114.2563 45.4154 0.0000 173.7348 108 D 4.7266 8.4225 120.5372 54.1563 42.1724 175.6899 109 V 4.7007 8.2684 121.4506 59.8478 33.5090 174.5760 110 L 4.6560 8.8541 128.0218 53.9472 43.8948 174.7697 111 E 4.9745 9.3951 126.0317 54.7304 31.8333 174.8417 112 L 5.2704 8.8380 125.1460 52.8970 44.9174 175.2441 113 E 4.9534 9.1181 122.5760 54.2706 33.3846 174.1941 114 A 5.2946 8.6444 127.5585 50.4165 22.5012 174.4580 115 H 5.3285 9.4346 119.2925 53.8683 32.1274 172.7323 116 A 4.8532 8.8267 126.2681 50.9301 19.5326 177.0450 117 L 4.1590 8.8133 123.8053 54.1415 42.5502 176.6925 118 F 4.2692 8.9416 125.4378 59.3613 39.3194 173.9392 119 D 4.2280 8.3151 124.1261 53.7003 43.7084 174.7414 120 E 4.7167 8.8244 123.2731 56.2506 31.4849 176.4498 121 T 4.3070 7.7577 114.9546 63.7363 69.4096 174.7549 122 S 4.7613 8.3792 115.9734 55.9591 64.8889 174.1093 123 K 4.1815 8.6188 125.8693 58.4570 33.1517 176.2413 124 K 4.8934 7.9959 122.0888 55.1163 33.1483 176.1930 125 R 4.7582 9.2417 125.8730 54.6136 34.8955 173.6824 126 D 5.2081 8.6493 122.0833 53.0045 43.2127 175.4065 127 V 4.7987 8.6040 122.8906 60.9934 34.6170 174.2869 128 K 4.7619 9.2039 128.4610 55.7558 33.3592 175.9624 129 V 5.1213 9.1461 125.8107 61.0374 34.6109 174.6751 130 V 5.0471 8.8832 125.6568 59.9885 34.5332 174.4247 131 G 4.6456 9.6019 110.4964 44.8768 0.0000 171.3755 132 H 5.3087 9.4548 119.9805 53.6703 33.4191 172.8646 133 V 4.5920 8.5937 121.1935 60.6879 33.7360 176.3005 134 K 3.6936 8.9581 129.3110 58.2327 31.0386 176.0333 135 E 4.5397 9.1208 126.4089 56.9605 29.5365 174.8427 136 I 4.3870 7.7499 121.7791 59.1545 38.6951 175.5509 137 K 4.4030 8.2264 125.9080 55.3257 33.0836 175.4676 *139 F 4.6964 8.2106 124.3863 58.2458 40.9713 173.1652 140 E 4.9873 7.7144 125.0232 54.8434 33.4265 174.0023 141 G 4.3357 8.9587 111.7158 45.6472 0.0000 171.8006 142 T 5.2879 8.8417 118.0314 61.5421 71.7218 173.3881 143 I 4.9519 8.8078 126.4315 59.6101 41.0910 174.3902 144 Q 4.9251 9.1552 126.2348 54.6317 30.4594 174.6595 145 V 4.7386 8.7525 125.1513 61.2469 34.0709 174.8034 146 V 5.6176 9.0436 120.5742 58.7658 34.8004 175.0937 147 S 5.3721 8.6593 118.7858 57.0798 65.9527 172.5628 148 T 4.7914 8.4709 109.0722 60.6159 71.3017 174.0173 149 D 4.6623 8.8587 121.2199 56.0008 41.3497 176.1672 150 E 4.4113 7.5764 116.7279 53.8724 33.8405 174.4774 151 H 3.4407 7.1659 119.8047 55.8932 30.1137 175.9702 152 I 3.6747 7.9286 126.5682 63.1175 37.8097 175.9396 153 F 5.1124 7.8982 116.6318 58.4046 39.6135 175.7227 154 K 4.2064 8.4272 125.6860 56.9637 32.5347 175.9566 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 13 L 8.17 4.45 0.00 1.70 1.88 0.95 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 14 E 8.08 4.38 0.00 2.22 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 0.00 2.32 2.34 0.00 15 E 9.12 4.70 0.00 1.93 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 1.89 0.00 16 Y 8.09 4.36 0.00 2.92 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 17 A 7.40 4.66 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 18 S 8.09 4.71 0.00 3.94 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 19 A 8.72 4.44 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 20 E 8.05 4.48 0.00 2.00 1.95 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 2.35 2.25 0.00 21 D 7.86 4.90 0.00 2.78 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 22 I 7.16 3.60 2.02 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 1.31 0.88 0.92 0.00 0.00 23 S 7.82 4.35 0.00 3.80 3.66 0.00 0.00 0.00 0.00 0.00 0.00 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 R 6.88 3.82 0.00 2.09 2.05 0.00 3.16 0.00 0.00 3.15 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.84 0.00 25 V 9.06 3.71 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 1.15 0.00 0.00 1.00 0.00 0.00 26 R 6.94 3.86 0.00 1.89 1.96 0.00 3.35 0.00 0.00 3.25 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.68 0.00 27 A 7.54 4.12 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 28 E 8.05 4.29 0.00 2.05 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 2.27 2.33 0.00 29 L 7.37 4.95 0.00 1.71 1.64 0.97 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 30 L 8.43 4.51 0.00 1.55 1.60 0.86 0.81 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 31 T 7.75 4.20 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 1.28 0.00 0.00 32 C 8.69 4.23 0.00 3.18 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 33 P 0.00 4.30 0.00 2.18 2.20 0.00 3.73 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 2.00 1.95 0.00 34 E 7.86 4.48 0.00 1.91 1.95 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 2.20 2.32 0.00 35 L 7.56 3.80 0.00 1.49 1.20 0.77 -0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 36 N 8.55 4.43 0.00 2.78 2.71 0.00 0.00 6.96 7.22 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 37 T 8.35 4.25 4.46 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 1.27 0.00 0.00 38 S 7.91 4.52 0.00 3.98 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 39 L 7.94 4.59 0.00 1.73 1.96 1.02 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 40 A 8.27 4.54 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.29 4.35 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 0.00 42 T 8.53 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 1.24 0.00 0.00 43 I 8.19 4.47 1.59 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.30 0.09 0.00 0.00 44 I 8.84 4.53 1.89 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.75 0.97 0.00 0.00 45 E 7.72 4.80 0.00 2.08 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 2.46 2.36 0.00 46 I 8.13 5.09 1.83 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.87 0.91 0.00 0.00 47 D 9.09 4.45 0.00 2.77 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 48 K 8.71 3.93 0.00 1.79 1.81 0.00 1.98 0.00 0.00 1.73 0.00 0.00 2.83 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.47 1.44 7.81 49 N 9.34 4.43 0.00 3.02 2.99 0.00 0.00 6.50 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 50 Y 8.00 5.24 0.00 2.92 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 51 A 7.48 4.78 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 K 8.98 4.89 0.00 1.64 1.56 0.00 1.65 0.00 0.00 1.75 0.00 0.00 2.98 0.00 0.00 3.33 0.00 0.00 0.00 0.00 1.29 1.48 7.81 53 S 8.97 5.06 0.00 3.86 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 54 I 8.60 4.91 1.76 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.67 0.55 0.00 0.00 55 L 8.79 4.78 0.00 1.69 1.45 0.98 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 56 I 8.27 4.53 1.83 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.56 0.89 0.00 0.00 57 T 8.25 4.15 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 1.27 0.00 0.00 58 T 8.06 4.70 4.18 0.00 0.00 0.00 0.00 0.00 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 59 S 8.47 4.24 0.00 3.97 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 60 E 7.39 4.14 0.00 1.80 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 2.28 2.38 0.00 *62 V 7.62 4.07 2.24 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 0.66 0.00 0.00 1.01 0.00 0.00 63 A 9.09 4.35 1.39 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 64 D 7.53 4.71 0.00 2.86 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 65 D 8.61 4.74 0.00 2.81 2.79 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 66 Q 9.54 4.39 0.00 2.08 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.76 0.00 0.00 0.00 0.00 0.00 2.31 2.42 0.00 67 G 7.94 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 68 L 7.85 4.42 0.00 1.82 1.79 0.96 1.10 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 69 I 8.17 4.58 1.93 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.97 1.00 0.00 0.00 70 F 9.16 4.41 0.00 3.21 3.39 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 71 D 8.46 4.22 0.00 2.00 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 0.00 0.00 0.00 72 A 6.69 3.86 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 F 7.99 3.76 0.00 3.28 3.12 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 74 I 7.95 3.68 2.12 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 1.43 0.70 0.34 0.00 0.00 75 F 8.24 3.87 0.00 3.33 3.29 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 76 A 8.80 3.95 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 0.00 0.00 0.00 0.00 0.00 0.00 77 A 8.27 4.61 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 78 A 7.84 3.80 1.10 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 0.00 0.00 79 N 8.13 3.95 0.00 2.14 2.86 0.00 0.00 6.83 7.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 Y 8.02 4.27 0.00 3.03 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 81 V 7.84 3.32 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 0.67 0.00 0.00 0.71 0.00 0.00 82 A 8.06 3.89 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 83 Q 8.08 3.81 0.00 2.34 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.75 0.00 0.00 0.00 0.00 0.00 2.39 2.39 0.00 84 A 7.80 3.92 1.12 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 85 S 7.80 4.30 0.00 4.05 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 I 7.20 4.08 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 1.40 0.66 0.91 0.00 0.00 87 N 8.18 4.05 0.00 3.03 2.78 0.00 0.00 6.96 7.73 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 88 K 7.42 4.75 0.00 1.75 1.67 0.00 1.83 0.00 0.00 1.64 0.00 0.00 2.97 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.48 1.34 7.81 89 E 8.63 3.80 0.00 1.56 1.12 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 1.54 2.01 0.00 90 F 7.67 5.05 0.00 3.23 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 91 S 8.43 5.22 0.00 3.81 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 92 V 8.66 4.64 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 1.02 0.00 0.00 0.86 0.00 0.00 93 I 8.34 4.92 2.00 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.85 0.93 0.00 0.00 94 I 8.41 4.46 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 1.25 0.76 0.92 0.00 0.00 95 G 7.68 4.30 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 0.00 96 S 8.46 5.26 0.00 4.09 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 97 K 9.18 4.42 0.00 1.80 1.65 0.00 1.29 0.00 0.00 1.59 0.00 0.00 2.82 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.33 1.22 7.81 98 C 8.45 4.92 0.00 2.46 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 0.00 0.00 0.00 0.00 99 F 8.54 4.26 0.00 2.15 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 0.00 0.00 0.00 100 F 8.59 4.93 0.00 2.84 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 0.00 101 Y 8.59 4.38 0.00 3.09 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 0.00 102 A 7.66 4.70 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 0.00 103 P 0.00 4.73 0.00 2.14 2.10 0.00 3.83 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.04 0.00 104 L 8.50 4.45 0.00 1.68 1.65 0.95 0.51 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 0.00 105 K 9.11 4.97 0.00 1.81 1.76 0.00 1.68 0.00 0.00 1.59 0.00 0.00 2.78 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.33 1.36 7.81 106 L 8.64 3.98 0.00 1.77 1.60 0.91 1.18 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 0.00 107 G 8.86 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 0.00 0.00 0.00 0.00 108 D 8.42 4.73 0.00 2.71 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 0.00 109 V 8.27 4.70 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 0.76 0.00 0.00 0.37 0.00 0.00 110 L 8.85 4.66 0.00 1.75 1.52 0.98 0.56 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 0.00 111 E 9.40 4.97 0.00 1.93 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 2.19 2.21 0.00 112 L 8.84 5.27 0.00 1.52 1.49 0.84 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 113 E 9.12 4.95 0.00 2.05 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 2.27 2.23 0.00 114 A 8.64 5.29 1.07 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 0.00 0.00 115 H 9.43 5.33 0.00 3.05 3.27 0.00 5.61 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 0.00 116 A 8.83 4.85 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 0.00 117 L 8.81 4.16 0.00 1.53 1.66 0.94 0.76 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 0.00 118 F 8.94 4.27 0.00 2.88 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 0.00 119 D 8.32 4.23 0.00 2.45 2.42 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 0.00 120 E 8.82 4.72 0.00 2.02 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 2.37 2.53 0.00 121 T 7.76 4.31 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 1.20 0.00 0.00 122 S 8.38 4.76 0.00 3.71 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 0.00 123 K 8.62 4.18 0.00 1.80 1.93 0.00 1.60 0.00 0.00 1.75 0.00 0.00 2.97 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.72 1.51 7.81 124 K 8.00 4.89 0.00 1.77 1.70 0.00 1.74 0.00 0.00 1.70 0.00 0.00 2.90 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.39 1.41 7.81 125 R 9.24 4.76 0.00 1.70 1.74 0.00 3.32 0.00 0.00 3.18 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.59 0.00 126 D 8.65 5.21 0.00 2.60 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 V 8.60 4.80 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.94 0.00 0.00 128 K 9.20 4.76 0.00 1.81 1.76 0.00 1.58 0.00 0.00 1.60 0.00 0.00 2.92 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.45 1.44 7.81 129 V 9.15 5.12 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 1.22 0.00 0.00 0.93 0.00 0.00 130 V 8.88 5.05 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 0.84 0.00 0.00 1.06 0.00 0.00 131 G 9.60 4.65 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 0.00 0.00 0.00 132 H 9.45 5.31 0.00 3.06 3.39 0.00 5.56 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 V 8.59 4.59 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 1.03 0.00 0.00 0.98 0.00 0.00 134 K 8.96 3.69 0.00 1.98 0.97 0.00 1.83 0.00 0.00 1.74 0.00 0.00 2.99 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.42 1.50 7.81 135 E 9.12 4.54 0.00 1.98 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 2.27 2.28 0.00 136 I 7.75 4.39 2.01 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 1.21 0.73 0.93 0.00 0.00 137 K 8.23 4.40 0.00 1.50 1.59 0.00 1.64 0.00 0.00 1.60 0.00 0.00 2.86 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.37 1.39 7.81 *139 F 8.21 4.70 0.00 3.28 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 E 7.71 4.99 0.00 2.17 1.62 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 2.18 2.29 0.00 141 G 8.96 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 0.00 0.00 0.00 0.00 142 T 8.84 5.29 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 0.00 143 I 8.81 4.95 1.87 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 1.29 0.77 0.93 0.00 0.00 144 Q 9.16 4.93 0.00 2.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.79 0.00 0.00 0.00 0.00 0.00 2.48 2.31 0.00 145 V 8.75 4.74 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 0.91 0.00 0.00 0.94 0.00 0.00 146 V 9.04 5.62 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 0.52 0.00 0.00 0.93 0.00 0.00 147 S 8.66 5.37 0.00 3.95 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 T 8.47 4.79 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 0.00 149 D 8.86 4.66 0.00 2.70 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 0.00 150 E 7.58 4.41 0.00 1.72 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 2.16 2.23 0.00 151 H 7.17 3.44 0.00 2.30 2.84 0.00 5.69 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 I 7.93 3.67 1.69 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.77 0.32 0.00 0.00 153 F 7.90 5.11 0.00 3.10 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 0.00 154 K 8.43 4.21 0.00 1.73 1.71 0.00 1.58 0.00 0.00 1.73 0.00 0.00 2.99 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.34 1.39 7.81 * Residues marked with a * may have inaccurate shift predictions.