NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 E 4.4241 8.2985 121.7435 55.9800 31.2261 174.8643 3 A 4.4995 8.7270 128.5193 51.0923 19.4799 171.1528 4 V 4.3964 8.7824 120.9370 61.0573 33.8228 173.5704 5 K 4.8805 8.4544 127.7299 55.1200 35.0559 175.0618 6 T 4.6231 8.8396 119.8986 61.1982 70.3713 173.2384 7 D 4.5607 8.6057 126.1405 56.2509 41.3903 178.1969 8 R 4.2684 7.9670 116.1821 56.7023 29.9434 175.9634 9 A 4.6686 7.6126 119.6767 49.6113 22.3317 174.5093 10 P 4.0684 0.0000 0.0000 62.6737 31.7528 176.5485 11 A 4.0207 8.5211 125.7315 52.1755 18.8737 177.5343 12 A 4.0861 8.0341 123.9311 50.4465 17.2280 176.6304 13 I 4.0175 8.6446 121.4385 61.3532 36.3269 176.3301 14 G 4.1988 7.7432 112.4701 43.9080 0.0000 169.7635 15 P 4.6141 0.0000 0.0000 62.3304 30.1981 175.7713 16 Y 4.8714 7.4951 114.6758 55.5580 41.1730 173.1411 17 A 4.6556 8.2559 122.1583 50.0020 21.9340 176.5734 18 Q 4.4032 8.6508 118.5782 59.2321 29.9567 176.3695 19 A 4.9774 7.5181 117.0895 51.2632 22.7213 175.3230 20 V 4.8575 8.7294 119.3769 61.0950 34.8744 174.5132 21 K 5.0604 9.2856 127.7206 55.2832 33.0714 176.1187 22 A 4.5349 9.5974 126.1917 52.5098 22.4041 175.9268 23 G 4.3255 10.2344 108.7308 46.3855 0.0000 174.6285 24 G 3.7621 8.6071 108.4146 44.3014 0.0000 173.4641 25 F 5.2454 8.3434 117.7952 55.4988 43.0669 174.3403 26 V 4.7909 8.8995 119.4925 61.3832 34.1478 174.1314 27 F 4.8779 9.4097 127.9276 56.1305 40.3456 174.9458 28 V 4.7013 8.6750 125.1195 61.3325 33.0775 175.7980 29 S 4.4539 8.9577 124.1785 58.0841 63.8172 174.3780 30 G 3.8022 8.5428 109.3911 46.4550 0.0000 172.8430 31 Q 4.9285 9.3228 125.5667 54.4272 31.0368 174.9086 32 I 4.9631 8.0764 115.2356 57.3404 41.3134 174.4138 33 P 4.6810 0.0000 0.0000 62.4339 29.2107 176.5736 34 L 4.9645 7.6357 118.5303 52.7558 44.0238 177.3025 35 A 4.2927 8.6959 126.7130 51.0197 19.2386 176.3305 36 P 4.3345 0.0000 0.0000 65.9286 31.3426 177.9620 37 D 4.4050 7.9635 114.9547 54.4227 39.3716 176.8696 38 G 4.0721 8.2690 108.6131 45.0857 0.0000 174.2823 39 S 4.3838 9.1016 115.4277 58.1729 64.5915 172.9621 40 L 4.6078 8.3005 123.4472 54.1344 42.9925 175.8220 41 V 4.0895 8.6888 127.6664 62.0907 31.8435 175.1902 42 E 4.6197 10.2892 127.4643 54.4554 31.7906 176.9420 43 G 3.8002 8.0654 106.7801 44.6571 0.0000 172.6189 44 D 4.7085 8.1651 121.4257 52.1699 41.7365 176.6359 45 I 3.7250 8.3395 112.9338 64.6221 37.1679 177.8220 46 R 4.1329 8.1597 119.5345 59.0207 29.5505 179.0013 47 V 3.6190 7.9877 117.4113 66.1217 31.5673 178.1777 48 Q 4.0320 8.0303 117.3994 59.2688 28.6207 178.4885 49 T 4.0166 8.9857 117.9392 66.7701 68.2743 176.0866 50 E 3.9848 7.9190 119.8156 59.1877 29.9624 178.5887 51 R 4.0434 7.7030 118.3020 59.3426 30.0863 178.9105 52 V 3.5615 7.6099 115.7332 64.2072 31.9687 177.1055 *54 E 4.1529 8.1420 118.3513 56.0931 31.6289 177.9084 55 N 4.2912 8.5403 116.4560 56.2884 38.5202 177.0284 56 L 3.9788 8.1035 120.6668 57.9676 41.8024 179.4962 57 K 3.7830 8.0150 118.3292 59.6579 32.0700 178.3647 58 A 3.9759 8.0486 120.7646 55.0495 18.3286 179.8146 59 V 3.5429 7.9074 116.6954 66.2070 31.6487 178.1866 60 L 4.0367 8.2330 119.0746 57.8660 41.3644 179.4942 61 E 4.2576 8.4828 119.5146 58.9608 29.2853 179.2777 62 A 4.0188 7.9810 118.7812 54.4965 18.4450 178.6834 63 A 4.3281 7.5525 117.4262 52.6054 18.8460 178.2301 64 G 4.1513 8.7650 106.8286 45.1079 0.0000 172.7370 65 S 5.0714 7.5135 116.0731 55.9956 63.5235 172.6818 66 G 3.9785 8.1012 106.8799 45.0761 0.0000 173.3709 67 L 4.0031 8.0378 118.5270 57.6270 41.5532 179.8468 68 S 4.3032 8.0167 111.3979 60.1038 63.4680 174.7776 69 R 4.3980 8.0372 119.8076 55.8302 30.2759 175.8710 70 V 4.2027 7.5238 119.3167 62.9688 31.9910 175.8830 71 V 4.3649 8.6228 119.9010 62.0715 33.9515 175.5522 72 Q 5.1887 7.8432 120.8070 54.7838 32.9226 173.4444 73 T 5.1915 8.9650 114.8663 60.3830 73.0021 172.6883 74 T 4.6963 9.1023 121.1425 62.1588 71.3184 172.7496 75 C 5.1279 8.8801 125.4449 57.9304 30.7921 172.9406 76 F 5.2747 9.3163 123.4793 55.7201 40.9195 174.8541 77 L 5.1422 8.7903 123.4552 52.9339 44.2954 177.4407 78 A 4.0547 8.4044 123.0093 54.2177 19.4411 176.9079 79 D 4.5072 7.5119 114.8491 53.3271 43.2891 175.0313 *81 E 4.3889 8.7007 113.2689 56.8072 31.6128 177.2549 82 D 4.3813 7.9994 117.2434 55.5967 40.7090 177.8646 83 F 4.0232 7.6985 122.4283 61.1227 39.2577 174.9645 84 P 4.2789 0.0000 0.0000 65.7667 31.3047 178.5382 85 G 3.7162 8.1261 103.5664 47.9619 0.0000 175.0826 86 F 4.2661 8.0968 124.5231 60.4427 39.3924 176.7506 87 N 3.6986 8.2568 116.9986 56.3531 38.4090 176.4807 88 E 3.8710 8.2188 120.3629 59.0695 29.5058 178.4824 89 V 3.8937 7.6596 117.4531 65.1743 31.5342 177.4723 90 Y 3.9821 7.8030 119.5339 60.5244 38.4022 177.5636 91 A 4.1804 8.0826 120.3425 54.8450 18.4547 179.4597 92 R 3.8888 7.5450 115.2974 59.0236 30.1506 177.3629 93 Y 3.9834 7.5699 115.0068 58.6233 38.6284 175.7398 94 F 4.8557 7.7455 117.1829 56.2244 40.8724 175.0557 95 T 4.6346 8.2004 118.4180 60.7623 72.0834 172.3848 96 P 3.7348 0.0000 0.0000 61.6331 31.7858 174.5250 97 P 4.2959 0.0000 0.0000 62.1581 31.8370 176.0064 98 Y 4.5422 8.1755 121.0271 57.3652 38.4613 174.1166 99 P 4.7628 0.0000 0.0000 62.2274 32.7714 175.8905 100 A 4.3498 9.2489 124.1116 51.9585 19.5373 176.7779 101 R 5.1433 8.4861 120.4554 54.4433 33.9881 174.2555 102 A 4.6261 8.5855 125.0374 50.5107 22.0389 174.9925 103 T 4.9367 8.4409 118.8734 61.9499 71.4971 173.8241 104 V 4.4669 8.4308 123.9105 61.5687 35.8207 172.5785 105 A 5.1032 8.4800 126.6117 50.6503 20.3928 176.9647 106 V 4.2834 8.3565 116.3047 59.2778 34.1270 176.3995 107 K 4.0119 8.7243 121.8942 59.4711 32.2205 176.4933 108 A 4.4720 7.2568 117.0295 51.3943 21.6699 174.7197 109 L 4.7640 7.8630 118.9337 51.5729 45.2779 174.5341 110 P 4.1572 0.0000 0.0000 64.5414 31.5586 177.0717 111 R 3.9577 9.2977 120.6507 57.4101 27.5206 176.9481 112 G 3.8812 8.0042 102.9400 45.9649 0.0000 174.8811 113 V 3.7733 7.3313 118.7947 63.1513 32.1711 175.7798 114 R 4.5986 8.3809 117.7464 56.1503 30.8756 175.5632 115 V 4.8827 7.5185 118.8065 61.7817 34.6107 173.3123 116 E 4.9711 9.2074 127.6465 54.8798 33.3852 173.7932 117 V 5.0869 9.0060 126.3466 61.1587 34.7473 174.0604 118 A 5.3605 8.9753 128.9563 50.7147 22.6357 174.3479 119 C 5.1168 8.3429 111.8601 57.5374 34.0651 172.7981 120 V 4.8330 9.0929 118.6186 61.1500 34.3503 174.0627 121 A 5.2528 8.9520 128.1539 49.9610 23.2105 174.6768 122 L 4.3374 8.6652 119.4144 54.2533 42.4526 177.2588 123 A 4.2751 8.4268 125.4900 51.5264 19.8810 177.5181 124 E 4.1377 8.2146 119.2083 56.5090 29.7573 176.2536 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 E 8.30 4.42 0.00 2.10 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 2.30 2.35 0.00 3 A 8.73 4.50 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 4 V 8.78 4.40 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 0.88 0.00 0.00 1.00 0.00 0.00 5 K 8.45 4.88 0.00 1.73 1.60 0.00 1.83 0.00 0.00 1.62 0.00 0.00 2.88 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.29 1.38 7.81 6 T 8.84 4.62 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 7 D 8.61 4.56 0.00 2.75 2.69 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 0.00 0.00 0.00 0.00 8 R 7.97 4.27 0.00 1.82 1.97 0.00 3.16 0.00 0.00 3.23 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.58 0.00 9 A 7.61 4.67 1.21 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 0.00 0.00 0.00 0.00 0.00 10 P 0.00 4.07 0.00 2.11 2.10 0.00 3.72 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.42 0.00 11 A 8.52 4.02 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 12 A 8.03 4.09 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 I 8.64 4.02 1.91 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.90 0.92 0.00 0.00 14 G 7.74 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 15 P 0.00 4.61 0.00 2.14 2.12 0.00 3.85 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.11 0.00 16 Y 7.50 4.87 0.00 3.18 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 17 A 8.26 4.66 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 18 Q 8.65 4.40 0.00 2.21 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.78 0.00 0.00 0.00 0.00 0.00 2.52 2.38 0.00 19 A 7.52 4.98 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 V 8.73 4.86 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 1.15 0.00 0.00 1.00 0.00 0.00 21 K 9.29 5.06 0.00 1.84 1.79 0.00 1.82 0.00 0.00 1.86 0.00 0.00 2.90 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.43 7.81 22 A 9.60 4.53 1.40 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 0.00 0.00 0.00 23 G 10.23 4.33 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 0.00 24 G 8.61 3.76 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 0.00 0.00 0.00 25 F 8.34 5.25 0.00 2.62 2.50 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.90 4.79 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 1.12 0.00 0.00 0.93 0.00 0.00 27 F 9.41 4.88 0.00 3.06 3.04 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 28 V 8.67 4.70 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 1.00 0.00 0.00 29 S 8.96 4.45 0.00 4.01 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 G 8.54 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 Q 9.32 4.93 0.00 2.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.55 0.00 0.00 0.00 0.00 0.00 2.54 2.48 0.00 32 I 8.08 4.96 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 1.36 0.94 0.95 0.00 0.00 33 P 0.00 4.68 0.00 2.11 2.11 0.00 3.58 0.00 0.00 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.16 0.00 34 L 7.64 4.96 0.00 1.64 1.60 0.95 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 35 A 8.70 4.29 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 36 P 0.00 4.33 0.00 2.05 2.44 0.00 3.69 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.23 0.00 37 D 7.96 4.41 0.00 2.77 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 38 G 8.27 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 0.00 0.00 0.00 39 S 9.10 4.38 0.00 3.88 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 L 8.30 4.61 0.00 1.68 1.61 0.93 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 41 V 8.69 4.09 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 0.82 0.00 0.00 0.94 0.00 0.00 42 E 10.29 4.62 0.00 1.99 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 2.24 2.29 0.00 43 G 8.07 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 D 8.17 4.71 0.00 2.91 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 45 I 8.34 3.73 1.96 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 1.92 0.83 1.03 0.00 0.00 46 R 8.16 4.13 0.00 2.05 2.07 0.00 3.15 0.00 0.00 3.28 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.74 0.00 47 V 7.99 3.62 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 1.12 0.00 0.00 1.02 0.00 0.00 48 Q 8.03 4.03 0.00 2.23 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.53 0.00 0.00 0.00 0.00 0.00 2.58 2.42 0.00 49 T 8.99 4.02 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 1.32 0.00 0.00 50 E 7.92 3.98 0.00 2.18 2.18 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 2.37 2.46 0.00 51 R 7.70 4.04 0.00 1.97 2.07 0.00 3.23 0.00 0.00 3.25 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.68 0.00 52 V 7.61 3.56 2.35 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 1.22 0.00 0.00 1.05 0.00 0.00 *54 E 8.14 4.15 0.00 2.17 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 2.43 2.29 0.00 55 N 8.54 4.29 0.00 2.89 2.88 0.00 0.00 6.97 6.75 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 56 L 8.10 3.98 0.00 1.59 1.77 1.05 0.81 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 57 K 8.02 3.78 0.00 1.72 1.97 0.00 1.82 0.00 0.00 1.85 0.00 0.00 3.11 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.51 1.52 7.81 58 A 8.05 3.98 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 59 V 7.91 3.54 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 1.08 0.00 0.00 0.99 0.00 0.00 60 L 8.23 4.04 0.00 1.72 1.73 0.99 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 61 E 8.48 4.26 0.00 2.23 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 2.33 2.28 0.00 62 A 7.98 4.02 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 63 A 7.55 4.33 1.40 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 0.00 0.00 0.00 64 G 8.76 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 65 S 7.51 5.07 0.00 4.01 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 66 G 8.10 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 L 8.04 4.00 0.00 1.61 1.55 0.93 0.36 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 68 S 8.02 4.30 0.00 3.98 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 R 8.04 4.40 0.00 2.01 2.09 0.00 3.26 0.00 0.00 3.07 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.86 0.00 70 V 7.52 4.20 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 1.11 0.00 0.00 71 V 8.62 4.36 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 0.85 0.00 0.00 1.10 0.00 0.00 72 Q 7.84 5.19 0.00 2.07 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.87 0.00 0.00 0.00 0.00 0.00 2.32 2.35 0.00 73 T 8.97 5.19 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 1.11 0.00 0.00 74 T 9.10 4.70 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 0.81 0.00 0.00 75 C 8.88 5.13 0.00 2.67 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 76 F 9.32 5.27 0.00 2.90 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 77 L 8.79 5.14 0.00 1.50 1.57 0.92 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 78 A 8.40 4.05 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 79 D 7.51 4.51 0.00 2.63 2.66 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 *81 E 8.70 4.39 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 2.32 2.42 0.00 82 D 8.00 4.38 0.00 2.91 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 83 F 7.70 4.02 0.00 3.07 3.17 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 0.00 0.00 0.00 84 P 0.00 4.28 0.00 2.24 2.15 0.00 3.89 0.00 0.00 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.37 0.00 85 G 8.13 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 F 8.10 4.27 0.00 3.05 3.17 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 0.00 0.00 0.00 87 N 8.26 3.70 0.00 1.80 2.52 0.00 0.00 6.88 8.18 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 88 E 8.22 3.87 0.00 1.92 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 2.31 2.30 0.00 89 V 7.66 3.89 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 1.09 0.00 0.00 1.05 0.00 0.00 90 Y 7.80 3.98 0.00 2.51 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 91 A 8.08 4.18 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 92 R 7.55 3.89 0.00 1.60 1.54 0.00 3.15 0.00 0.00 3.10 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.82 0.00 93 Y 7.57 3.98 0.00 2.23 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 94 F 7.75 4.86 0.00 3.13 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 95 T 8.20 4.63 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 1.11 0.00 0.00 96 P 0.00 3.73 0.00 1.81 1.69 0.00 3.43 0.00 0.00 3.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.13 0.00 97 P 0.00 4.30 0.00 2.18 2.04 0.00 3.72 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.97 0.00 98 Y 8.18 4.54 0.00 3.05 2.91 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 99 P 0.00 4.76 0.00 1.81 1.94 0.00 3.69 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 2.38 0.00 100 A 9.25 4.35 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 0.00 101 R 8.49 5.14 0.00 1.69 1.66 0.00 2.87 0.00 0.00 2.56 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.49 0.00 102 A 8.59 4.63 1.11 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 0.00 103 T 8.44 4.94 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 1.25 0.00 0.00 104 V 8.43 4.47 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 0.97 0.00 0.00 0.84 0.00 0.00 105 A 8.48 5.10 1.21 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 0.00 0.00 0.00 0.00 0.00 106 V 8.36 4.28 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 0.87 0.00 0.00 1.06 0.00 0.00 107 K 8.72 4.01 0.00 1.70 1.82 0.00 1.80 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.40 1.43 7.81 108 A 7.26 4.47 1.17 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 0.00 0.00 0.00 0.00 0.00 109 L 7.86 4.76 0.00 1.84 1.50 0.98 0.95 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 0.00 110 P 0.00 4.16 0.00 2.12 1.93 0.00 3.70 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.02 0.00 111 R 9.30 3.96 0.00 1.93 2.00 0.00 3.37 0.00 0.00 3.23 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.59 0.00 112 G 8.00 3.88 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 0.00 113 V 7.33 3.77 2.30 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 0.86 0.00 0.00 0.94 0.00 0.00 114 R 8.38 4.60 0.00 1.91 2.13 0.00 3.22 0.00 0.00 3.29 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.62 0.00 115 V 7.52 4.88 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 0.82 0.00 0.00 0.95 0.00 0.00 116 E 9.21 4.97 0.00 2.06 1.83 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 2.28 2.37 0.00 117 V 9.01 5.09 2.28 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 1.11 0.00 0.00 1.29 0.00 0.00 118 A 8.98 5.36 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 0.00 119 C 8.34 5.12 0.00 3.30 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 0.00 120 V 9.09 4.83 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 0.47 0.00 0.00 1.04 0.00 0.00 121 A 8.95 5.25 1.28 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 0.00 0.00 122 L 8.67 4.34 0.00 1.49 1.48 0.88 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 123 A 8.43 4.28 1.20 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 0.00 124 E 8.21 4.14 0.00 2.15 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.21 0.00 * Residues marked with a * may have inaccurate shift predictions.