NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 10 F 4.8198 8.1676 115.8760 57.0970 40.3134 177.1384 11 H 3.9894 5.2900 117.9768 54.2036 28.7208 170.5303 12 E 4.2603 9.5359 122.8293 57.4850 30.0970 176.8884 13 M 4.5814 7.1736 114.0752 54.9994 32.3968 176.3829 14 R 4.5679 7.6364 116.9051 55.6004 32.5143 175.5806 15 E 4.0672 8.0125 117.2942 55.0221 30.2343 174.5671 16 P 4.1620 0.0000 0.0000 62.6026 32.3399 174.9919 17 R 4.1508 7.4261 112.6737 55.5879 32.9342 173.7783 18 I 4.2818 8.5040 121.9360 60.7037 38.2091 174.9439 19 E 4.4860 8.8385 129.1776 54.4625 31.3282 171.9320 20 K 4.5877 8.7385 132.6067 55.4283 34.1391 174.6968 21 V 4.4550 7.8247 119.6494 61.2774 34.7722 174.0491 22 V 4.4237 8.3363 129.2540 61.7646 32.9939 174.9775 23 V 5.0605 8.2697 122.6885 59.3486 33.3207 174.7132 24 H 5.1182 8.5365 124.7237 54.6662 33.7411 172.0026 25 M 4.2361 8.4235 124.9505 53.4083 33.0225 175.1511 26 G 4.0966 8.0118 111.9290 46.2763 0.0000 171.4450 27 I 4.1604 7.6675 127.4109 60.2937 39.6202 176.1040 28 G 4.0735 7.8298 111.4496 45.4346 0.0000 172.5669 29 H 4.6146 7.9001 117.4602 55.4432 29.9625 173.6674 *35 A 4.1914 7.0274 123.3990 52.0007 19.1096 176.4356 36 N 4.2693 8.8264 112.4255 56.4895 36.2703 176.6046 37 A 3.7417 7.9906 122.4505 54.6318 18.3495 178.9002 38 E 3.8928 8.8137 118.0713 60.0818 29.4690 179.0562 39 D 4.4411 7.5294 118.4903 57.7234 40.9108 179.6370 40 I 3.7606 7.7432 112.6864 63.9966 37.6094 177.9927 41 L 4.1019 7.6866 120.2512 57.5079 41.4336 179.5405 42 G 3.6895 8.4521 106.0707 47.9189 0.0000 175.4703 43 E 4.0938 7.8114 119.5854 58.9085 29.7851 178.7483 44 I 3.9194 8.2456 118.4275 63.3401 38.0323 176.6480 45 T 4.5645 8.3345 108.5435 63.9532 70.0390 174.5517 46 G 3.7145 6.9033 109.4007 44.0899 0.0000 173.2620 47 Q 4.5778 7.7498 115.7334 54.3343 31.5539 174.0987 48 M 3.7855 8.5377 118.5122 55.6104 32.4444 174.8219 49 P 4.8218 0.0000 0.0000 61.8630 33.3916 175.2368 50 V 4.4700 8.3649 120.4853 60.8174 34.3685 175.3343 51 R 4.3605 8.7363 125.6635 57.2633 31.2982 176.7932 52 T 4.5142 8.7493 117.9498 61.3015 69.9541 173.9603 53 K 5.3690 8.7522 124.4506 55.8157 33.2547 175.5489 54 A 4.8899 8.7060 122.7866 50.2263 22.1019 175.8027 55 K 4.4915 8.4300 117.6008 55.5552 34.9625 175.1820 56 R 4.1802 8.4298 122.2212 56.2959 29.6167 175.9505 57 T 4.5429 8.2449 117.1211 62.5325 69.9789 174.5804 58 V 4.5560 9.2503 125.9498 60.6604 35.0672 175.9428 59 G 3.7935 8.8800 112.6847 48.6887 0.0000 175.0250 60 E 4.2535 8.1085 118.7531 58.3767 28.1502 176.1228 61 F 4.1687 7.7360 112.8348 60.3038 38.7225 174.9816 62 D 4.9120 7.9227 118.9267 51.7258 40.2263 175.4584 63 I 3.6561 7.7004 114.8732 60.8966 39.5824 177.2819 64 R 3.8560 7.9100 121.6429 56.1372 29.4265 174.8533 65 E 3.9246 8.1997 128.8832 58.5218 30.3146 176.1323 66 G 3.9088 7.8532 110.4685 46.4521 0.0000 171.9115 67 D 4.5680 8.2969 121.9867 51.5287 42.4584 173.4826 68 P 4.5808 0.0000 0.0000 62.5971 31.3618 176.6228 69 I 4.6450 8.9656 125.4452 59.1920 39.7760 174.9647 70 G 4.4929 7.5095 108.0680 43.4622 0.0000 172.1102 71 A 5.9203 8.0327 121.4738 49.6019 23.4056 174.8067 72 K 5.0312 8.2650 116.7632 56.0951 36.9998 175.5113 73 V 4.5151 8.4265 120.1635 61.9987 34.9319 172.9921 74 T 4.7260 8.5307 119.1760 60.4272 69.8416 173.8601 75 L 4.7275 8.3849 127.0656 53.0571 44.0367 176.0989 76 R 4.7436 7.9325 120.2987 54.7326 34.1679 176.3218 77 D 4.4039 8.9388 120.4112 55.6236 38.9797 176.5341 78 E 3.9928 8.9288 123.6852 60.9755 28.1045 178.4399 79 M 4.1813 8.2335 117.8020 58.2855 31.8604 178.4666 80 A 4.2806 7.9835 120.8081 54.9475 18.8865 179.2351 81 E 3.9664 8.0720 116.6870 59.4621 29.5621 179.0383 82 E 4.0100 8.4941 119.0160 59.0268 29.9489 179.0844 83 F 4.4191 7.5381 117.7452 60.7201 39.9533 177.6797 84 L 4.2187 8.2295 118.2738 57.4282 41.0558 179.0820 85 Q 4.2675 8.0504 115.3681 56.6337 28.2644 176.2244 86 T 4.5562 7.7223 108.9004 62.6095 74.3010 175.1873 87 A 3.9837 7.8326 125.6315 55.0066 18.9663 179.0890 88 L 3.6304 8.1993 114.8955 57.5688 41.8375 178.1391 89 P 4.0969 0.0000 0.0000 65.6945 31.2419 177.1526 90 L 4.3378 8.0349 115.3278 54.7219 41.6339 176.2124 91 A 4.8454 8.2762 121.7745 50.4443 21.8435 175.1432 92 E 4.4266 8.3349 116.9731 58.5227 31.7436 176.5715 93 L 3.7421 6.8506 116.4238 52.7702 43.4162 175.7655 94 A 4.4886 8.5824 122.4671 52.5471 21.3599 174.3671 95 T 3.1903 8.6955 112.0008 62.5901 69.2261 173.9971 96 S 3.8126 8.6484 119.1993 60.4605 63.3951 173.2116 97 Q 4.4646 10.6684 118.4289 55.8412 28.5475 174.8715 98 F 4.8898 7.6298 114.2472 55.2644 41.1591 175.0313 99 D 4.6843 9.6263 123.9736 54.4222 41.6555 175.9111 100 D 4.7143 8.5351 119.6956 55.2550 41.2785 177.5468 101 T 4.5885 7.2940 113.0669 62.3010 68.8404 174.5925 102 G 3.9516 8.3613 108.6960 46.4792 0.0000 173.1303 103 N 5.2421 7.7113 116.6902 51.2229 41.7180 173.2618 104 F 4.5510 7.3283 108.4978 56.3704 41.0987 173.0090 105 S 5.0771 8.8436 116.3572 56.4474 65.0397 172.6370 106 F 4.9346 8.8786 120.5852 55.4792 41.5683 172.5043 107 G 4.2828 8.9746 102.2081 44.3723 0.0000 173.2397 *128 L 4.0236 8.5399 122.9587 55.1453 43.6182 176.3353 129 D 4.8353 8.5675 125.8047 52.8302 44.0090 176.0956 130 V 4.2085 7.9984 120.9945 61.9441 34.5936 173.8321 131 T 4.7078 8.5721 125.1946 61.5759 71.7216 173.8916 132 V 4.2875 7.7342 124.6406 61.0759 34.2479 173.6142 133 N 4.6882 8.6561 127.4937 52.3153 40.2391 173.5631 134 L 5.2795 8.1521 125.8288 53.2205 44.6161 175.7938 135 V 4.2475 7.8784 120.7875 61.3553 35.1715 171.5073 136 R 4.4457 8.2463 116.6393 54.8526 31.4602 177.3708 137 P 3.9860 0.0000 0.0000 65.2553 32.2975 177.2683 138 G 4.1615 7.8061 106.5683 46.0390 0.0000 175.3658 139 Y 4.3176 8.1438 122.9616 60.0551 38.8897 175.9783 140 R 3.9033 8.2599 119.4298 59.3921 29.8643 178.0936 141 V 3.4840 7.4331 116.5505 65.4301 31.1577 176.8588 142 A 4.7286 7.6929 119.3818 51.1963 19.4297 177.3182 143 K 4.2580 7.6206 115.3315 55.7038 33.4976 176.5581 144 R 4.3371 7.5067 115.5422 55.0787 30.8122 176.3469 145 D 4.4401 8.3106 117.5583 57.0763 41.3481 177.4822 146 K 3.9860 7.9075 118.4028 57.7189 32.6805 176.9993 147 A 3.8482 8.7773 124.0906 52.3730 16.2941 176.8417 148 S 4.5017 7.1550 113.7206 61.0684 63.7412 173.3003 149 R 4.5574 8.5978 118.5773 55.3706 33.7408 173.6729 150 S 4.5726 8.5228 118.4433 57.6261 63.4716 173.8155 151 I 3.9568 8.2484 127.2923 60.3382 37.7704 174.4249 152 P 4.4160 0.0000 0.0000 62.5549 32.2430 177.2445 153 T 3.9264 8.8074 112.8667 65.4158 67.9836 176.6618 154 K 4.0554 7.9739 119.6642 59.1817 32.2784 177.7078 155 H 4.6382 7.9833 115.4274 55.7026 30.0493 175.1516 156 R 4.2752 7.2194 118.5650 56.1813 30.6123 175.1227 157 L 4.5530 8.1445 120.4905 53.7875 43.4841 175.5906 158 N 4.7447 8.1669 123.0415 51.5685 41.2538 174.5433 159 P 4.3401 0.0000 0.0000 65.8753 31.3932 178.8369 160 A 3.8446 7.8691 118.7984 55.3540 18.1255 179.1882 161 D 4.4514 8.1736 115.9596 56.4808 40.8231 178.7001 162 A 4.1006 7.5647 122.0415 54.8272 19.1296 179.2684 163 V 3.1851 7.4653 116.4574 66.3016 31.2947 177.7403 164 A 3.8922 7.9034 120.0062 55.1614 18.0069 178.9067 165 F 4.1390 7.6106 117.4807 61.8046 39.6701 177.5229 166 I 3.5144 7.8443 118.7494 64.3927 36.8182 177.8929 167 E 4.5115 8.2450 120.3074 58.4799 29.3633 177.5219 168 S 4.5538 8.0599 112.1430 57.8526 64.8224 175.1140 169 T 4.7501 7.8899 113.0237 62.7511 70.8731 173.1722 170 Y 3.3667 7.8493 118.6051 57.6322 35.1501 168.7787 171 D 4.4163 6.7773 117.0983 54.0619 43.8082 175.5759 172 V 4.7518 7.9089 117.0106 61.2244 35.7365 178.5411 173 E 4.3703 8.9114 122.5202 56.3160 28.7792 177.3284 174 V 4.0483 7.7668 116.6993 63.7669 31.7676 175.0488 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 10 F 8.17 4.82 0.00 3.36 3.35 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 11 H 5.29 3.99 0.00 3.09 2.32 0.00 5.62 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 E 9.54 4.26 0.00 1.64 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 2.07 2.17 0.00 13 M 7.17 4.58 0.00 1.89 2.03 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.55 0.00 14 R 7.64 4.57 0.00 1.78 1.97 0.00 3.43 0.00 0.00 3.39 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.66 0.00 15 E 8.01 4.07 0.00 2.15 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 2.33 2.29 0.00 16 P 0.00 4.16 0.00 0.96 1.65 0.00 3.64 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.00 0.00 17 R 7.43 4.15 0.00 1.80 1.82 0.00 2.73 0.00 0.00 3.12 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.43 0.00 18 I 8.50 4.28 1.98 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.90 0.97 0.00 0.00 19 E 8.84 4.49 0.00 1.83 1.70 0.00 0.00 0.00 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 2.21 0.00 20 K 8.74 4.59 0.00 2.09 1.96 0.00 1.63 0.00 0.00 1.70 0.00 0.00 3.06 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.34 1.31 7.81 21 V 7.82 4.45 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 0.96 0.00 0.00 0.96 0.00 0.00 22 V 8.34 4.42 1.96 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 0.88 0.00 0.00 0.84 0.00 0.00 23 V 8.27 5.06 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 0.05 0.00 0.00 0.70 0.00 0.00 24 H 8.54 5.12 0.00 3.17 2.98 0.00 5.63 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 M 8.42 4.24 0.00 1.92 1.89 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 2.45 2.40 0.00 26 G 8.01 4.10 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 0.00 27 I 7.67 4.16 1.77 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.73 0.75 0.00 0.00 28 G 7.83 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 29 H 7.90 4.61 0.00 3.17 3.34 0.00 5.76 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *35 A 7.03 4.19 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 36 N 8.83 4.27 0.00 2.92 3.14 0.00 0.00 5.87 7.46 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 37 A 7.99 3.74 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 38 E 8.81 3.89 0.00 1.96 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 2.32 2.50 0.00 39 D 7.53 4.44 0.00 2.52 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 I 7.74 3.76 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 1.88 1.12 0.91 0.00 0.00 41 L 7.69 4.10 0.00 1.93 1.72 0.87 0.77 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 42 G 8.45 3.69 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 0.00 0.00 0.00 43 E 7.81 4.09 0.00 1.93 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 2.48 0.00 44 I 8.25 3.92 2.02 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 0.85 1.09 0.00 0.00 45 T 8.33 4.56 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 0.93 0.00 0.00 46 G 6.90 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 7.75 4.58 0.00 2.15 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.67 6.61 0.00 0.00 0.00 0.00 0.00 2.21 2.28 0.00 48 M 8.54 3.79 0.00 2.00 2.08 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.60 0.00 49 P 0.00 4.82 0.00 1.91 1.94 0.00 3.59 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.05 0.00 50 V 8.36 4.47 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 1.01 0.00 0.00 0.91 0.00 0.00 51 R 8.74 4.36 0.00 1.72 1.85 0.00 3.35 0.00 0.00 3.21 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.61 0.00 52 T 8.75 4.51 4.36 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 1.21 0.00 0.00 53 K 8.75 5.37 0.00 1.63 1.74 0.00 1.72 0.00 0.00 2.36 0.00 0.00 2.83 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.43 1.28 7.81 54 A 8.71 4.89 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 55 K 8.43 4.49 0.00 1.72 1.70 0.00 1.83 0.00 0.00 1.70 0.00 0.00 2.92 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.33 1.41 7.81 56 R 8.43 4.18 0.00 1.99 2.00 0.00 3.20 0.00 0.00 3.23 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.64 0.00 57 T 8.24 4.54 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 1.24 0.00 0.00 58 V 9.25 4.56 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 0.94 0.00 0.00 59 G 8.88 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 60 E 8.11 4.25 0.00 2.14 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 2.31 2.34 0.00 61 F 7.74 4.17 0.00 3.03 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 62 D 7.92 4.91 0.00 2.96 2.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 I 7.70 3.66 1.93 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.86 1.06 0.00 0.00 64 R 7.91 3.86 0.00 1.77 2.04 0.00 3.20 0.00 0.00 3.11 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.61 0.00 65 E 8.20 3.92 0.00 1.97 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 2.29 2.30 0.00 66 G 7.85 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 67 D 8.30 4.57 0.00 2.64 2.71 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.58 0.00 1.94 2.03 0.00 3.62 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.11 0.00 69 I 8.97 4.65 1.97 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 1.14 1.06 0.93 0.00 0.00 70 G 7.51 4.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 A 8.03 5.92 1.19 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 0.00 0.00 72 K 8.26 5.03 0.00 1.75 1.88 0.00 1.45 0.00 0.00 1.69 0.00 0.00 2.76 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.35 1.39 7.81 73 V 8.43 4.52 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 0.81 0.00 0.00 0.86 0.00 0.00 74 T 8.53 4.73 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 1.15 0.00 0.00 75 L 8.38 4.73 0.00 1.49 1.52 0.49 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 76 R 7.93 4.74 0.00 1.62 1.77 0.00 3.31 0.00 0.00 3.23 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.61 0.00 77 D 8.94 4.40 0.00 2.89 2.32 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 78 E 8.93 3.99 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 2.42 2.42 0.00 79 M 8.23 4.18 0.00 2.01 2.28 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 2.69 2.58 0.00 80 A 7.98 4.28 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 81 E 8.07 3.97 0.00 2.16 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 2.45 2.62 0.00 82 E 8.49 4.01 0.00 2.00 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 2.36 2.55 0.00 83 F 7.54 4.42 0.00 3.25 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 84 L 8.23 4.22 0.00 1.94 1.81 1.10 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 85 Q 8.05 4.27 0.00 1.91 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.73 0.00 0.00 0.00 0.00 0.00 2.19 2.43 0.00 86 T 7.72 4.56 4.10 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 1.14 0.00 0.00 87 A 7.83 3.98 1.22 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 0.00 0.00 0.00 88 L 8.20 3.63 0.00 1.73 1.68 0.96 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 89 P 0.00 4.10 0.00 2.00 2.13 0.00 3.66 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.12 0.00 90 L 8.03 4.34 0.00 1.81 1.73 0.91 0.88 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 91 A 8.28 4.85 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 E 8.33 4.43 0.00 1.93 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 2.19 2.28 0.00 93 L 6.85 3.74 0.00 1.72 1.84 1.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 94 A 8.58 4.49 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 95 T 8.70 3.19 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 1.12 0.00 0.00 96 S 8.65 3.81 0.00 4.23 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 0.00 97 Q 10.67 4.46 0.00 2.14 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.52 6.73 0.00 0.00 0.00 0.00 0.00 2.41 2.40 0.00 98 F 7.63 4.89 0.00 3.06 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 99 D 9.63 4.68 0.00 2.81 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 0.00 100 D 8.54 4.71 0.00 2.72 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 0.00 101 T 7.29 4.59 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 1.24 0.00 0.00 102 G 8.36 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 0.00 0.00 0.00 103 N 7.71 5.24 0.00 2.98 2.80 0.00 0.00 6.60 8.13 0.00 0.00 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 F 7.33 4.55 0.00 2.48 1.64 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 0.00 0.00 0.00 0.00 105 S 8.84 5.08 0.00 3.72 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 0.00 106 F 8.88 4.93 0.00 3.14 3.16 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 0.00 0.00 0.00 107 G 8.97 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 0.00 0.00 0.00 0.00 *128 L 8.54 4.02 0.00 1.75 1.60 0.94 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 129 D 8.57 4.84 0.00 2.74 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 V 8.00 4.21 0.92 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 0.86 0.00 0.00 0.91 0.00 0.00 131 T 8.57 4.71 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 1.04 0.00 0.00 132 V 7.73 4.29 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 1.09 0.00 0.00 0.76 0.00 0.00 133 N 8.66 4.69 0.00 2.81 2.91 0.00 0.00 6.56 6.41 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 0.00 134 L 8.15 5.28 0.00 1.74 1.52 1.33 1.12 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 0.00 135 V 7.88 4.25 1.59 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 0.24 0.00 0.00 0.71 0.00 0.00 136 R 8.25 4.45 0.00 1.80 1.96 0.00 2.95 0.00 0.00 3.02 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.44 0.00 137 P 0.00 3.99 0.00 2.29 2.15 0.00 3.62 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 1.90 2.10 0.00 138 G 7.81 4.16 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 0.00 0.00 0.00 0.00 0.00 0.00 139 Y 8.14 4.32 0.00 3.13 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 R 8.26 3.90 0.00 1.93 1.94 0.00 3.25 0.00 0.00 3.26 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.69 0.00 141 V 7.43 3.48 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 0.99 0.00 0.00 0.97 0.00 0.00 142 A 7.69 4.73 0.96 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 0.00 0.00 143 K 7.62 4.26 0.00 1.61 1.77 0.00 1.69 0.00 0.00 1.61 0.00 0.00 2.87 0.00 0.00 3.22 0.00 0.00 0.00 0.00 0.80 1.45 7.81 144 R 7.51 4.34 0.00 1.89 1.91 0.00 3.10 0.00 0.00 3.20 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.60 0.00 145 D 8.31 4.44 0.00 2.67 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 0.00 146 K 7.91 3.99 0.00 1.80 1.71 0.00 1.79 0.00 0.00 1.81 0.00 0.00 2.87 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.52 1.42 7.81 147 A 8.78 3.85 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 0.00 148 S 7.15 4.50 0.00 3.85 4.08 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 0.00 0.00 0.00 149 R 8.60 4.56 0.00 1.88 1.72 0.00 3.12 0.00 0.00 3.08 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.58 0.00 150 S 8.52 4.57 0.00 3.91 3.73 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 0.00 151 I 8.25 3.96 1.98 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 1.44 1.17 1.05 0.00 0.00 152 P 0.00 4.42 0.00 2.21 1.99 0.00 3.67 0.00 0.00 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.09 0.00 153 T 8.81 3.93 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 0.00 154 K 7.97 4.06 0.00 1.77 1.95 0.00 1.65 0.00 0.00 1.66 0.00 0.00 3.12 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.47 1.58 7.81 155 H 7.98 4.64 0.00 3.15 3.45 0.00 5.94 0.00 0.00 0.00 0.00 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 156 R 7.22 4.28 0.00 2.10 1.89 0.00 3.41 0.00 0.00 3.23 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.75 0.00 157 L 8.14 4.55 0.00 1.66 1.72 0.89 0.56 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 0.00 158 N 8.17 4.74 0.00 3.16 2.72 0.00 0.00 6.64 7.91 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 0.00 159 P 0.00 4.34 0.00 2.16 2.18 0.00 3.62 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.46 0.00 160 A 7.87 3.84 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 0.00 161 D 8.17 4.45 0.00 2.71 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 0.00 162 A 7.56 4.10 1.59 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 0.00 0.00 163 V 7.47 3.19 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 0.61 0.00 0.00 0.22 0.00 0.00 164 A 7.90 3.89 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 0.00 165 F 7.61 4.14 0.00 2.97 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 0.00 166 I 7.84 3.51 1.85 0.00 0.00 1.13 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 0.88 0.00 0.00 167 E 8.25 4.51 0.00 1.87 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 2.27 2.18 0.00 168 S 8.06 4.55 0.00 3.86 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 0.00 169 T 7.89 4.75 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 1.16 0.00 0.00 170 Y 7.85 3.37 0.00 3.01 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 0.00 171 D 6.78 4.42 0.00 2.89 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 172 V 7.91 4.75 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 0.84 0.00 0.00 0.89 0.00 0.00 173 E 8.91 4.37 0.00 1.97 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 2.41 2.19 0.00 174 V 7.77 4.05 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 1.07 0.00 0.00 0.89 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.