NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 15 A 4.3564 8.1076 123.5820 51.5944 20.4284 178.4199 16 S 3.9994 8.1273 112.7581 60.5768 62.9816 173.5616 17 G 3.8892 7.7667 108.0780 45.4269 0.0000 175.3264 18 V 3.8512 7.4808 120.8064 61.5387 32.1988 176.0573 19 R 4.3997 9.5052 123.6496 55.1968 31.0889 174.8717 20 L 5.1871 8.5303 126.3218 53.1205 44.7842 174.7996 21 A 5.1769 8.8023 126.6135 50.1279 22.7043 174.9093 22 I 5.0119 9.1536 121.3317 59.3807 41.0329 174.7946 23 V 4.9360 8.9119 127.0419 59.7726 33.8631 174.4665 24 A 5.2183 8.8886 127.0950 49.7775 21.3916 175.3075 25 S 4.6901 9.2304 118.4032 58.7629 63.5534 174.6627 26 S 4.5419 8.7650 120.1977 58.4907 63.0943 175.4012 27 W 4.1931 7.8769 119.8761 59.9248 29.2079 177.1584 28 H 4.7055 8.0584 121.3291 53.8875 27.5921 175.7709 29 G 3.7622 8.5451 111.2332 47.7598 0.0000 172.6436 30 K 4.0130 7.9772 120.4390 59.2705 32.1854 179.4667 31 I 3.7755 7.7315 119.5857 64.4820 37.0911 178.1291 32 C 4.1824 8.3580 117.7178 62.9158 27.9847 175.7398 33 D 4.3791 8.5744 120.6692 57.3767 40.5326 178.8609 34 A 4.0010 7.9858 121.0028 55.1563 18.4290 179.6161 35 L 3.9510 8.0574 117.5481 57.9111 41.7253 179.5612 36 L 3.9550 8.0730 120.2221 58.0058 41.9317 178.3448 37 D 4.3983 8.2379 118.1562 57.3578 41.1810 178.4829 38 G 3.6769 8.1856 106.6461 47.1296 0.0000 175.1087 39 A 4.3371 7.9237 124.9868 54.3850 18.3647 179.8960 40 R 3.8992 8.4628 116.5486 59.4257 30.1280 179.5540 41 K 3.9705 8.3313 118.4246 59.2395 32.0183 179.5345 42 V 3.5392 7.8793 118.2848 65.9574 31.4957 177.6696 43 A 3.9795 8.0368 120.1794 55.4187 18.2753 179.5031 44 A 4.2944 7.7244 120.5974 54.7444 18.2021 180.1204 45 G 3.6114 8.0812 103.4586 47.8581 0.0000 174.8467 46 C 4.5408 7.9579 116.1275 59.6834 28.2405 174.3489 47 G 3.8831 7.9860 108.9766 45.1801 0.0000 174.0261 48 L 4.5625 8.3155 121.1124 52.8785 41.7654 176.7731 49 D 4.5917 8.4524 123.3006 55.6541 41.9448 176.5977 50 D 4.8192 7.5661 117.4006 52.0502 41.0979 172.8509 51 P 4.6105 0.0000 0.0000 62.8873 33.2302 178.0869 52 T 4.0853 8.5857 118.8890 63.7668 69.3542 173.5709 53 V 4.7837 8.4269 126.7065 60.9818 33.8757 174.7097 54 V 4.4998 8.9642 127.7383 61.1673 34.6078 174.1409 55 R 5.1144 8.6600 126.0203 54.8672 32.1109 175.7590 56 V 4.5223 8.5444 115.3758 59.5186 35.2633 176.9240 57 L 4.1291 8.6946 121.3773 57.4082 42.7885 177.6236 58 G 4.4056 8.0705 104.3640 41.7800 0.0000 173.0672 59 A 3.9807 8.4352 120.8833 55.2716 17.9641 180.0617 60 I 3.6374 7.5924 116.8721 64.5346 37.5139 177.8151 61 E 4.1632 8.1099 117.9795 58.0981 29.3042 179.1723 62 I 3.7877 7.6371 120.8315 63.9487 37.1518 176.2894 63 P 4.2557 0.0000 0.0000 65.6415 31.1216 179.0070 64 V 3.6191 7.7284 117.4107 64.8019 31.2537 178.5063 65 V 3.5655 7.5390 117.2835 65.5887 31.3339 177.7191 66 A 3.9686 8.5600 120.9362 55.2107 17.9176 179.3122 67 Q 3.8809 8.1741 117.3695 59.3548 29.3266 177.8997 68 E 4.0817 7.9556 119.8699 59.4506 29.7553 178.8562 69 L 4.0737 8.1980 118.7879 57.6093 41.4217 179.2811 70 A 4.1225 8.2535 120.2976 54.8995 18.2961 179.5310 71 R 4.1508 7.7108 116.3174 58.5148 30.0518 177.1005 72 N 5.0766 7.9671 113.9155 52.5948 38.1308 173.5439 73 H 4.9790 8.0829 113.6259 55.0509 32.6466 173.0786 74 D 4.7770 9.1001 120.3866 55.8804 41.6562 176.7514 75 A 4.8026 7.5976 118.4050 50.7726 22.8217 175.2074 76 V 4.8236 8.7398 120.3706 61.0444 35.1766 174.3415 77 V 4.6108 8.8409 127.6712 61.1942 33.6777 173.9835 78 A 4.9990 8.9276 130.6832 50.7274 20.5440 175.7052 79 L 5.1555 8.4060 122.8522 51.7857 45.6630 176.3656 80 G 4.1650 7.9231 107.8633 46.4987 0.0000 171.6325 81 V 4.8626 8.4356 119.0162 61.3277 34.4465 174.4180 82 V 4.5269 9.2950 128.7519 61.3004 33.8155 174.0216 83 I 5.0746 8.5155 128.6380 59.1593 39.3208 175.6790 84 R 3.7115 8.2177 128.1660 55.4668 30.2403 176.1358 85 G 4.2294 8.5955 113.8691 46.2264 0.0000 175.2462 86 Q 4.1944 8.9336 121.9415 57.0245 29.2085 175.5578 87 T 4.6598 7.5112 106.2470 58.8746 71.4552 172.6503 88 P 4.7515 0.0000 0.0000 63.5961 31.7569 178.0952 89 H 4.1907 8.4066 117.5760 59.1480 28.6242 176.6145 90 F 4.0793 8.4597 121.5479 61.7376 38.9221 176.8041 91 D 4.0464 7.9898 117.8810 57.5979 40.5660 178.5056 92 Y 4.1583 7.4237 116.5550 60.5380 37.9868 178.1519 93 V 3.4911 7.8501 119.4345 66.1944 31.5744 177.8456 94 C 3.9116 7.6059 116.2927 62.7946 27.8101 175.8004 95 D 4.2671 8.0299 120.1465 57.3323 40.3459 178.7862 96 A 3.9447 8.0325 121.0912 55.1119 18.3127 179.8459 97 V 3.4667 7.7743 116.6522 66.3665 31.7009 178.2659 98 T 3.8130 8.0269 115.5982 66.8710 68.3589 176.5758 99 Q 4.0917 8.3143 120.0847 58.8226 28.6335 179.2883 100 G 3.5297 8.3098 106.8300 47.9626 0.0000 175.8678 101 L 4.0026 8.1187 122.4237 57.4044 41.5823 179.8926 102 T 3.8345 7.8178 115.5513 66.5639 68.4702 176.5632 103 R 3.8516 7.9236 120.5301 59.5221 30.1320 178.4990 104 V 3.6028 8.0462 118.4453 66.1011 31.4984 178.0758 105 S 4.5348 8.0717 115.1827 61.0472 62.6183 176.5069 106 L 4.0470 7.8234 122.1271 57.3113 41.2446 178.9135 107 D 4.4030 8.4341 118.6253 57.0154 40.9404 178.2753 108 S 4.4887 8.0470 111.2584 57.3509 64.1756 173.8681 109 S 3.7847 7.5960 117.9018 60.1407 61.0108 172.3435 110 T 4.7314 7.8882 114.5671 60.9475 72.7794 172.9217 111 P 4.4656 0.0000 0.0000 62.8032 32.6907 175.3427 112 I 4.9097 8.3246 124.8131 59.2924 38.9540 174.8008 113 A 4.1738 9.1132 130.5016 51.5603 19.8136 175.8286 114 N 4.7696 8.8451 121.4196 52.0297 39.6540 174.8484 115 G 4.1665 9.1714 117.2606 45.8470 0.0000 171.8843 116 V 4.6552 7.5618 122.1002 60.9760 32.0703 175.6013 117 L 4.2769 8.8596 129.9430 55.1652 42.8081 176.8494 118 T 5.3091 8.6223 113.0678 60.1517 70.2188 172.7612 119 T 4.7578 9.0150 117.9275 60.1182 72.0476 174.9406 120 N 4.1853 9.1526 120.1332 55.1731 39.0827 176.2520 121 T 4.7078 7.5044 107.0243 58.8971 73.3359 174.3176 122 E 3.8775 8.5708 121.9148 59.1846 29.7085 178.3069 123 E 3.9031 8.2380 119.0418 59.6777 29.3657 178.8165 124 Q 3.9728 7.9549 116.0685 58.8818 29.0455 178.4434 125 A 4.1436 7.7134 121.8523 55.1026 18.5699 179.5540 126 L 3.9233 8.2688 117.9730 58.0799 41.8784 179.1316 127 D 4.5716 8.2409 116.8540 55.9610 41.0142 177.1441 128 R 4.5574 7.8563 116.4833 56.3880 31.0335 176.2962 129 A 4.5788 8.0373 119.6264 51.0727 19.3343 177.4870 130 G 3.9340 7.9787 104.2291 46.7257 0.0000 174.5271 131 L 4.3608 7.6935 117.8605 52.8846 42.9856 176.6405 132 P 4.1551 0.0000 0.0000 65.8210 31.1998 177.5219 133 T 4.4377 7.6445 104.1552 61.2427 69.3101 174.8521 134 S 4.4396 8.3122 118.9180 58.4500 63.4646 174.3889 135 A 4.1235 8.8287 127.2956 55.0253 18.4701 177.2917 136 E 4.5626 8.0660 111.7901 54.4865 32.3761 173.5296 137 D 5.1655 8.2669 116.8399 51.7879 43.0917 175.3878 138 K 4.1206 9.0291 129.8017 59.1173 32.2371 178.9399 139 G 3.5141 8.4405 106.0643 47.5733 0.0000 175.4966 140 A 3.9795 8.2094 123.2270 54.9819 18.4743 179.3620 141 Q 3.9181 8.1269 116.1710 59.3236 28.7503 179.3378 142 A 4.0316 8.2980 121.7696 55.3582 18.4539 179.9218 143 T 3.8065 7.9157 114.3552 66.6138 68.4999 176.9448 144 V 3.5703 8.0324 120.2397 66.0974 31.4922 177.9000 145 A 3.9565 8.1279 119.9452 55.0861 18.2616 179.3498 146 A 3.9462 8.2136 119.4765 55.3994 18.4783 179.9675 147 L 3.9227 8.0822 117.1547 57.8448 41.7713 179.4681 148 A 4.0098 8.3557 121.1473 55.6557 18.2172 179.9029 149 T 3.8672 8.1314 113.9562 66.5269 68.4141 176.9482 150 A 3.9882 8.0902 122.8101 55.2042 18.5449 179.7099 151 L 3.9360 8.0947 117.5043 58.0799 41.6497 179.9228 152 T 3.8745 8.0284 115.6844 66.6904 68.4358 176.6633 153 L 4.0215 8.1852 121.1052 57.8888 41.3947 179.7628 154 R 3.9450 8.0224 117.2326 59.3821 30.0888 178.4657 155 E 4.1517 7.9470 117.8367 58.9561 29.6880 178.4681 *156 L 4.1527 7.8062 119.4421 58.3522 40.8955 178.0069 157 R 4.4391 7.7386 117.6876 53.2357 33.2671 175.3961 158 A 3.9982 8.0493 122.9709 53.1459 18.5292 176.5819 159 H 4.6816 7.9084 116.7232 55.0819 30.8944 174.1415 160 S 4.3505 8.5822 114.0773 58.5520 62.9780 173.8777 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 15 A 8.11 4.36 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 16 S 8.13 4.00 0.00 4.07 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 17 G 7.77 3.89 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 0.00 18 V 7.48 3.85 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 0.77 0.00 0.00 0.94 0.00 0.00 19 R 9.51 4.40 0.00 1.91 1.91 0.00 3.12 0.00 0.00 3.08 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.60 0.00 20 L 8.53 5.19 0.00 1.76 1.51 0.98 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 21 A 8.80 5.18 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 I 9.15 5.01 1.86 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 1.28 0.75 0.95 0.00 0.00 23 V 8.91 4.94 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 0.88 0.00 0.00 0.93 0.00 0.00 24 A 8.89 5.22 1.24 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 0.00 0.00 0.00 25 S 9.23 4.69 0.00 3.93 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 26 S 8.76 4.54 0.00 3.87 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 27 W 7.88 4.19 0.00 3.08 3.30 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 28 H 8.06 4.71 0.00 3.27 3.30 0.00 5.64 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 G 8.55 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 30 K 7.98 4.01 0.00 1.83 1.88 0.00 1.68 0.00 0.00 1.82 0.00 0.00 2.95 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.53 1.53 7.81 31 I 7.73 3.78 1.92 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 1.65 0.67 0.93 0.00 0.00 32 C 8.36 4.18 0.00 3.16 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 D 8.57 4.38 0.00 2.85 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 A 7.99 4.00 1.42 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 0.00 0.00 35 L 8.06 3.95 0.00 1.89 1.75 1.01 0.40 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 36 L 8.07 3.95 0.00 1.86 1.84 0.93 1.02 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 37 D 8.24 4.40 0.00 2.95 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 38 G 8.19 3.68 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 0.00 0.00 0.00 39 A 7.92 4.34 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 40 R 8.46 3.90 0.00 2.02 2.00 0.00 3.14 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.80 0.00 41 K 8.33 3.97 0.00 1.92 1.86 0.00 1.67 0.00 0.00 1.58 0.00 0.00 2.90 0.00 0.00 3.23 0.00 0.00 0.00 0.00 1.46 1.56 7.81 42 V 7.88 3.54 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 1.01 0.00 0.00 0.98 0.00 0.00 43 A 8.04 3.98 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 44 A 7.72 4.29 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 45 G 8.08 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 C 7.96 4.54 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 47 G 7.99 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 48 L 8.32 4.56 0.00 1.78 1.61 0.97 1.15 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 49 D 8.45 4.59 0.00 2.67 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 D 7.57 4.82 0.00 2.55 2.52 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.61 0.00 2.11 2.04 0.00 3.93 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.00 0.00 52 T 8.59 4.09 4.14 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 0.00 0.00 1.22 0.00 0.00 53 V 8.43 4.78 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 0.78 0.00 0.00 0.93 0.00 0.00 54 V 8.96 4.50 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 1.02 0.00 0.00 0.92 0.00 0.00 55 R 8.66 5.11 0.00 1.73 1.84 0.00 3.56 0.00 0.00 3.24 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.59 0.00 56 V 8.54 4.52 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.98 0.00 0.00 57 L 8.69 4.13 0.00 1.68 1.84 0.97 0.98 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 58 G 8.07 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 0.00 0.00 0.00 0.00 59 A 8.44 3.98 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 60 I 7.59 3.64 1.81 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 1.52 0.74 0.87 0.00 0.00 61 E 8.11 4.16 0.00 2.28 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.39 0.00 62 I 7.64 3.79 1.94 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 1.52 0.68 0.90 0.00 0.00 63 P 0.00 4.26 0.00 2.14 2.09 0.00 3.79 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.13 0.00 64 V 7.73 3.62 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 0.86 0.00 0.00 0.93 0.00 0.00 65 V 7.54 3.57 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 1.00 0.00 0.00 0.97 0.00 0.00 66 A 8.56 3.97 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 67 Q 8.17 3.88 0.00 2.13 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.89 0.00 0.00 0.00 0.00 0.00 2.38 2.37 0.00 68 E 7.96 4.08 0.00 2.10 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.41 0.00 69 L 8.20 4.07 0.00 1.84 1.63 0.88 0.81 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 70 A 8.25 4.12 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 71 R 7.71 4.15 0.00 1.91 2.02 0.00 3.12 0.00 0.00 3.28 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.84 0.00 72 N 7.97 5.08 0.00 2.71 2.79 0.00 0.00 6.76 8.17 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 73 H 8.08 4.98 0.00 3.18 3.38 0.00 5.88 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 D 9.10 4.78 0.00 2.61 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 A 7.60 4.80 1.24 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 0.00 0.00 0.00 76 V 8.74 4.82 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 0.93 0.00 0.00 0.92 0.00 0.00 77 V 8.84 4.61 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 0.98 0.00 0.00 0.93 0.00 0.00 78 A 8.93 5.00 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 79 L 8.41 5.16 0.00 1.54 1.54 0.93 0.76 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 80 G 7.92 4.17 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 0.00 81 V 8.44 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 0.81 0.00 0.00 0.99 0.00 0.00 82 V 9.29 4.53 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 0.89 0.00 0.00 0.87 0.00 0.00 83 I 8.52 5.07 1.94 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.77 0.87 0.00 0.00 84 R 8.22 3.71 0.00 0.67 1.33 0.00 2.98 0.00 0.00 3.08 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.19 0.00 85 G 8.60 4.23 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 0.00 86 Q 8.93 4.19 0.00 2.10 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.05 6.77 0.00 0.00 0.00 0.00 0.00 2.36 2.31 0.00 87 T 7.51 4.66 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 1.29 0.00 0.00 88 P 0.00 4.75 0.00 2.44 2.22 0.00 3.94 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.12 0.00 89 H 8.41 4.19 0.00 3.26 3.39 0.00 5.64 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 F 8.46 4.08 0.00 3.12 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 D 7.99 4.05 0.00 2.19 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 0.00 0.00 0.00 92 Y 7.42 4.16 0.00 3.04 2.96 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 93 V 7.85 3.49 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 0.85 0.00 0.00 0.84 0.00 0.00 94 C 7.61 3.91 0.00 2.70 2.67 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 95 D 8.03 4.27 0.00 2.85 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 A 8.03 3.94 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 V 7.77 3.47 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 1.06 0.00 0.00 0.91 0.00 0.00 98 T 8.03 3.81 4.32 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 1.18 0.00 0.00 99 Q 8.31 4.09 0.00 2.13 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.82 0.00 0.00 0.00 0.00 0.00 2.37 2.48 0.00 100 G 8.31 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.12 4.00 0.00 1.68 1.72 0.90 0.97 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 0.00 102 T 7.82 3.83 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 1.20 0.00 0.00 103 R 7.92 3.85 0.00 1.88 2.11 0.00 3.10 0.00 0.00 3.09 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.77 0.00 104 V 8.05 3.60 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 0.99 0.00 0.00 1.01 0.00 0.00 105 S 8.07 4.53 0.00 4.17 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 0.00 106 L 7.82 4.05 0.00 1.72 1.74 0.92 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 107 D 8.43 4.40 0.00 2.78 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 0.00 108 S 8.05 4.49 0.00 4.03 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 0.00 109 S 7.60 3.78 0.00 3.97 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 0.00 110 T 7.89 4.73 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 1.33 0.00 0.00 111 P 0.00 4.47 0.00 2.07 1.98 0.00 3.76 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.12 0.00 112 I 8.32 4.91 1.87 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 0.88 0.90 0.00 0.00 113 A 9.11 4.17 1.24 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 0.00 0.00 0.00 114 N 8.85 4.77 0.00 2.73 2.76 0.00 0.00 6.86 7.98 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 0.00 115 G 9.17 4.17 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 0.00 116 V 7.56 4.66 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 0.77 0.00 0.00 0.97 0.00 0.00 117 L 8.86 4.28 0.00 1.68 1.61 0.96 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 118 T 8.62 5.31 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 1.22 0.00 0.00 119 T 9.02 4.76 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 1.26 0.00 0.00 120 N 9.15 4.19 0.00 2.78 2.79 0.00 0.00 6.72 7.32 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 0.00 121 T 7.50 4.71 4.21 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 1.17 0.00 0.00 122 E 8.57 3.88 0.00 2.04 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 2.34 0.00 123 E 8.24 3.90 0.00 2.06 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 0.00 2.38 2.42 0.00 124 Q 7.95 3.97 0.00 2.24 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.73 0.00 0.00 0.00 0.00 0.00 2.39 2.36 0.00 125 A 7.71 4.14 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 0.00 126 L 8.27 3.92 0.00 1.84 1.74 0.92 0.81 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 0.00 127 D 8.24 4.57 0.00 2.98 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 0.00 128 R 7.86 4.56 0.00 1.90 1.88 0.00 3.32 0.00 0.00 3.18 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.53 0.00 129 A 8.04 4.58 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 0.00 130 G 7.98 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 0.00 131 L 7.69 4.36 0.00 1.73 1.60 0.98 1.04 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 0.00 132 P 0.00 4.16 0.00 2.03 2.15 0.00 3.66 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 2.12 0.00 133 T 7.64 4.44 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 0.00 134 S 8.31 4.44 0.00 3.94 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 A 8.83 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 0.00 136 E 8.07 4.56 0.00 2.15 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 2.20 2.25 0.00 137 D 8.27 5.17 0.00 2.68 2.56 0.00 0.00 0.00 0.00 0.00 0.00 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 K 9.03 4.12 0.00 1.96 1.87 0.00 1.58 0.00 0.00 1.66 0.00 0.00 3.08 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.45 1.51 7.81 139 G 8.44 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.21 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 0.00 141 Q 8.13 3.92 0.00 2.29 2.18 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 2.52 0.00 142 A 8.30 4.03 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 0.00 143 T 7.92 3.81 4.37 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 1.25 0.00 0.00 144 V 8.03 3.57 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 1.07 0.00 0.00 0.97 0.00 0.00 145 A 8.13 3.96 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 0.00 146 A 8.21 3.95 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 0.00 147 L 8.08 3.92 0.00 1.72 1.73 0.92 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 148 A 8.36 4.01 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 0.00 149 T 8.13 3.87 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 0.00 150 A 8.09 3.99 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 0.00 151 L 8.09 3.94 0.00 1.86 1.73 0.92 0.60 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 0.00 152 T 8.03 3.87 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 1.22 0.00 0.00 153 L 8.19 4.02 0.00 1.83 1.73 0.93 1.20 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 0.00 154 R 8.02 3.94 0.00 1.93 2.00 0.00 3.34 0.00 0.00 3.15 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.79 0.00 155 E 7.95 4.15 0.00 2.14 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 0.00 2.36 2.32 0.00 *156 L 7.81 4.15 0.00 1.86 1.78 0.93 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 157 R 7.74 4.44 0.00 1.91 1.95 0.00 3.29 0.00 0.00 3.24 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.71 0.00 158 A 8.05 4.00 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 0.00 159 H 7.91 4.68 0.00 3.21 3.23 0.00 5.47 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 160 S 8.58 4.35 0.00 3.97 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 * Residues marked with a * may have inaccurate shift predictions.