NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 10 I 4.0209 8.0093 120.7912 61.7160 39.1833 172.2197 11 I 3.0415 8.5093 124.5978 60.2620 38.3924 171.7016 12 R 4.8331 8.2419 121.3396 54.6003 34.6725 175.6051 13 F 4.9754 8.2246 114.7684 55.6072 40.9750 173.3471 14 S 4.5932 8.5187 115.5877 56.5863 63.9317 173.4062 15 V 4.4443 7.8649 124.2981 61.0533 34.2903 174.8798 16 S 4.7073 8.6216 121.6049 56.8371 63.9177 173.6316 17 L 4.8059 8.1331 124.9002 52.0633 44.6889 177.2753 18 Q 4.1348 8.5425 121.1627 56.0463 30.6502 177.7360 19 Q 3.9488 8.6591 123.1137 59.6980 28.7830 178.7844 20 N 4.3486 8.2283 117.1550 55.6712 37.0484 176.2963 21 L 4.0675 7.7721 122.1687 57.3648 42.3812 178.1078 22 L 3.9454 7.6784 120.4152 58.2231 42.0278 178.7156 23 D 4.3393 8.0823 118.9011 57.3171 40.7480 178.3926 24 E 3.9262 7.9240 119.4722 58.9333 29.5300 178.4483 25 L 3.8520 7.9606 120.3846 58.3273 42.2442 178.4025 26 D 4.3515 8.3062 118.9782 57.5602 40.8276 178.2427 27 N 4.2209 8.6685 117.4456 57.1295 38.7856 176.7139 28 R 3.9304 8.4790 119.9920 59.4341 30.0615 178.4579 29 I 3.8852 8.0392 120.0915 64.4138 37.0849 178.2955 30 I 3.7139 7.6624 120.0031 64.5124 36.8329 178.5672 31 K 3.9629 8.0453 118.1155 58.9579 31.9757 177.9404 32 N 4.9353 7.8921 113.9385 51.5583 40.5516 174.3231 33 G 3.7366 8.0726 107.9122 46.6937 0.0000 173.7658 34 Y 4.1943 7.9807 116.3628 57.2411 38.9471 176.8484 35 S 4.3120 9.7744 119.2341 60.6003 63.4638 174.1785 36 S 4.8334 7.6720 113.5136 55.1228 66.4616 175.0025 37 R 3.8501 8.5722 119.0414 59.4730 29.7334 179.5192 38 S 4.1592 8.0307 113.3544 61.1682 62.9682 176.0408 39 E 3.9709 7.9584 123.4750 59.2001 29.4736 178.5184 40 L 3.4428 7.2732 120.4892 57.7334 41.9219 179.1140 41 V 3.5567 7.7245 118.4881 65.6682 31.4672 177.7013 42 R 3.9289 8.3707 119.0360 59.9117 29.7080 178.1970 43 D 4.4180 7.9397 117.9568 57.5490 40.7181 178.7578 44 M 4.0594 8.1276 119.2066 58.3317 31.8936 178.7899 45 I 3.6965 8.0835 120.2449 64.6894 37.2538 178.7137 46 R 3.9259 8.1779 118.9279 58.9193 29.8388 178.4836 47 E 4.1271 8.0206 116.7751 58.1021 30.1742 178.4968 48 K 3.9882 8.3400 121.3402 59.2636 32.1993 178.8173 49 L 4.0302 8.2725 119.8087 57.6137 41.6685 179.5799 50 V 3.6979 7.4027 117.7097 66.1900 31.6282 177.7108 51 E 4.0133 8.1100 118.2803 59.7966 29.1140 179.0339 52 D 4.6830 8.1356 117.1124 56.5326 41.0984 177.9638 53 N 4.5123 8.3133 117.1206 55.9573 39.0454 176.3493 54 W 4.4966 8.5010 119.6992 56.8866 29.3081 175.1739 55 A 4.6674 7.4627 121.3752 50.9129 18.6835 175.7582 56 E 4.9569 7.9632 117.4197 57.6485 31.5254 175.8258 57 D 5.1550 8.1673 135.0000 53.9498 40.8129 176.2972 58 N 4.7824 8.7385 122.2270 54.3111 39.2688 175.5262 59 P 3.0280 0.0000 0.0000 60.9862 33.9797 175.2208 *62 E 4.0000 8.0263 118.3803 56.8458 31.3922 176.6257 63 S 4.7335 8.4370 119.7117 55.9171 63.6872 173.6094 64 K 4.0642 8.4301 123.5391 56.3713 33.4672 175.5527 65 I 5.1960 8.6067 122.9646 59.8035 40.1297 174.4794 66 A 5.1212 9.1413 126.5712 50.5137 23.5131 174.9339 67 V 4.6607 8.5822 119.3628 61.0457 34.1733 174.2169 68 L 4.7874 8.9157 131.4015 54.0709 43.6084 175.1034 69 V 4.8460 8.8075 127.1744 61.3760 33.6210 174.5434 70 V 5.0773 9.2631 127.5995 61.2438 35.0729 173.8896 71 I 5.2346 9.2560 128.6061 59.8647 39.9194 174.2536 72 Y 5.1836 8.6568 123.5350 56.1550 42.2664 172.8331 73 D 5.3401 9.0208 119.8457 52.5887 42.0321 176.5277 74 H 4.7869 8.9606 121.6667 57.7716 28.8095 176.2436 75 H 4.2541 8.3761 116.1392 57.7258 28.7850 175.1850 76 Q 4.1087 7.7547 120.8053 55.4857 28.4065 175.8885 77 R 4.0218 8.3944 125.3584 57.5066 30.9445 178.0070 78 E 4.0222 9.0166 119.9456 57.2269 28.5201 176.5786 79 L 3.8443 7.5992 119.8303 58.0912 42.0524 178.1413 80 N 4.0653 8.1275 116.4565 56.9219 38.8001 176.3894 81 Q 3.9326 8.0148 120.2423 58.9800 29.1100 177.9873 82 R 3.8921 8.4616 119.6611 59.6006 30.1620 178.8788 83 M 3.9667 8.2158 118.5377 58.3000 31.8531 178.6554 84 I 3.5853 7.8025 120.0097 64.6197 37.3593 178.1843 85 D 4.3518 8.3521 119.6424 57.4836 40.4715 178.7794 86 I 3.6725 7.7627 119.3066 64.5573 37.4460 177.9938 87 Q 4.0559 8.1056 120.1322 59.5289 28.6914 177.8253 88 H 4.3099 8.1853 116.1025 58.5465 28.7565 176.6293 89 A 4.4541 7.8480 120.1506 52.3245 18.5055 177.8290 90 S 4.2941 7.9976 114.9922 58.8691 64.0675 175.8405 91 G 3.9470 8.2657 107.9886 45.1444 0.0000 173.5996 92 T 4.2390 7.3610 116.0275 63.6465 69.3916 173.3773 93 H 4.9591 9.0976 121.7516 54.0818 31.1347 173.9717 94 V 4.2937 8.4789 123.8086 62.8021 31.5680 175.5340 95 L 4.4621 8.7966 128.0036 56.5902 42.9035 176.4969 96 C 4.9399 7.4805 115.5382 58.9417 34.7412 172.7578 97 T 5.1980 8.5853 113.6428 60.4174 71.5273 172.9155 98 T 4.7127 8.8899 121.4605 62.0380 71.4815 172.7364 99 H 5.2388 8.7695 124.3764 54.4088 32.6732 172.4020 100 I 4.3434 8.7209 126.6302 59.7542 39.6170 174.9911 101 H 4.7312 8.7131 124.8835 55.4183 27.7690 175.4020 102 M 4.2009 8.5824 124.9988 57.7278 32.6607 176.3271 103 D 4.5069 7.3620 115.8858 52.6693 41.4550 174.5093 104 E 3.9722 8.8862 118.3394 59.8444 29.6723 178.0622 105 H 5.2565 8.7864 112.5905 55.1069 31.6802 172.7664 106 N 5.1745 8.2597 115.1944 51.6638 42.5258 173.1901 107 C 5.0397 9.1329 121.0299 57.6428 32.1470 172.5358 108 L 5.1181 8.5300 124.7808 53.3368 44.2893 174.7671 109 E 5.3192 9.5984 125.7852 54.6809 33.1615 174.8233 110 T 5.0200 8.7844 114.1724 60.0549 71.3208 173.1209 111 I 4.7727 8.8403 128.0809 59.3322 39.9478 174.8642 112 I 4.5253 8.7812 129.8716 60.7531 38.3331 175.2658 113 L 5.3191 9.1414 127.4103 52.8807 45.2219 175.3192 114 Q 5.1103 10.4574 123.6686 53.4963 32.3646 175.8386 115 G 3.7451 7.5819 111.5038 45.4146 0.0000 171.1353 116 N 4.7975 7.8281 117.2593 51.7511 40.3143 175.8869 117 S 4.1393 8.2253 116.8088 61.5165 62.9101 176.5314 118 F 4.2363 8.2998 123.6731 61.2608 39.2681 176.8395 119 E 3.6976 8.3905 117.7558 59.3195 29.1837 179.3696 120 I 3.7241 7.8368 119.7593 64.6588 37.3769 178.5849 121 Q 3.9963 8.2653 118.7759 58.8876 28.5444 178.6971 122 R 3.7199 7.9757 120.0518 59.2251 29.9604 178.2391 123 L 3.8848 8.0088 120.2920 58.1372 42.0024 178.7985 124 Q 3.8768 7.7776 119.1865 59.1831 29.1040 178.2809 125 L 3.9696 7.7625 119.6821 57.4492 41.3760 179.1263 126 E 3.8438 7.9975 118.4867 59.4222 30.1317 178.4570 127 I 3.8784 7.9098 120.0717 64.4967 36.9508 178.7529 128 G 3.6888 7.9352 105.5364 47.5207 0.0000 175.5720 129 G 3.7166 7.7430 105.7400 45.4794 0.0000 173.9964 130 L 4.1879 7.2406 122.1088 54.0041 42.3683 176.5439 131 R 4.1270 8.3325 123.4874 57.7403 30.8302 176.7168 132 G 3.9686 9.0766 113.3569 45.1862 0.0000 172.8375 133 V 4.2860 7.3861 119.8426 62.2656 31.5348 175.4727 134 K 4.4484 8.7166 127.5587 58.1286 33.4381 177.4372 135 F 4.8756 8.0045 121.6801 56.8516 42.9255 173.0314 136 A 4.9295 7.8812 127.0648 50.1635 21.8764 174.9869 137 K 4.3184 8.9351 123.7914 54.7504 36.1164 174.7981 138 L 4.8249 8.5372 126.8660 53.9582 43.3283 176.1341 139 T 4.3562 8.6950 120.9403 61.5177 70.2945 174.0272 140 K 3.7742 8.2336 126.0229 55.8744 32.7061 176.5940 141 A 4.9298 8.6171 124.6051 50.5582 22.3091 176.3266 142 S 4.1958 8.5075 112.9387 58.9139 62.3974 174.2516 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 I 8.01 4.02 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 1.49 1.36 0.93 0.00 0.00 11 I 8.51 3.04 1.92 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 1.43 0.52 0.93 0.00 0.00 12 R 8.24 4.83 0.00 1.80 1.82 0.00 3.20 0.00 0.00 3.28 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.61 0.00 13 F 8.22 4.98 0.00 3.09 2.92 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 14 S 8.52 4.59 0.00 3.82 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 15 V 7.86 4.44 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 0.93 0.00 0.00 0.72 0.00 0.00 16 S 8.62 4.71 0.00 3.88 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 L 8.13 4.81 0.00 1.56 1.51 0.89 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 18 Q 8.54 4.13 0.00 2.22 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.86 0.00 0.00 0.00 0.00 0.00 2.45 2.49 0.00 19 Q 8.66 3.95 0.00 2.15 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.00 6.85 0.00 0.00 0.00 0.00 0.00 2.43 2.49 0.00 20 N 8.23 4.35 0.00 2.95 3.08 0.00 0.00 5.73 6.67 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 21 L 7.77 4.07 0.00 1.77 1.67 0.92 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 22 L 7.68 3.95 0.00 1.72 1.79 0.89 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 23 D 8.08 4.34 0.00 2.74 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 24 E 7.92 3.93 0.00 2.08 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 0.00 2.30 2.35 0.00 25 L 7.96 3.85 0.00 1.88 1.85 0.83 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 26 D 8.31 4.35 0.00 2.89 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 27 N 8.67 4.22 0.00 2.79 3.00 0.00 0.00 6.95 7.71 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 28 R 8.48 3.93 0.00 2.00 2.15 0.00 3.24 0.00 0.00 3.35 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.73 0.00 29 I 8.04 3.89 2.09 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 1.54 0.70 1.03 0.00 0.00 30 I 7.66 3.71 2.06 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 1.54 0.57 0.92 0.00 0.00 31 K 8.05 3.96 0.00 1.77 1.92 0.00 1.92 0.00 0.00 1.72 0.00 0.00 3.03 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.50 1.76 7.81 32 N 7.89 4.94 0.00 3.08 2.97 0.00 0.00 7.02 7.53 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 33 G 8.07 3.74 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 0.00 0.00 0.00 34 Y 7.98 4.19 0.00 3.00 3.07 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 35 S 9.77 4.31 0.00 3.95 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 36 S 7.67 4.83 0.00 3.97 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 R 8.57 3.85 0.00 1.83 1.95 0.00 3.09 0.00 0.00 3.34 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.66 0.00 38 S 8.03 4.16 0.00 4.05 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 39 E 7.96 3.97 0.00 2.11 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 0.00 2.61 2.43 0.00 40 L 7.27 3.44 0.00 0.78 1.46 0.37 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 41 V 7.72 3.56 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 1.09 0.00 0.00 0.93 0.00 0.00 42 R 8.37 3.93 0.00 2.07 2.18 0.00 3.20 0.00 0.00 3.21 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.74 0.00 43 D 7.94 4.42 0.00 2.92 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 44 M 8.13 4.06 0.00 2.06 2.20 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.54 0.00 45 I 8.08 3.70 2.04 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.91 0.92 0.00 0.00 46 R 8.18 3.93 0.00 1.88 2.01 0.00 3.13 0.00 0.00 3.24 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.97 0.00 47 E 8.02 4.13 0.00 2.12 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.30 0.00 48 K 8.34 3.99 0.00 2.00 1.95 0.00 1.66 0.00 0.00 1.80 0.00 0.00 2.94 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.45 1.64 7.81 49 L 8.27 4.03 0.00 1.75 1.73 0.93 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 50 V 7.40 3.70 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 1.02 0.00 0.00 1.00 0.00 0.00 51 E 8.11 4.01 0.00 2.32 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 2.29 2.45 0.00 52 D 8.14 4.68 0.00 2.69 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 53 N 8.31 4.51 0.00 2.81 3.18 0.00 0.00 7.19 7.37 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 54 W 8.50 4.50 0.00 3.44 3.34 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 55 A 7.46 4.67 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 56 E 7.96 4.96 0.00 1.91 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.17 0.00 57 D 8.17 5.15 0.00 2.64 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 0.00 0.00 0.00 0.00 58 N 8.74 4.78 0.00 2.59 2.48 0.00 0.00 6.83 8.02 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 59 P 0.00 3.03 0.00 2.02 1.91 0.00 3.66 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.12 0.00 *62 E 8.03 4.00 0.00 1.84 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.28 0.00 63 S 8.44 4.73 0.00 3.68 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 64 K 8.43 4.06 0.00 1.21 0.75 0.00 0.65 0.00 0.00 0.61 0.00 0.00 2.29 0.00 0.00 2.47 0.00 0.00 0.00 0.00 0.91 0.97 7.81 65 I 8.61 5.20 2.01 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 1.35 1.05 0.99 0.00 0.00 66 A 9.14 5.12 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 67 V 8.58 4.66 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 1.01 0.00 0.00 0.95 0.00 0.00 68 L 8.92 4.79 0.00 1.78 1.52 0.85 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 69 V 8.81 4.85 2.34 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 1.16 0.00 0.00 0.99 0.00 0.00 70 V 9.26 5.08 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.94 0.00 0.00 71 I 9.26 5.23 2.04 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.78 0.96 0.00 0.00 72 Y 8.66 5.18 0.00 3.24 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 73 D 9.02 5.34 0.00 2.84 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 74 H 8.96 4.79 0.00 3.25 3.38 0.00 5.78 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 H 8.38 4.25 0.00 3.32 3.37 0.00 5.67 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 Q 7.75 4.11 0.00 2.05 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.83 0.00 0.00 0.00 0.00 0.00 2.59 2.40 0.00 77 R 8.39 4.02 0.00 1.90 1.85 0.00 3.42 0.00 0.00 3.36 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.61 0.00 78 E 9.02 4.02 0.00 2.22 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.29 0.00 79 L 7.60 3.84 0.00 1.77 1.82 0.82 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 80 N 8.13 4.07 0.00 2.85 2.83 0.00 0.00 6.77 7.40 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 81 Q 8.01 3.93 0.00 2.20 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.65 0.00 0.00 0.00 0.00 0.00 2.43 2.51 0.00 82 R 8.46 3.89 0.00 2.00 1.93 0.00 3.16 0.00 0.00 3.14 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.88 0.00 83 M 8.22 3.97 0.00 1.91 2.10 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.43 0.00 84 I 7.80 3.59 2.00 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 1.72 0.86 0.87 0.00 0.00 85 D 8.35 4.35 0.00 2.79 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 86 I 7.76 3.67 2.03 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 1.37 0.49 0.86 0.00 0.00 87 Q 8.11 4.06 0.00 2.11 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.79 0.00 0.00 0.00 0.00 0.00 2.32 2.50 0.00 88 H 8.19 4.31 0.00 3.29 3.32 0.00 5.72 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 A 7.85 4.45 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 90 S 8.00 4.29 0.00 3.98 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 91 G 8.27 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 92 T 7.36 4.24 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 1.28 0.00 0.00 93 H 9.10 4.96 0.00 3.03 3.19 0.00 5.61 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 V 8.48 4.29 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 0.82 0.00 0.00 0.93 0.00 0.00 95 L 8.80 4.46 0.00 1.56 1.72 0.95 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 96 C 7.48 4.94 0.00 2.96 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 97 T 8.59 5.20 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 1.23 0.00 0.00 98 T 8.89 4.71 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 1.21 0.00 0.00 99 H 8.77 5.24 0.00 3.11 3.09 0.00 5.88 0.00 0.00 0.00 0.00 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 I 8.72 4.34 1.79 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 1.18 0.80 0.87 0.00 0.00 101 H 8.71 4.73 0.00 3.13 3.22 0.00 5.70 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 M 8.58 4.20 0.00 1.99 2.19 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.41 0.00 103 D 7.36 4.51 0.00 2.81 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 0.00 104 E 8.89 3.97 0.00 1.82 1.51 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 2.30 2.34 0.00 105 H 8.79 5.26 0.00 3.17 3.45 0.00 5.81 0.00 0.00 0.00 0.00 6.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 N 8.26 5.17 0.00 2.71 2.58 0.00 0.00 6.78 7.54 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 0.00 107 C 9.13 5.04 0.00 1.62 2.23 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 0.00 108 L 8.53 5.12 0.00 1.63 1.42 0.90 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 109 E 9.60 5.32 0.00 2.01 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 2.27 2.35 0.00 110 T 8.78 5.02 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 0.00 111 I 8.84 4.77 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 1.25 0.86 0.92 0.00 0.00 112 I 8.78 4.53 1.90 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 1.25 0.68 0.95 0.00 0.00 113 L 9.14 5.32 0.00 1.61 1.58 0.94 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 114 Q 10.46 5.11 0.00 2.08 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.89 0.00 0.00 0.00 0.00 0.00 2.26 2.47 0.00 115 G 7.58 3.75 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 0.00 0.00 0.00 116 N 7.83 4.80 0.00 2.95 2.95 0.00 0.00 5.73 7.64 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 0.00 117 S 8.23 4.14 0.00 4.34 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 0.00 118 F 8.30 4.24 0.00 3.06 3.32 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 0.00 119 E 8.39 3.70 0.00 2.11 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 0.00 2.44 2.48 0.00 120 I 7.84 3.72 2.16 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.51 1.11 0.00 0.00 121 Q 8.27 4.00 0.00 2.22 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.80 0.00 0.00 0.00 0.00 0.00 2.41 2.57 0.00 122 R 7.98 3.72 0.00 1.38 1.71 0.00 2.52 0.00 0.00 2.75 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.42 0.00 123 L 8.01 3.88 0.00 1.86 1.82 0.87 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 124 Q 7.78 3.88 0.00 2.08 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.59 0.00 0.00 0.00 0.00 0.00 2.25 2.30 0.00 125 L 7.76 3.97 0.00 1.86 1.65 0.92 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 126 E 8.00 3.84 0.00 1.89 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 2.28 2.35 0.00 127 I 7.91 3.88 1.81 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.16 0.84 0.00 0.00 128 G 7.94 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 0.00 129 G 7.74 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 0.00 130 L 7.24 4.19 0.00 1.81 1.56 0.85 0.48 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 0.00 131 R 8.33 4.13 0.00 1.77 1.84 0.00 3.24 0.00 0.00 3.24 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.64 0.00 132 G 9.08 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 V 7.39 4.29 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 0.83 0.00 0.00 0.92 0.00 0.00 134 K 8.72 4.45 0.00 1.81 1.93 0.00 1.87 0.00 0.00 1.67 0.00 0.00 2.92 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.48 1.46 7.81 135 F 8.00 4.88 0.00 3.12 2.88 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 0.00 136 A 7.88 4.93 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 K 8.94 4.32 0.00 1.05 1.41 0.00 1.60 0.00 0.00 1.83 0.00 0.00 2.88 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.28 1.28 7.81 138 L 8.54 4.82 0.00 1.62 1.39 0.79 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 139 T 8.69 4.36 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 140 K 8.23 3.77 0.00 0.95 0.74 0.00 1.24 0.00 0.00 0.92 0.00 0.00 2.80 0.00 0.00 2.61 0.00 0.00 0.00 0.00 0.30 0.77 7.81 141 A 8.62 4.93 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 0.00 142 S 8.51 4.20 0.00 4.02 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 * Residues marked with a * may have inaccurate shift predictions.