NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 N 5.0350 8.2833 118.0831 53.0758 40.7420 172.7318 3 K 5.0058 9.6540 122.6650 54.2087 35.7711 173.6011 4 I 5.0771 9.2424 125.2776 59.5291 41.2556 173.6985 5 F 5.1382 9.3533 129.7815 56.5666 41.6518 174.3027 6 I 4.8211 7.9580 126.4939 59.4606 40.7536 173.7964 7 Y 4.7040 8.5974 126.8170 55.5310 41.9581 173.5247 8 A 4.8629 7.0271 128.6043 48.7658 20.6463 177.5099 9 G 4.0273 8.2800 113.3770 45.0908 0.0000 172.9379 10 V 4.6502 7.4113 113.4000 59.9585 35.0909 176.3461 11 R 4.1718 8.5384 119.8623 55.5893 32.2912 175.2551 12 N 5.1120 7.9275 117.5802 51.5371 40.4926 174.9736 13 H 4.0702 9.1981 121.3084 58.1885 28.7789 175.6649 14 N 4.5512 7.6679 115.7263 52.8624 38.7337 175.3154 15 S 4.0400 7.8518 114.1951 59.0080 63.5199 175.1875 16 K 3.8450 8.6402 129.1673 59.6442 32.0122 179.0394 17 T 4.0019 7.8949 115.8384 66.5638 68.3556 176.0998 18 L 4.0468 8.1321 122.2879 57.9757 42.0926 178.5322 19 E 3.8055 7.9603 119.2631 59.6955 29.5446 178.5785 20 Y 4.3309 8.0584 116.8015 61.2920 37.8864 178.5621 21 T 4.0149 8.3445 117.0316 66.5504 68.4859 177.0276 22 K 4.0433 8.5866 120.9395 59.2277 31.9590 179.4005 23 R 3.8587 8.1240 119.1282 59.3420 30.0709 178.2741 24 L 3.9325 8.1571 120.1946 58.2325 42.0928 178.8405 25 S 4.1523 8.2607 112.9903 61.5834 62.3497 176.3113 26 S 4.1345 8.3867 118.0746 61.5531 62.4265 176.7395 27 I 3.6446 7.9294 122.4778 64.4569 36.8956 178.4244 28 I 3.6620 7.7047 120.4682 64.7634 36.7805 178.8327 29 S 4.3758 8.0311 114.4921 61.0566 62.7150 176.0307 30 S 4.4647 7.7768 114.7963 59.2825 63.2884 174.6434 31 R 4.6355 7.4287 118.8686 55.8457 32.0476 174.9398 32 N 4.9613 8.1272 113.8501 51.5805 42.5930 174.1201 33 N 4.7020 8.5453 119.6574 52.3142 38.1000 174.1099 34 V 4.5964 7.7756 116.5687 59.3589 36.6918 174.5246 35 D 4.7710 9.0750 122.2912 53.2278 42.1979 174.8510 36 I 4.9568 8.3453 127.0996 59.6185 39.4583 175.2302 37 S 4.6199 9.0780 122.4472 56.7052 64.1120 172.5334 38 F 4.7925 8.8216 130.7548 56.8048 40.2539 174.8301 39 R 5.2350 8.5933 125.9537 54.9515 33.8038 175.0747 40 T 4.3969 8.9175 110.9143 59.9832 72.4038 172.8310 41 P 4.5844 0.0000 0.0000 64.8515 31.5070 178.1597 42 F 4.4026 8.0261 117.1577 59.3761 38.9687 176.0024 43 N 5.0376 8.2924 114.1193 52.4658 37.9875 174.1883 44 S 4.9374 8.2330 114.6698 57.0491 67.1265 173.0088 45 E 4.5198 9.9696 125.5821 54.7691 31.1280 174.7123 46 L 5.0351 8.4498 127.0552 52.4881 43.7927 176.4896 47 E 4.0798 9.3918 123.8718 55.8503 30.1345 177.7593 48 I 3.8820 8.1572 122.3861 61.3084 37.5682 176.2148 49 S 4.0240 9.1298 120.8224 59.1848 62.4315 173.5238 50 N 4.9808 8.4659 122.9404 52.1784 37.8779 174.5604 51 S 4.1092 7.9373 112.6875 58.8003 63.7311 173.1916 52 D 4.7908 8.0971 120.3055 52.2858 43.4792 176.8035 53 S 3.6829 8.5903 123.2250 61.8024 62.9449 176.5914 54 E 3.9427 8.1439 120.2828 59.6709 29.3318 179.2543 55 E 3.8671 8.0190 118.2637 59.0517 29.5433 179.2602 56 L 3.6938 7.9352 120.7137 58.1954 41.7487 179.0009 57 F 4.6813 7.9555 117.8374 60.1371 38.9971 178.1617 58 K 3.5883 8.2934 118.0963 57.8401 31.8064 178.3632 59 K 4.5046 7.5558 114.4557 54.9601 33.6562 176.0632 60 G 2.8444 7.4658 106.1066 46.6910 0.0000 173.5654 61 I 3.8602 7.3429 121.0589 59.8693 37.4813 175.3531 62 D 4.5274 8.3918 124.9738 52.5041 42.7658 176.0806 63 R 4.5515 8.1718 128.4019 55.1436 29.7597 176.2799 64 Q 4.5769 7.7471 113.1590 58.5587 35.9324 177.8486 65 S 4.0587 8.0201 113.4468 61.6832 62.9156 175.5265 66 N 4.7463 8.0436 114.7394 52.9580 37.0982 175.3362 67 A 4.7280 8.1515 122.6748 52.5986 21.6322 176.7354 68 D 4.6190 7.5041 115.2303 52.3387 40.8367 176.3967 69 D 4.8621 8.9724 121.6168 54.7753 40.8193 178.1088 70 G 3.6835 8.7338 109.8870 47.7439 0.0000 176.3491 71 G 3.6612 8.0388 107.9270 47.6388 0.0000 176.0337 72 V 3.7590 7.7889 121.7487 64.3649 31.4318 178.3446 73 I 3.8993 7.9994 120.4908 64.1748 36.9611 178.4976 74 K 4.0056 8.2653 119.5819 59.2791 31.9562 179.3132 75 K 4.0069 8.2763 119.8799 59.7172 32.0433 178.7943 76 E 4.1343 8.5433 118.9856 59.2325 29.1257 179.3419 77 L 3.7300 7.6872 118.4409 57.8269 41.8062 179.3859 78 L 4.0972 7.8563 117.4351 57.0986 41.6232 178.4365 79 E 4.3931 7.8549 116.0076 55.7731 30.1721 176.6326 80 S 4.5954 7.0220 114.2207 58.1216 64.5273 173.6376 81 D 4.8155 9.1623 121.7115 55.7413 42.5648 176.7436 82 I 5.2099 7.7909 117.6389 59.4514 41.5376 174.6434 83 I 5.1094 9.1594 126.6004 59.6165 40.4387 174.4200 84 I 4.9365 9.1270 127.9215 59.5207 39.9599 174.5088 85 I 4.8954 8.4471 128.1273 59.3180 39.8775 174.8399 86 S 5.2827 8.9227 121.3938 56.8096 66.3866 173.0287 87 S 4.8329 9.0613 116.1456 56.3090 65.9970 171.6963 88 P 5.0662 0.0000 0.0000 62.0170 32.4814 176.2362 89 V 4.4289 8.7158 122.5405 61.6647 32.2449 174.1308 90 Y 4.8983 8.3087 129.4315 56.5986 40.9896 175.6064 91 L 3.1667 8.7361 126.8438 56.5228 39.0280 174.0199 92 Q 3.4574 8.2164 111.0332 56.2246 26.5616 173.0376 93 N 4.7926 7.5007 112.1033 52.3479 42.4609 173.6743 94 V 3.9868 7.9742 114.4017 60.7643 32.3572 176.9737 95 S 4.5077 8.5743 117.1969 57.8865 64.9509 175.5330 96 V 3.6093 8.3623 121.3706 66.6334 31.1714 177.9024 97 D 4.5324 8.1435 117.7582 57.4040 40.4248 178.8292 98 T 4.1549 7.9705 116.5625 66.5638 68.4324 176.7186 99 K 4.1688 8.4432 121.7763 59.5000 32.0925 178.3892 100 N 4.2944 8.4065 117.5308 56.4487 38.6552 176.5555 101 F 3.8279 8.2866 121.2753 61.3616 39.6213 176.8733 102 I 3.8017 8.0059 119.3131 64.5198 36.9260 178.3671 103 E 3.9077 8.4756 119.6960 59.3563 29.0493 179.5518 104 R 3.8545 8.0519 117.5345 57.7374 30.2195 177.9722 105 I 3.6681 6.7045 112.2569 60.3620 37.7343 177.6255 106 G 3.6899 7.8347 110.0604 47.8696 0.0000 176.1380 107 G 3.6476 7.7809 108.5002 47.4756 0.0000 173.9681 108 W 4.8805 8.0800 119.2186 56.5018 29.6577 178.0400 109 S 4.1024 8.0684 116.4590 61.7533 62.2556 175.5132 110 H 4.7813 7.9504 113.3996 55.4744 28.8412 174.6656 111 L 4.2474 7.6962 118.7271 53.5909 43.0168 176.3477 112 F 3.8735 7.3609 116.6932 58.4860 36.4109 177.2041 113 R 4.0088 7.9577 118.4456 58.1977 30.3645 177.7279 114 L 4.3851 7.8000 116.8347 54.0689 42.1184 176.0443 115 A 4.5370 6.9161 122.1159 53.1068 18.5922 178.4841 116 G 2.4773 5.3800 110.3555 44.0994 0.0000 173.5167 117 K 4.3495 7.1759 119.0765 55.0759 34.6127 175.4650 118 F 5.2416 8.5689 121.2853 55.8865 41.4348 174.8324 119 V 4.9335 9.3013 123.6664 61.0543 34.2972 174.2762 120 V 4.9847 8.9838 127.7378 61.2509 34.3656 174.1775 121 T 5.1596 8.5315 117.1491 59.8389 72.0857 172.8458 122 L 5.2426 8.8939 125.1624 53.5225 45.4119 174.6275 123 D 5.4923 9.2340 125.8220 51.5310 42.9375 174.8711 124 V 4.8636 8.6751 120.5103 61.1341 34.7546 173.7035 125 A 5.0860 8.9398 129.9753 50.2268 20.9596 176.5740 126 E 4.2471 9.1608 122.6101 57.1530 30.3184 176.1944 127 S 4.8598 7.7556 112.8156 57.5060 66.3396 173.8634 128 N 4.8108 8.5249 122.3300 51.8687 38.0021 175.5484 129 G 4.2551 7.7935 115.6298 44.8092 0.0000 170.4538 130 S 4.6618 8.4606 117.9076 56.4084 65.1963 172.8331 131 D 4.7264 8.2960 124.6978 52.9983 41.8327 174.1791 132 N 5.5510 8.2466 114.5532 51.8464 39.9208 177.6622 133 V 3.7260 8.6437 120.2411 66.2524 31.6421 177.0707 134 S 4.1894 8.1236 113.5337 61.6323 62.8227 176.1622 135 E 3.9650 8.1894 121.7032 59.1143 29.2672 178.4866 136 Y 4.1076 8.2426 119.5688 60.8434 38.9414 178.1493 137 L 4.0426 8.2960 119.9998 57.6302 41.7099 179.5191 138 R 3.9435 8.2531 118.7741 59.5802 30.0573 178.2982 139 D 4.2951 8.1804 118.6776 57.3830 40.6022 178.8715 140 I 3.5256 7.2727 118.7361 64.5878 37.4221 178.4605 141 F 4.2824 8.2098 118.3172 60.1276 38.4549 177.9903 142 S 4.7331 8.1768 113.9244 60.7759 62.6314 177.2727 143 Y 4.3646 8.3306 123.5053 57.2040 38.6899 176.8553 *145 G 4.1765 8.2331 106.2076 45.5824 0.0000 174.1108 146 G 4.2313 8.3205 108.5285 46.1736 0.0000 172.5624 147 Q 4.6364 8.9907 124.1765 54.8089 30.6377 174.9767 148 I 4.4810 8.5138 127.8145 61.0460 36.4584 175.5220 149 L 4.2897 9.0889 130.8717 58.1291 42.7380 176.4863 150 H 4.8022 7.7965 115.1103 55.4219 33.2151 172.3250 151 Q 5.0031 8.2934 121.6583 54.0354 32.3278 174.7243 152 V 4.3277 8.8656 123.3518 61.1180 34.4966 174.2428 153 S 5.0407 8.7350 123.5833 56.9932 65.1185 173.3075 154 I 4.3285 8.5771 126.8511 60.2030 38.8055 175.4065 155 T 5.0199 8.1693 121.9322 61.6475 72.3798 173.3005 156 N 4.6759 8.6751 124.9616 53.5102 38.9815 173.7066 157 S 4.6205 8.0834 122.9111 57.3336 65.5886 173.2730 158 L 4.0384 8.6745 118.1550 57.0726 41.7512 176.6485 159 K 4.2387 7.3884 119.7862 54.5325 32.2348 175.1868 160 D 4.6256 8.6130 127.5409 53.5592 41.2058 175.4793 161 I 4.4336 8.1734 118.4103 60.1655 38.7183 176.7688 162 A 3.9090 8.3992 125.0395 55.8909 17.7876 180.0374 163 E 3.8897 8.1663 114.4171 59.6770 29.6951 179.0313 164 A 4.1404 7.9144 118.6983 55.2728 18.7650 179.1978 165 Q 4.1541 8.2957 116.6984 58.8873 28.8145 179.6535 166 L 3.9486 7.8663 119.1666 54.9564 41.6229 178.7975 *168 E 4.3312 8.2648 121.5648 56.2331 31.6428 177.5406 169 A 3.8806 7.7689 120.4452 55.2564 18.2290 179.7760 170 T 3.7785 7.8210 114.3986 66.8858 68.5144 176.5093 171 Y 4.3413 7.4791 118.1813 61.0167 37.7241 178.6434 172 K 3.9729 7.8855 119.4322 59.5579 32.1524 179.4484 173 I 3.7575 7.7941 119.9916 64.5194 36.9522 178.4092 174 E 3.9903 8.5936 119.7064 59.4568 29.2598 179.1493 175 D 4.3523 8.1015 118.8540 56.9812 40.7820 178.9348 176 V 3.4178 7.1988 117.5868 65.5030 31.3331 177.9880 177 L 3.9957 7.7001 117.6803 57.9154 41.5354 178.2745 178 E 4.0858 8.4191 116.1747 56.9951 29.6391 177.3873 179 G 3.8878 7.9649 106.9127 46.2497 0.0000 174.8871 180 K 4.2049 8.4332 120.6915 56.9267 32.5901 177.2265 181 I 4.5175 7.5603 119.4836 59.0051 39.4418 174.7952 182 K 4.9511 8.4666 123.9996 54.6097 34.9282 175.3588 183 Y 4.3825 8.9914 121.6820 58.1234 39.0097 175.8287 184 K 4.5161 8.9308 126.4484 54.6828 35.9544 176.4977 185 T 3.9702 8.4574 114.1829 61.2586 69.9488 174.4433 186 T 4.5769 7.8316 112.5231 60.0272 72.5114 175.1454 187 D 4.3508 8.4965 120.7951 57.6013 40.7822 178.2923 188 Y 4.1850 8.1277 119.5592 61.0096 38.7163 178.2813 189 Q 3.8810 7.9920 118.6250 59.0039 28.8542 178.5112 190 E 3.9509 8.4121 119.7654 59.3259 29.4238 179.6729 191 R 3.9420 8.4620 118.5314 59.1059 30.0793 178.8932 192 A 3.9468 7.8347 120.6612 55.1214 18.3129 179.0330 193 Y 4.3100 8.2657 118.2357 61.1989 38.7688 178.4427 194 Q 3.7982 8.3001 118.9226 59.0487 28.6360 178.9133 195 T 3.8063 8.0276 116.8150 66.6534 68.4612 176.7616 196 L 3.6976 8.0148 120.9665 57.3319 41.5615 179.2887 197 K 3.2984 7.7431 119.5585 59.5241 31.8493 178.7959 198 L 3.9039 7.2180 117.7861 57.6638 41.7580 179.4560 199 I 3.5669 7.1562 119.8277 64.3417 37.1522 178.5574 200 L 2.6387 7.3936 119.8615 57.0205 40.9960 179.1044 201 E 3.6178 7.5667 118.8936 58.9396 29.5926 177.2850 202 N 4.5629 7.5534 113.0722 53.6282 39.1039 174.6836 203 Y 4.6211 7.2973 116.6166 57.3689 38.7946 175.2355 204 D 4.5560 8.4715 120.4930 54.0739 41.8045 177.2029 205 S 4.1965 8.7479 119.5592 60.7391 62.9722 174.7711 206 E 4.5820 8.1326 118.7799 56.0028 29.4714 175.3947 207 H 4.2569 8.3399 121.2984 55.8797 30.4690 175.5146 208 F 4.2408 8.9178 130.1429 61.6912 39.5860 176.3830 209 E 4.2353 8.4941 119.6229 59.3401 29.6204 179.7354 210 K 4.3308 8.1063 116.9557 57.1593 31.8440 177.7196 *212 Y 4.4305 8.0570 119.5453 56.9057 40.4264 177.1176 213 W 3.8841 8.6963 119.5003 59.7258 29.6973 178.5513 214 E 4.3088 8.9716 118.1518 59.6007 29.1096 179.5238 215 K 4.0235 8.0657 116.2328 59.1287 32.1778 178.1028 216 K 4.1330 7.9346 115.9246 56.1530 31.9892 176.9582 217 R 4.0575 7.9057 117.5400 57.3143 27.8564 178.4546 218 L 3.3123 7.8298 120.0153 57.1510 41.7119 178.9400 219 F 4.7156 8.1920 117.0209 60.0088 39.1220 175.6397 220 E 4.5665 7.9805 116.5921 56.0728 29.5829 175.6178 221 A 5.0376 7.9220 120.9951 51.2406 21.4455 177.2839 222 N 4.7353 8.8721 117.2403 55.0921 39.4293 176.0723 223 S 4.5422 7.4008 111.5047 56.0198 66.8255 175.2676 224 L 3.0356 8.2043 124.1828 57.8480 41.6242 178.6591 225 E 4.1216 8.4229 119.3765 59.1394 29.5804 178.3685 226 E 3.9413 8.1663 119.4055 59.0261 29.7003 178.2868 227 W 4.1250 8.1078 128.3887 60.7765 30.1538 177.1290 228 Y 3.2481 8.2189 119.0372 60.8874 38.0147 177.8206 229 Y 3.6811 7.7379 116.1204 60.5773 38.0213 178.0879 230 V 3.6616 7.9763 119.0202 66.3402 31.7552 177.0256 231 E 3.9386 7.6029 117.3677 57.9393 29.4658 176.2323 232 N 4.0178 6.8185 121.0594 53.6026 38.4313 175.1682 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 N 8.28 5.03 0.00 2.73 2.85 0.00 0.00 6.78 7.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 K 9.65 5.01 0.00 1.74 1.75 0.00 1.82 0.00 0.00 1.72 0.00 0.00 2.93 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.40 1.54 7.81 4 I 9.24 5.08 1.92 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.87 1.00 0.00 0.00 5 F 9.35 5.14 0.00 3.17 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 6 I 7.96 4.82 1.16 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.34 0.20 0.00 0.00 7 Y 8.60 4.70 0.00 2.77 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 A 7.03 4.86 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 9 G 8.28 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 V 7.41 4.65 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 1.10 0.00 0.00 11 R 8.54 4.17 0.00 1.72 1.86 0.00 3.23 0.00 0.00 2.89 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.42 0.00 12 N 7.93 5.11 0.00 2.77 2.66 0.00 0.00 6.96 7.89 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 13 H 9.20 4.07 0.00 2.97 2.96 0.00 5.57 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 N 7.67 4.55 0.00 2.57 2.75 0.00 0.00 6.83 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 S 7.85 4.04 0.00 3.95 3.84 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 0.00 0.00 0.00 16 K 8.64 3.85 0.00 1.87 1.89 0.00 1.61 0.00 0.00 1.72 0.00 0.00 2.92 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.69 1.24 7.81 17 T 7.89 4.00 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 1.25 0.00 0.00 18 L 8.13 4.05 0.00 1.81 1.85 1.06 0.71 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 19 E 7.96 3.81 0.00 1.92 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.17 0.00 20 Y 8.06 4.33 0.00 3.06 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 21 T 8.34 4.01 4.58 0.00 0.00 0.00 0.00 0.00 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 22 K 8.59 4.04 0.00 1.84 1.72 0.00 0.62 0.00 0.00 0.61 0.00 0.00 2.55 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.53 1.37 7.81 23 R 8.12 3.86 0.00 2.04 2.23 0.00 3.16 0.00 0.00 3.11 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.73 0.00 24 L 8.16 3.93 0.00 1.83 1.88 0.90 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 25 S 8.26 4.15 0.00 4.19 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 26 S 8.39 4.13 0.00 4.04 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 27 I 7.93 3.64 1.99 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 1.50 1.02 0.83 0.00 0.00 28 I 7.70 3.66 2.01 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 1.50 0.79 0.92 0.00 0.00 29 S 8.03 4.38 0.00 3.86 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 30 S 7.78 4.46 0.00 4.04 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 31 R 7.43 4.64 0.00 1.94 2.02 0.00 3.10 0.00 0.00 3.31 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.55 0.00 32 N 8.13 4.96 0.00 2.77 2.66 0.00 0.00 6.80 8.06 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 33 N 8.55 4.70 0.00 2.66 2.76 0.00 0.00 6.79 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 34 V 7.78 4.60 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 0.77 0.00 0.00 0.96 0.00 0.00 35 D 9.08 4.77 0.00 2.77 2.70 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 0.00 0.00 0.00 36 I 8.35 4.96 1.93 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 1.27 0.79 0.99 0.00 0.00 37 S 9.08 4.62 0.00 3.98 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 38 F 8.82 4.79 0.00 3.06 2.82 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 0.00 0.00 0.00 39 R 8.59 5.24 0.00 1.76 2.01 0.00 3.57 0.00 0.00 3.50 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.53 0.00 40 T 8.92 4.40 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 1.38 0.00 0.00 41 P 0.00 4.58 0.00 1.82 2.06 0.00 3.65 0.00 0.00 3.43 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 42 F 8.03 4.40 0.00 3.13 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 43 N 8.29 5.04 0.00 2.86 2.97 0.00 0.00 5.77 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 44 S 8.23 4.94 0.00 4.11 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 45 E 9.97 4.52 0.00 2.07 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 2.33 0.00 46 L 8.45 5.04 0.00 1.59 1.58 0.90 0.94 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 47 E 9.39 4.08 0.00 1.97 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.42 0.00 48 I 8.16 3.88 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 1.30 0.46 0.90 0.00 0.00 49 S 9.13 4.02 0.00 3.69 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 50 N 8.47 4.98 0.00 2.76 2.77 0.00 0.00 6.23 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 51 S 7.94 4.11 0.00 3.77 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 52 D 8.10 4.79 0.00 2.69 2.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 S 8.59 3.68 0.00 3.92 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 54 E 8.14 3.94 0.00 2.17 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 2.39 2.40 0.00 55 E 8.02 3.87 0.00 1.82 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.41 0.00 56 L 7.94 3.69 0.00 1.43 0.65 0.45 0.56 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 57 F 7.96 4.68 0.00 3.23 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 K 8.29 3.59 0.00 1.92 1.74 0.00 1.55 0.00 0.00 1.58 0.00 0.00 2.87 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.29 1.49 7.81 59 K 7.56 4.50 0.00 1.75 1.74 0.00 1.83 0.00 0.00 1.69 0.00 0.00 2.96 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.31 1.34 7.81 60 G 7.47 2.84 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 0.00 0.00 0.00 0.00 0.00 0.00 61 I 7.34 3.86 1.82 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 1.10 0.62 0.82 0.00 0.00 62 D 8.39 4.53 0.00 2.40 2.43 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.17 4.55 0.00 1.90 1.91 0.00 3.02 0.00 0.00 3.17 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.56 0.00 64 Q 7.75 4.58 0.00 2.01 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.72 6.78 0.00 0.00 0.00 0.00 0.00 2.22 2.26 0.00 65 S 8.02 4.06 0.00 3.92 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 66 N 8.04 4.75 0.00 2.83 2.90 0.00 0.00 5.73 7.26 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 67 A 8.15 4.73 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 68 D 7.50 4.62 0.00 2.98 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 D 8.97 4.86 0.00 2.97 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 70 G 8.73 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 71 G 8.04 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 V 7.79 3.76 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 0.95 0.00 0.00 1.03 0.00 0.00 73 I 8.00 3.90 2.08 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 1.91 0.86 0.97 0.00 0.00 74 K 8.27 4.01 0.00 2.01 2.17 0.00 1.58 0.00 0.00 1.55 0.00 0.00 2.58 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.82 1.34 7.81 75 K 8.28 4.01 0.00 1.90 2.03 0.00 1.68 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.50 1.54 7.81 76 E 8.54 4.13 0.00 2.27 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 2.48 2.83 0.00 77 L 7.69 3.73 0.00 1.88 1.81 0.84 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 78 L 7.86 4.10 0.00 1.79 1.68 0.86 0.49 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 79 E 7.85 4.39 0.00 2.01 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 2.32 2.48 0.00 80 S 7.02 4.60 0.00 4.20 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 0.00 81 D 9.16 4.82 0.00 2.82 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 82 I 7.79 5.21 1.96 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 1.51 0.98 1.04 0.00 0.00 83 I 9.16 5.11 1.92 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.84 0.99 0.00 0.00 84 I 9.13 4.94 1.77 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 1.22 0.72 0.84 0.00 0.00 85 I 8.45 4.90 1.58 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.05 0.93 0.00 0.00 86 S 8.92 5.28 0.00 3.89 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 S 9.06 4.83 0.00 3.95 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 88 P 0.00 5.07 0.00 2.03 1.99 0.00 3.80 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 2.04 1.95 0.00 89 V 8.72 4.43 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 0.83 0.00 0.00 0.98 0.00 0.00 90 Y 8.31 4.90 0.00 2.90 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 L 8.74 3.17 0.00 1.57 1.55 0.69 -0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 92 Q 8.22 3.46 0.00 2.11 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.74 0.00 0.00 0.00 0.00 0.00 2.31 2.44 0.00 93 N 7.50 4.79 0.00 2.66 2.58 0.00 0.00 7.28 7.59 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 94 V 7.97 3.99 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 0.99 0.00 0.00 0.98 0.00 0.00 95 S 8.57 4.51 0.00 4.13 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 96 V 8.36 3.61 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 1.09 0.00 0.00 0.98 0.00 0.00 97 D 8.14 4.53 0.00 2.82 2.90 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 0.00 0.00 0.00 98 T 7.97 4.15 4.52 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 1.43 0.00 0.00 99 K 8.44 4.17 0.00 1.92 2.00 0.00 1.64 0.00 0.00 1.57 0.00 0.00 3.06 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.46 1.63 7.81 100 N 8.41 4.29 0.00 3.04 3.00 0.00 0.00 6.80 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 0.00 101 F 8.29 3.83 0.00 2.87 3.25 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 0.00 102 I 8.01 3.80 2.12 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.02 0.84 0.00 0.00 103 E 8.48 3.91 0.00 1.94 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 0.00 2.31 2.54 0.00 104 R 8.05 3.85 0.00 1.53 1.68 0.00 3.14 0.00 0.00 3.32 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.64 0.00 105 I 6.70 3.67 1.02 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.60 -0.03 0.00 0.00 106 G 7.83 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 0.00 107 G 7.78 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 W 8.08 4.88 0.00 3.48 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 S 8.07 4.10 0.00 3.58 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 0.00 110 H 7.95 4.78 0.00 3.18 3.18 0.00 5.66 0.00 0.00 0.00 0.00 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 L 7.70 4.25 0.00 1.26 0.64 0.67 0.20 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 0.00 112 F 7.36 3.87 0.00 2.93 2.93 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 0.00 113 R 7.96 4.01 0.00 1.18 1.21 0.00 2.63 0.00 0.00 2.25 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.14 0.00 114 L 7.80 4.39 0.00 1.88 1.76 1.27 0.91 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 0.00 115 A 6.92 4.54 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 0.00 116 G 5.38 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 K 7.18 4.35 0.00 1.75 1.71 0.00 1.64 0.00 0.00 1.73 0.00 0.00 2.94 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.31 1.33 7.81 118 F 8.57 5.24 0.00 3.11 3.01 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 0.00 119 V 9.30 4.93 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 0.76 0.00 0.00 1.01 0.00 0.00 120 V 8.98 4.98 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 1.03 0.00 0.00 0.98 0.00 0.00 121 T 8.53 5.16 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 1.17 0.00 0.00 122 L 8.89 5.24 0.00 1.71 1.48 0.87 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 123 D 9.23 5.49 0.00 2.83 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 0.00 124 V 8.68 4.86 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 1.20 0.00 0.00 1.03 0.00 0.00 125 A 8.94 5.09 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 0.00 126 E 9.16 4.25 0.00 1.97 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 2.30 2.41 0.00 127 S 7.76 4.86 0.00 3.89 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 0.00 128 N 8.52 4.81 0.00 2.84 2.75 0.00 0.00 6.76 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 0.00 129 G 7.79 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 0.00 0.00 0.00 0.00 130 S 8.46 4.66 0.00 3.78 3.70 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 0.00 0.00 0.00 131 D 8.30 4.73 0.00 2.79 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 N 8.25 5.55 0.00 2.79 2.84 0.00 0.00 7.25 7.68 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 0.00 133 V 8.64 3.73 2.26 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 1.16 0.00 0.00 0.98 0.00 0.00 134 S 8.12 4.19 0.00 4.11 4.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 E 8.19 3.96 0.00 2.30 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 2.41 2.44 0.00 136 Y 8.24 4.11 0.00 3.11 3.22 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 0.00 137 L 8.30 4.04 0.00 1.98 1.89 1.04 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 138 R 8.25 3.94 0.00 2.16 2.12 0.00 3.04 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.69 0.00 139 D 8.18 4.30 0.00 2.78 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 0.00 140 I 7.27 3.53 1.41 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 0.72 -0.20 0.40 0.00 0.00 141 F 8.21 4.28 0.00 3.30 3.21 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 0.00 142 S 8.18 4.73 0.00 4.11 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 0.00 143 Y 8.33 4.36 0.00 3.36 3.11 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 *145 G 8.23 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 0.00 0.00 0.00 0.00 146 G 8.32 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 0.00 147 Q 8.99 4.64 0.00 2.15 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.95 0.00 0.00 0.00 0.00 0.00 2.48 2.37 0.00 148 I 8.51 4.48 1.94 0.00 0.00 1.00 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 1.00 0.96 0.00 0.00 149 L 9.09 4.29 0.00 1.86 1.94 0.90 1.21 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 0.00 150 H 7.80 4.80 0.00 3.27 3.10 0.00 5.86 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 Q 8.29 5.00 0.00 1.86 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.61 6.46 0.00 0.00 0.00 0.00 0.00 2.25 2.31 0.00 152 V 8.87 4.33 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.96 0.00 0.00 153 S 8.73 5.04 0.00 3.73 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 0.00 154 I 8.58 4.33 1.65 0.00 0.00 0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.53 0.54 0.00 0.00 155 T 8.17 5.02 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 1.27 0.00 0.00 156 N 8.68 4.68 0.00 2.75 2.94 0.00 0.00 6.94 8.90 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 0.00 157 S 8.08 4.62 0.00 3.96 3.82 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 0.00 0.00 0.00 158 L 8.67 4.04 0.00 1.67 1.77 0.93 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 159 K 7.39 4.24 0.00 1.77 1.73 0.00 1.80 0.00 0.00 1.63 0.00 0.00 2.94 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.38 1.36 7.81 160 D 8.61 4.63 0.00 2.70 2.60 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.17 4.43 1.86 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 1.33 0.74 0.91 0.00 0.00 162 A 8.40 3.91 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 0.00 163 E 8.17 3.89 0.00 1.96 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 0.00 2.37 2.36 0.00 164 A 7.91 4.14 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 Q 8.30 4.15 0.00 2.21 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 7.07 0.00 0.00 0.00 0.00 0.00 2.36 2.55 0.00 166 L 7.87 3.95 0.00 1.78 1.64 1.01 0.63 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 *168 E 8.26 4.33 0.00 2.08 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 2.16 2.36 0.00 169 A 7.77 3.88 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 0.00 170 T 7.82 3.78 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 171 Y 7.48 4.34 0.00 3.12 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 0.00 172 K 7.89 3.97 0.00 1.84 1.85 0.00 1.70 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.58 1.46 7.81 173 I 7.79 3.76 2.00 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 1.53 0.70 0.91 0.00 0.00 174 E 8.59 3.99 0.00 2.25 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 0.00 2.55 2.48 0.00 175 D 8.10 4.35 0.00 2.96 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 0.00 176 V 7.20 3.42 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 0.53 0.00 0.00 0.20 0.00 0.00 177 L 7.70 4.00 0.00 1.83 1.73 1.02 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 178 E 8.42 4.09 0.00 1.92 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 2.35 2.45 0.00 179 G 7.96 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 0.00 180 K 8.43 4.20 0.00 1.80 1.86 0.00 1.63 0.00 0.00 1.69 0.00 0.00 2.79 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.44 1.39 7.81 181 I 7.56 4.52 1.64 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.56 0.94 0.00 0.00 182 K 8.47 4.95 0.00 2.15 1.95 0.00 1.65 0.00 0.00 1.66 0.00 0.00 2.93 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.42 1.54 7.81 183 Y 8.99 4.38 0.00 2.50 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 184 K 8.93 4.52 0.00 1.58 1.54 0.00 1.75 0.00 0.00 1.73 0.00 0.00 3.02 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.35 1.60 7.81 185 T 8.46 3.97 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 1.02 0.00 0.00 186 T 7.83 4.58 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 187 D 8.50 4.35 0.00 2.85 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 188 Y 8.13 4.19 0.00 3.09 3.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 189 Q 7.99 3.88 0.00 2.26 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.58 0.00 0.00 0.00 0.00 0.00 2.65 2.62 0.00 190 E 8.41 3.95 0.00 1.98 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 2.44 2.46 0.00 191 R 8.46 3.94 0.00 2.01 1.97 0.00 3.20 0.00 0.00 3.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.83 0.00 192 A 7.83 3.95 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 193 Y 8.27 4.31 0.00 2.61 3.10 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 0.00 194 Q 8.30 3.80 0.00 2.12 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.58 0.00 0.00 0.00 0.00 0.00 2.73 2.61 0.00 195 T 8.03 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 1.17 0.00 0.00 196 L 8.01 3.70 0.00 1.86 1.26 0.92 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 0.00 197 K 7.74 3.30 0.00 1.70 1.79 0.00 1.64 0.00 0.00 1.80 0.00 0.00 3.24 0.00 0.00 2.64 0.00 0.00 0.00 0.00 1.53 1.82 7.81 198 L 7.22 3.90 0.00 1.63 1.61 0.87 0.90 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 0.00 199 I 7.16 3.57 1.56 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.70 0.43 0.00 0.00 200 L 7.39 2.64 0.00 1.02 1.37 0.30 -0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 201 E 7.57 3.62 0.00 2.01 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 2.16 2.14 0.00 202 N 7.55 4.56 0.00 2.70 2.82 0.00 0.00 7.09 7.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 203 Y 7.30 4.62 0.00 3.04 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 0.00 204 D 8.47 4.56 0.00 2.77 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 205 S 8.75 4.20 0.00 4.04 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 0.00 206 E 8.13 4.58 0.00 2.16 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 0.00 2.28 2.39 0.00 207 H 8.34 4.26 0.00 3.26 3.34 0.00 5.61 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 208 F 8.92 4.24 0.00 3.12 3.33 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 0.00 209 E 8.49 4.24 0.00 2.19 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 2.71 2.98 0.00 210 K 8.11 4.33 0.00 2.03 2.11 0.00 1.95 0.00 0.00 1.78 0.00 0.00 2.79 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.95 1.63 7.81 *212 Y 8.06 4.43 0.00 2.79 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 0.00 213 W 8.70 3.88 0.00 3.31 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 0.00 214 E 8.97 4.31 0.00 2.20 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 2.65 3.03 0.00 215 K 8.07 4.02 0.00 1.64 1.82 0.00 1.76 0.00 0.00 1.73 0.00 0.00 3.00 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.46 1.40 7.81 216 K 7.93 4.13 0.00 1.43 1.86 0.00 1.82 0.00 0.00 1.53 0.00 0.00 2.62 0.00 0.00 2.70 0.00 0.00 0.00 0.00 0.73 0.21 7.81 217 R 7.91 4.06 0.00 2.22 2.15 0.00 3.23 0.00 0.00 3.19 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.63 0.00 218 L 7.83 3.31 0.00 0.88 0.35 -0.57 -1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 219 F 8.19 4.72 0.00 3.20 3.11 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 0.00 220 E 7.98 4.57 0.00 2.08 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 2.49 2.35 0.00 221 A 7.92 5.04 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 0.00 222 N 8.87 4.74 0.00 2.92 2.94 0.00 0.00 6.76 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 223 S 7.40 4.54 0.00 4.27 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 224 L 8.20 3.04 0.00 0.73 1.49 0.07 0.38 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 0.00 225 E 8.42 4.12 0.00 2.17 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 2.55 2.55 0.00 226 E 8.17 3.94 0.00 2.11 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 2.34 2.34 0.00 227 W 8.11 4.13 0.00 3.32 3.24 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 0.00 228 Y 8.22 3.25 0.00 3.11 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 229 Y 7.74 3.68 0.00 3.02 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 0.00 230 V 7.98 3.66 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 0.76 0.00 0.00 0.93 0.00 0.00 231 E 7.60 3.94 0.00 1.16 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 1.98 2.11 0.00 232 N 6.82 4.02 0.00 1.65 2.03 0.00 0.00 7.03 7.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.