NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -1 A 4.3580 8.1233 123.5761 51.9724 20.6640 178.3567 0 H 3.9930 8.2845 118.1890 59.4523 28.4871 175.6795 1 M 4.0636 8.2541 119.8022 58.6255 32.5754 177.3079 2 N 4.4478 8.1776 116.7904 56.7363 39.2361 176.4460 3 D 4.3469 8.4663 120.5907 57.4008 40.9638 178.7765 4 I 3.7346 7.9532 120.2737 64.5405 37.1641 178.7885 5 K 4.2349 8.4796 119.3874 59.4754 31.8232 179.5721 6 Q 3.1956 8.2767 118.6391 58.5225 28.3289 178.5275 7 L 3.9458 7.7251 119.0940 57.8048 42.0563 179.2998 8 L 4.1455 8.0569 118.9319 57.5387 41.3530 179.3700 9 W 4.1014 8.2435 127.4259 60.2661 30.7714 177.0496 10 N 4.5535 8.1922 113.9342 52.7842 38.8557 175.6187 11 G 3.7455 7.1429 109.1904 46.9568 0.0000 172.3926 12 E 5.0353 8.2964 123.2342 54.6439 32.8549 173.9153 13 L 4.6486 8.7478 125.2607 52.7234 45.9085 175.2253 14 N 4.7922 8.3674 118.9921 52.7829 40.1888 174.2292 15 V 4.7252 9.0323 123.5498 60.9479 35.1048 173.7414 16 L 4.9063 9.3219 130.6593 53.7316 43.7395 174.9433 17 V 4.7227 9.1837 130.3730 62.0265 33.5509 175.0276 18 S 5.0726 8.7479 126.9260 57.3641 64.1070 169.5825 19 I 4.4236 8.7469 126.8512 58.7873 38.5577 175.4859 20 D 4.6128 8.5009 126.8311 53.5788 41.8329 175.3894 21 P 4.3673 0.0000 0.0000 65.9937 31.2911 178.3881 22 S 4.1486 7.6482 113.7811 61.1534 62.8272 175.5837 23 F 4.3025 8.4076 118.1894 58.9640 39.0047 175.2092 24 L 4.7106 7.6510 119.7761 53.1139 44.0515 175.4824 25 M 4.3955 8.2742 121.2364 55.2014 32.9401 178.5963 26 K 4.2610 8.6797 116.5000 55.0692 31.0654 176.3121 27 G 4.3695 8.2144 108.7109 46.8568 0.0000 177.5771 28 S 4.3865 8.3789 119.6988 57.9093 62.0592 177.1971 *31 E 4.4586 8.6410 111.1048 57.2043 31.7384 173.1502 32 I 4.3163 7.7611 115.0035 62.1421 39.1187 176.2920 33 A 4.3243 7.9130 121.5022 53.0106 20.3732 176.6378 34 V 4.6029 7.7125 114.0433 61.3166 33.6176 174.9167 35 L 4.6368 9.1850 128.8814 53.3627 43.9305 176.2503 36 R 5.0554 8.5072 121.3864 54.4921 32.4401 174.8884 37 I 4.6872 8.7938 117.2938 59.1183 41.8604 174.2457 38 R 4.8648 8.3710 121.6281 54.6429 31.6327 176.0076 39 V 3.8509 8.2799 124.3685 59.7300 34.3680 173.2086 40 P 4.4536 0.0000 0.0000 62.8140 31.5871 176.6802 41 R 3.7531 8.3221 120.9919 58.6551 30.7110 177.1220 42 E 3.9225 7.1642 120.3268 53.3240 28.0784 173.8712 43 T 2.5679 6.1919 115.0381 61.5523 70.8218 170.6375 44 Y 5.4248 7.9247 119.7642 55.9791 40.4462 176.9158 45 L 3.9397 9.0664 123.7610 58.2957 41.8821 180.1678 46 V 3.7681 8.0697 110.6549 63.8532 31.4988 177.7215 47 N 4.5431 8.4379 116.5606 55.2817 38.6309 175.8628 48 Y 4.2466 8.5462 115.6340 57.6824 38.2651 177.1585 49 M 3.6199 7.5639 122.2946 57.9109 31.9829 176.5596 50 P 4.3912 0.0000 0.0000 65.6669 31.5638 178.0589 51 L 3.9046 7.8362 118.1862 58.3356 41.9451 178.6642 52 I 3.5795 7.8219 119.7118 64.4745 36.8414 178.5412 53 W 4.4217 8.3668 118.4381 59.7552 28.9710 177.9998 54 N 4.5505 9.0114 118.7260 56.5481 38.3571 177.2900 55 K 4.3183 7.7932 126.9214 58.0237 32.4645 184.4891 56 I 4.1606 8.3272 121.2025 62.1091 35.0776 180.1165 *68 S 4.2478 8.9611 117.9667 59.6952 63.4773 172.5359 69 E 3.6556 8.5693 117.8063 56.3461 26.8555 174.0319 70 K 4.3387 7.0892 119.7597 54.5534 34.3201 174.8494 71 Y 4.7713 9.0065 124.5120 56.1891 41.0014 174.6794 72 F 5.5455 8.8675 119.9685 55.8720 43.4709 173.8514 73 W 5.2701 8.4811 118.1965 56.1492 32.0044 172.9140 74 F 5.4638 9.1430 118.1183 56.1240 41.4638 174.9439 75 E 5.4431 9.5642 120.0300 55.0695 34.2520 174.1210 76 H 4.9958 9.1459 122.3167 54.7260 32.9137 173.3427 77 N 4.1066 9.4796 123.9983 54.5479 35.9546 174.8995 78 K 3.9426 8.2229 112.2491 57.1539 30.3393 175.8528 79 T 4.6454 7.7513 116.8618 60.7497 70.2911 172.0875 80 P 5.0377 0.0000 0.0000 63.4527 32.0569 175.5331 81 I 4.6838 9.2569 125.7577 58.6637 39.2923 173.7043 82 P 4.5773 0.0000 0.0000 62.4300 31.5306 176.7414 83 W 4.5995 8.9482 121.6294 58.4114 28.7844 177.2210 84 N 3.6852 6.8858 115.9235 52.7765 36.2885 174.1537 85 Y 4.8361 8.0000 115.4358 55.4107 41.8684 174.4447 86 P 4.8410 0.0000 0.0000 63.1337 33.0876 177.3686 87 V 3.6844 8.7620 121.0649 66.6011 31.3823 178.8445 88 G 3.5793 8.3204 105.4313 47.6912 0.0000 175.9211 89 V 3.5766 7.5651 120.0205 65.7886 31.6001 177.9591 90 L 3.9033 8.0539 118.8294 57.5975 41.4379 179.3241 91 F 4.0165 8.4581 120.7856 61.4633 39.1655 176.8082 92 D 4.2333 8.2866 118.7583 57.1958 40.6648 178.1316 93 C 4.3082 7.8973 113.1636 59.4007 29.9963 175.1520 94 L 4.1685 7.6862 120.0241 56.4322 42.0907 176.5510 95 A 3.8896 7.5847 125.0096 50.7743 20.3897 176.1902 *104 S 4.2407 8.5818 110.2242 59.2068 63.7263 174.1086 105 F 4.4775 9.2514 132.4644 62.2570 39.3613 177.4588 106 E 3.7497 8.3562 114.4994 58.7053 29.4647 179.0703 107 N 4.7463 7.5815 113.8461 52.9759 38.9677 175.1870 108 Q 4.2175 7.6268 120.1801 55.0447 29.8581 175.8197 109 V 3.6499 8.2008 122.8925 62.6231 32.0863 175.7842 110 K 3.8956 8.4640 127.1386 57.8343 32.4468 176.0787 111 D 4.4818 8.7300 125.1693 55.3586 38.0802 174.1685 112 V 3.7334 7.9950 118.1090 62.5983 32.2577 174.5199 113 L 4.5486 8.5087 128.7901 53.7561 42.7879 175.3508 114 T 4.6594 8.4016 123.6382 62.3002 69.6205 173.9169 115 F 4.9570 8.3535 119.7252 56.0934 41.0629 172.7168 116 L 4.5863 8.8370 121.8834 53.2738 44.2581 174.8604 117 R 5.1679 8.5490 127.2656 54.9354 31.0407 174.8465 118 I 5.0593 8.7702 119.7195 59.4317 41.8031 173.8527 119 H 5.3224 9.3999 119.8373 53.9627 31.8584 172.6506 120 L 4.3195 8.9070 126.0659 54.0645 43.1594 175.4636 121 V 4.4722 8.4329 126.8147 61.0557 34.6787 173.9990 122 M 4.9001 8.0625 121.8184 53.6679 34.0509 174.4462 123 G 4.3306 8.6489 106.9148 45.8250 0.0000 173.5845 124 D 4.8454 8.9282 119.0022 55.1193 41.3521 176.6119 125 S 4.5154 7.8303 112.5397 56.1653 65.6929 172.1490 126 L 4.1360 7.5642 126.6540 51.7676 43.2620 174.4453 127 P 4.0208 0.0000 0.0000 62.0998 31.4821 175.5969 128 P 4.2184 0.0000 0.0000 65.7045 31.3463 177.5686 129 T 4.0315 7.6792 107.8565 62.9508 69.0730 173.9559 130 I 4.6283 6.9370 113.8258 58.6490 40.6806 174.9739 131 I 4.0750 7.8471 115.0196 59.4144 38.5392 173.9996 132 P 4.7581 0.0000 0.0000 63.1552 31.9140 176.7732 133 I 4.2355 7.7640 120.8502 59.2442 35.8942 175.8828 134 A 4.3921 8.7717 128.0453 51.6397 19.1871 178.3555 135 S 4.2386 8.8758 116.8368 62.0016 63.2727 176.4319 136 S 4.2367 8.1160 118.3788 58.8105 62.4124 176.0961 137 K 4.6166 8.5780 123.5968 54.7323 31.7566 177.5609 138 T 4.5361 7.5938 113.6025 63.0123 68.4050 175.5481 139 Q 3.9805 8.1231 121.0582 59.7099 29.1102 177.5769 140 A 4.2379 8.0077 120.9732 55.4712 18.3484 178.8113 141 E 2.0000 7.6436 116.7580 58.9758 29.5509 179.1424 142 K 4.1933 8.0303 118.2921 59.4034 32.1119 179.2309 143 F 4.2499 8.6991 121.1568 60.9177 39.3638 176.8561 144 W 4.4397 9.0728 128.4681 60.8925 30.5815 177.9299 145 F 4.0394 8.6859 117.8229 60.8460 38.3302 177.2026 146 H 4.1180 8.2918 117.7265 58.9231 29.4814 177.4378 147 Q 3.8549 7.7757 120.0915 58.8151 28.5413 178.7965 148 W 3.7468 7.7627 119.8556 59.4172 29.0613 178.5040 149 K 3.9788 8.3008 119.7651 59.4317 31.6084 178.6971 150 Q 3.9345 7.9802 119.8974 59.0724 29.0466 178.3045 151 V 3.1370 7.6412 119.4496 66.1833 31.4344 177.6747 152 C 4.2455 8.7876 116.7620 62.8232 27.9340 176.0086 153 F 4.2213 8.2198 121.9772 61.4602 38.6291 177.3426 154 I 3.6350 7.8294 119.4388 64.1792 36.8572 178.4742 155 L 3.9915 8.4451 120.1495 57.2898 41.4147 178.5788 156 N 4.5820 8.3749 114.9816 54.2055 39.5980 175.9580 157 G 3.7657 7.7009 106.0936 45.4184 0.0000 173.3644 158 S 4.9061 7.4000 112.3211 56.6011 65.7052 174.6355 159 S 4.6835 8.7479 114.9969 58.3908 62.9274 175.4455 160 K 3.7829 7.6693 124.0672 60.2106 31.5661 178.0622 161 A 3.9543 8.0500 119.0303 55.2831 18.2259 178.7236 162 I 3.9958 7.6620 115.8551 63.5904 38.2420 176.6575 163 M 4.5902 7.8518 116.9517 55.2165 31.9085 176.6137 164 S 4.6487 7.4579 112.6035 57.9127 63.5622 174.1334 165 L 4.4829 7.1520 119.8122 53.9907 42.7862 177.2238 166 S 4.5141 9.5150 119.8699 58.5978 65.3712 176.5464 167 V 3.7626 8.3405 124.2703 66.4613 31.1615 177.8307 168 N 4.6125 8.0540 118.4671 57.8550 37.8126 179.9759 169 E 4.0158 8.1975 121.2076 59.3997 29.5698 179.7422 170 A 4.4435 8.1953 122.4108 56.1664 18.4945 180.5296 171 R 4.2680 8.0873 118.7365 61.6615 29.5302 180.8941 172 K 4.2942 9.2283 120.9081 59.1597 31.9297 178.8662 173 F 4.6428 8.3337 120.4550 61.4221 39.7877 176.7476 174 W 3.6797 8.8419 128.1579 60.0869 30.4240 178.1197 175 G 3.6846 8.7826 106.4806 47.7398 0.0000 175.7565 176 S 4.2362 8.1100 115.9795 61.2509 62.7190 176.8837 177 V 3.3612 7.1405 121.1730 65.7249 31.2041 177.3064 178 I 3.4578 6.8749 117.9827 64.2308 37.0098 177.0966 179 T 4.1422 7.8030 107.4233 61.2548 69.2286 174.6521 180 R 4.0111 7.9609 120.4465 57.9356 27.7355 177.2385 181 N 4.7285 8.2952 117.4613 52.4727 38.6829 173.5171 182 F 3.0685 8.6556 129.9353 60.8405 39.5734 176.3291 183 Q 3.7678 8.1085 116.9752 59.2454 28.6127 178.6408 184 D 4.3141 8.4320 119.6001 57.2568 40.7787 178.7507 185 F 4.1353 7.8180 120.8876 61.2904 39.3884 177.1800 186 I 3.4570 7.3763 119.4243 64.2047 36.8199 177.7962 187 E 3.7250 7.9062 119.8940 59.5112 29.5782 179.0550 188 I 3.3094 7.4682 119.7447 64.0865 36.8504 178.6341 189 S 3.2914 7.1213 114.0511 61.1818 62.9379 176.1094 190 N 4.3972 7.8700 120.0161 55.8839 38.1160 177.2435 191 K 3.8233 7.6233 120.1907 58.8158 32.2742 177.8201 192 I 4.0783 7.0518 110.2337 60.3609 38.5613 175.9851 193 S 4.6123 7.1362 119.2122 58.4050 63.8364 174.6645 194 S 4.4973 8.5879 122.3574 58.2183 63.1349 175.5052 195 S 4.3087 8.9679 123.5928 60.7101 62.2197 174.4223 196 R 4.3317 7.5481 120.9065 52.8160 30.9639 174.7287 197 P 4.7041 0.0000 0.0000 61.8774 32.2333 177.3493 198 R 3.9418 8.7177 120.8496 59.2769 30.1989 176.2478 199 H 5.1812 7.5144 110.2526 54.1255 33.2373 172.7009 200 I 3.9324 7.8837 120.4175 59.1666 38.6987 175.8109 201 P 4.5499 0.0000 0.0000 61.9133 29.8100 173.1633 202 L 5.1344 8.0535 124.4141 53.0504 44.9674 174.4000 203 I 4.9617 8.6617 126.7798 59.5703 40.5038 174.3058 204 I 4.8897 9.2388 128.7368 59.7168 39.4230 174.7940 205 Q 4.9695 9.5022 126.0516 54.1751 32.0759 175.0454 206 T 4.6212 7.8433 117.4343 61.6909 65.5579 175.2382 207 S 3.4143 7.8532 120.6759 59.7706 62.6154 172.5408 208 R 4.0401 8.1785 118.0194 57.7707 29.5611 173.8945 *213 F 4.6573 8.0810 120.6361 57.7552 40.8690 177.5630 214 R 4.2508 7.5182 111.6778 56.7577 32.0489 173.5319 215 I 4.7128 8.2996 127.0791 60.1994 39.9955 175.2744 216 S 4.5084 8.4542 116.6591 57.0768 66.0006 174.0468 217 Q 5.2590 8.0669 125.7228 52.5433 28.7225 172.6598 218 P 4.3256 0.0000 0.0000 63.0881 32.5011 176.6911 219 T 4.3894 8.2696 110.8120 60.7555 69.9331 174.3032 220 I 4.3888 8.1688 128.6407 59.3397 39.1465 175.2648 221 S 4.4947 8.6824 122.3599 58.3085 63.1384 173.7239 222 M 4.5327 9.5079 124.3269 55.0423 33.5050 175.9785 223 T 3.8515 7.3573 115.9107 64.7976 68.6271 174.0159 224 G 3.9159 9.0202 114.0104 46.1236 0.0000 172.6443 225 V 4.5040 7.5152 111.3823 60.2666 36.2560 175.3977 226 N 5.0210 8.1465 117.0649 51.6158 39.1531 171.8479 227 P 4.4959 0.0000 0.0000 62.9045 32.7695 176.0524 228 T 4.8403 8.4896 115.7141 60.0167 69.4594 175.4114 229 L 4.1250 8.6740 126.8981 58.0127 42.3724 179.3257 230 K 4.1579 8.5626 119.9062 59.2780 32.3936 178.5176 231 D 4.4551 7.9850 118.2952 56.3616 40.9757 176.9174 232 I 4.6007 7.5550 113.0712 60.2393 37.6174 177.3897 233 E 4.2222 8.1077 121.7710 59.8158 29.4535 178.3656 234 G 3.8945 8.0819 106.8353 46.7114 0.0000 173.4775 235 D 4.9920 8.0621 118.5929 54.6156 44.5294 176.7828 236 I 4.3057 7.3992 121.3879 62.4189 36.4838 178.4410 *247 D 4.8426 9.3888 135.0000 55.0749 42.9526 179.5333 248 V 4.8862 9.2500 110.8057 60.6561 36.0633 175.8412 249 M 4.6928 9.0239 121.5852 54.1209 34.8825 174.7980 250 V 4.0716 8.0701 125.9012 62.0057 33.0481 174.2082 251 I 4.8779 8.5603 129.6507 59.8221 39.7219 174.5720 252 C 4.7937 8.8235 126.5278 58.3925 35.1630 173.9074 253 Q 3.5994 9.8794 124.9178 57.1670 25.9377 174.7219 254 G 4.0112 8.8077 103.3199 46.4680 0.0000 173.6900 255 I 4.6344 7.4539 112.4926 58.2231 40.6532 174.0202 256 E 4.5091 8.5647 122.1718 56.1826 30.2225 175.5707 257 I 4.4954 8.1037 127.4664 58.6394 39.6619 173.9415 258 P 4.3582 0.0000 0.0000 62.2023 32.0163 177.8270 259 W 4.1031 9.0818 123.5282 59.7840 29.2499 177.2148 260 H 4.7159 8.1522 111.4318 55.7595 28.6788 175.0227 261 M 4.2507 7.7898 121.2221 55.2767 32.8619 175.3181 262 L 4.6643 8.3196 124.8246 54.1519 43.6015 177.9205 263 L 3.9817 8.8569 125.9821 58.6290 42.0732 178.8498 264 Y 4.2437 8.1311 118.8288 60.7860 38.7296 177.5833 265 D 4.1584 8.1392 119.2173 57.2329 41.0402 178.0283 266 L 3.8774 8.0725 120.9155 58.4955 42.0670 178.3610 267 Y 3.9292 8.1995 119.2244 61.0183 38.5704 178.3663 268 S 3.9458 7.8824 114.5612 60.7942 62.8347 176.0470 269 K 4.3473 7.7282 119.6970 57.3232 32.8504 177.3893 270 L 4.6315 8.0161 115.9801 53.9969 42.1597 176.9210 271 R 4.0113 7.3071 115.4685 56.3720 29.8271 176.6920 272 S 5.1489 9.7611 116.8553 56.8578 63.9061 175.4699 273 F 5.1304 9.6813 117.2959 59.4291 37.4165 175.7617 274 D 4.3932 8.0040 119.4924 53.0602 39.7085 177.1435 275 G 2.7030 8.4184 109.6468 44.6031 0.0000 173.7224 276 F 4.6949 8.2017 118.3317 56.2055 41.5221 174.4256 277 L 5.1036 8.7310 123.1041 53.8093 43.8372 174.5770 278 Y 5.2678 8.8830 123.7587 56.3927 40.4033 175.1734 279 I 4.8567 8.9356 123.8407 59.7990 41.2335 174.5044 280 T 5.0394 8.8636 122.6508 61.7759 71.4927 172.9285 281 L 4.9326 8.6606 127.1624 53.8638 43.0511 176.8324 282 V 4.5292 8.4952 116.2706 58.8489 35.8670 173.6397 283 P 4.5900 0.0000 0.0000 63.8617 32.4124 177.2262 284 I 3.6051 7.6300 117.9812 60.6108 35.9734 174.4309 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 -1 A 8.12 4.36 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 0 H 8.28 3.99 0.00 3.30 3.37 0.00 5.63 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1 M 8.25 4.06 0.00 2.12 2.10 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.65 0.00 2 N 8.18 4.45 0.00 2.87 3.02 0.00 0.00 7.21 8.49 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 3 D 8.47 4.35 0.00 3.00 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 4 I 7.95 3.73 2.07 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 1.55 1.03 0.94 0.00 0.00 5 K 8.48 4.23 0.00 2.16 2.27 0.00 1.77 0.00 0.00 1.78 0.00 0.00 3.04 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.63 1.70 7.81 6 Q 8.28 3.20 0.00 2.15 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.80 0.00 0.00 0.00 0.00 0.00 1.16 2.21 0.00 7 L 7.73 3.95 0.00 1.91 1.72 0.88 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 8 L 8.06 4.15 0.00 2.01 1.81 1.05 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 9 W 8.24 4.10 0.00 3.57 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 10 N 8.19 4.55 0.00 2.72 2.75 0.00 0.00 6.99 7.25 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 11 G 7.14 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 12 E 8.30 5.04 0.00 1.90 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 1.99 2.10 0.00 13 L 8.75 4.65 0.00 1.23 1.12 0.42 -0.34 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 14 N 8.37 4.79 0.00 2.83 2.71 0.00 0.00 6.34 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 15 V 9.03 4.73 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 1.00 0.00 0.00 0.78 0.00 0.00 16 L 9.32 4.91 0.00 1.91 1.75 0.92 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 17 V 9.18 4.72 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 0.89 0.00 0.00 0.88 0.00 0.00 18 S 8.75 5.07 0.00 3.46 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 19 I 8.75 4.42 1.85 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 1.31 0.77 0.00 0.00 20 D 8.50 4.61 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 21 P 0.00 4.37 0.00 2.29 2.35 0.00 3.83 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.04 0.00 22 S 7.65 4.15 0.00 3.89 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 23 F 8.41 4.30 0.00 3.18 3.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 L 7.65 4.71 0.00 1.69 1.67 0.97 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 25 M 8.27 4.40 0.00 2.09 2.00 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 2.68 2.54 0.00 26 K 8.68 4.26 0.00 1.77 1.69 0.00 1.86 0.00 0.00 1.71 0.00 0.00 2.94 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.36 1.01 7.81 27 G 8.21 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 0.00 0.00 0.00 0.00 28 S 8.38 4.39 0.00 3.64 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 *31 E 8.64 4.46 0.00 2.01 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 0.00 2.13 1.91 0.00 32 I 7.76 4.32 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 1.35 1.33 0.94 0.00 0.00 33 A 7.91 4.32 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 34 V 7.71 4.60 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 0.83 0.00 0.00 0.92 0.00 0.00 35 L 9.18 4.64 0.00 1.54 1.51 0.85 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 36 R 8.51 5.06 0.00 1.59 1.77 0.00 3.06 0.00 0.00 3.21 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.53 0.00 37 I 8.79 4.69 1.80 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 1.28 0.76 0.87 0.00 0.00 38 R 8.37 4.86 0.00 1.60 1.89 0.00 3.34 0.00 0.00 3.16 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.46 0.00 39 V 8.28 3.85 1.69 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 0.31 0.00 0.00 0.41 0.00 0.00 40 P 0.00 4.45 0.00 1.63 1.66 0.00 3.09 0.00 0.00 3.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.77 0.00 41 R 8.32 3.75 0.00 1.63 1.90 0.00 2.99 0.00 0.00 3.10 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.40 0.00 42 E 7.16 3.92 0.00 1.35 1.46 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 0.00 2.22 2.26 0.00 43 T 6.19 2.57 3.64 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 1.03 0.00 0.00 44 Y 7.92 5.42 0.00 3.39 3.13 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 0.00 0.00 0.00 0.00 45 L 9.07 3.94 0.00 1.78 1.46 0.48 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 46 V 8.07 3.77 1.73 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 0.25 0.00 0.00 0.44 0.00 0.00 47 N 8.44 4.54 0.00 3.07 2.69 0.00 0.00 6.84 8.08 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 48 Y 8.55 4.25 0.00 3.03 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 49 M 7.56 3.62 0.00 1.30 2.05 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.61 0.00 50 P 0.00 4.39 0.00 2.10 2.14 0.00 3.59 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.24 0.00 51 L 7.84 3.90 0.00 1.65 1.90 1.05 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 52 I 7.82 3.58 1.60 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 1.43 0.59 0.55 0.00 0.00 53 W 8.37 4.42 0.00 3.46 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 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0.00 0.00 0.00 0.00 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 F 9.14 5.46 0.00 3.25 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 75 E 9.56 5.44 0.00 1.97 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 2.68 2.40 0.00 76 H 9.15 5.00 0.00 3.18 3.14 0.00 5.73 0.00 0.00 0.00 0.00 6.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 N 9.48 4.11 0.00 2.81 2.82 0.00 0.00 7.19 7.61 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 78 K 8.22 3.94 0.00 1.93 1.97 0.00 1.72 0.00 0.00 1.73 0.00 0.00 3.13 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.31 1.39 7.81 79 T 7.75 4.65 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 1.24 0.00 0.00 80 P 0.00 5.04 0.00 1.90 1.88 0.00 3.66 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 2.41 0.00 81 I 9.26 4.68 2.21 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 1.66 0.98 0.99 0.00 0.00 82 P 0.00 4.58 0.00 2.23 2.10 0.00 3.76 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 2.00 1.86 0.00 83 W 8.95 4.60 0.00 3.71 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 84 N 6.89 3.69 0.00 1.44 1.42 0.00 0.00 5.83 7.55 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 85 Y 8.00 4.84 0.00 2.93 2.78 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 86 P 0.00 4.84 0.00 2.40 2.68 0.00 3.64 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 2.19 0.00 87 V 8.76 3.68 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 0.92 0.00 0.00 0.88 0.00 0.00 88 G 8.32 3.58 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 0.00 0.00 0.00 89 V 7.57 3.58 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 0.71 0.00 0.00 0.51 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 115 F 8.35 4.96 0.00 3.13 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 L 8.84 4.59 0.00 1.91 1.53 0.95 0.96 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 0.00 117 R 8.55 5.17 0.00 1.85 1.80 0.00 3.27 0.00 0.00 3.38 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.74 0.00 118 I 8.77 5.06 1.98 0.00 0.00 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.71 0.92 0.00 0.00 119 H 9.40 5.32 0.00 3.19 3.24 0.00 5.60 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 0.00 120 L 8.91 4.32 0.00 1.58 1.29 0.24 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 121 V 8.43 4.47 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 0.00 0.00 0.34 0.00 0.00 0.88 0.00 0.00 122 M 8.06 4.90 0.00 1.62 1.65 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.21 0.00 123 G 8.65 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 D 8.93 4.85 0.00 2.74 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 0.00 125 S 7.83 4.52 0.00 3.74 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 0.00 126 L 7.56 4.14 0.00 1.00 1.03 0.95 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 127 P 0.00 4.02 0.00 1.86 1.68 0.00 2.20 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.44 0.00 128 P 0.00 4.22 0.00 2.11 2.12 0.00 3.59 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.86 0.00 129 T 7.68 4.03 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 0.00 130 I 6.94 4.63 1.87 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 1.16 0.63 0.93 0.00 0.00 131 I 7.85 4.07 1.81 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.52 0.72 0.00 0.00 132 P 0.00 4.76 0.00 2.48 2.31 0.00 3.84 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.13 0.00 133 I 7.76 4.24 2.22 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 0.87 0.90 0.83 0.00 0.00 134 A 8.77 4.39 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 0.00 135 S 8.88 4.24 0.00 3.99 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 0.00 136 S 8.12 4.24 0.00 3.65 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 0.00 137 K 8.58 4.62 0.00 1.76 1.70 0.00 1.73 0.00 0.00 1.63 0.00 0.00 2.87 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.30 0.98 7.81 138 T 7.59 4.54 4.29 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 1.26 0.00 0.00 139 Q 8.12 3.98 0.00 2.22 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.61 0.00 0.00 0.00 0.00 0.00 2.65 2.65 0.00 140 A 8.01 4.24 1.57 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 0.00 0.00 0.00 0.00 0.00 0.00 141 E 7.64 2.00 0.00 1.16 1.66 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 2.47 2.21 0.00 142 K 8.03 4.19 0.00 2.14 1.99 0.00 1.77 0.00 0.00 1.64 0.00 0.00 2.97 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.56 1.54 7.81 143 F 8.70 4.25 0.00 3.31 3.46 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 0.00 0.00 0.00 0.00 144 W 9.07 4.44 0.00 3.96 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 0.00 145 F 8.69 4.04 0.00 3.32 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 0.00 146 H 8.29 4.12 0.00 3.39 3.20 0.00 5.59 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 Q 7.78 3.85 0.00 2.10 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.57 0.00 0.00 0.00 0.00 0.00 1.58 2.38 0.00 148 W 7.76 3.75 0.00 3.21 3.14 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 0.00 149 K 8.30 3.98 0.00 1.92 1.87 0.00 1.57 0.00 0.00 1.38 0.00 0.00 2.77 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.33 1.43 7.81 150 Q 7.98 3.93 0.00 2.51 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.58 0.00 0.00 0.00 0.00 0.00 2.46 2.48 0.00 151 V 7.64 3.14 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 0.56 0.00 0.00 -0.30 0.00 0.00 152 C 8.79 4.25 0.00 3.21 3.18 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 0.00 153 F 8.22 4.22 0.00 3.27 3.23 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 0.00 154 I 7.83 3.63 1.86 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 1.55 1.25 0.86 0.00 0.00 155 L 8.45 3.99 0.00 1.63 1.69 1.09 0.39 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 0.00 156 N 8.37 4.58 0.00 2.85 2.83 0.00 0.00 7.27 7.99 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 0.00 157 G 7.70 3.77 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 0.00 0.00 0.00 158 S 7.40 4.91 0.00 4.05 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 0.00 159 S 8.75 4.68 0.00 4.10 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 0.00 160 K 7.67 3.78 0.00 1.92 1.89 0.00 1.65 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.44 1.49 7.81 161 A 8.05 3.95 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 0.00 162 I 7.66 4.00 1.96 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.48 1.08 0.00 0.00 163 M 7.85 4.59 0.00 2.02 2.06 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.50 0.00 164 S 7.46 4.65 0.00 3.88 4.05 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 0.00 165 L 7.15 4.48 0.00 1.69 1.68 0.83 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 166 S 9.52 4.51 0.00 4.01 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 167 V 8.34 3.76 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 0.80 0.00 0.00 0.93 0.00 0.00 168 N 8.05 4.61 0.00 2.72 2.84 0.00 0.00 6.90 7.66 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 0.00 169 E 8.20 4.02 0.00 2.17 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 0.00 2.31 2.35 0.00 170 A 8.20 4.44 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 0.00 171 R 8.09 4.27 0.00 1.87 1.96 0.00 3.27 0.00 0.00 3.09 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.51 0.00 172 K 9.23 4.29 0.00 1.87 2.19 0.00 1.64 0.00 0.00 1.60 0.00 0.00 2.90 0.00 0.00 3.36 0.00 0.00 0.00 0.00 1.53 1.64 7.81 173 F 8.33 4.64 0.00 3.31 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 0.00 174 W 8.84 3.68 0.00 3.44 3.36 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 0.00 175 G 8.78 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 0.00 176 S 8.11 4.24 0.00 4.52 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 0.00 177 V 7.14 3.36 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 0.02 0.00 0.00 0.56 0.00 0.00 178 I 6.87 3.46 1.75 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 0.62 0.73 0.00 0.00 179 T 7.80 4.14 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 0.00 180 R 7.96 4.01 0.00 2.06 2.16 0.00 3.16 0.00 0.00 2.84 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.53 0.00 181 N 8.30 4.73 0.00 2.84 2.83 0.00 0.00 6.69 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 0.00 182 F 8.66 3.07 0.00 2.75 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 183 Q 8.11 3.77 0.00 2.33 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.68 0.00 0.00 0.00 0.00 0.00 2.46 2.52 0.00 184 D 8.43 4.31 0.00 2.77 2.78 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 0.00 185 F 7.82 4.14 0.00 2.82 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 186 I 7.38 3.46 1.54 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.16 -0.36 0.74 0.00 0.00 187 E 7.91 3.72 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 2.17 2.25 0.00 188 I 7.47 3.31 0.88 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.96 -0.15 0.00 0.00 189 S 7.12 3.29 0.00 3.77 3.23 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 0.00 190 N 7.87 4.40 0.00 2.90 2.82 0.00 0.00 6.60 6.76 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 0.00 191 K 7.62 3.82 0.00 1.69 1.77 0.00 1.66 0.00 0.00 1.59 0.00 0.00 2.98 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.33 1.35 7.81 192 I 7.05 4.08 1.75 0.00 0.00 0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.54 0.73 0.00 0.00 193 S 7.14 4.61 0.00 3.97 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 194 S 8.59 4.50 0.00 3.63 3.64 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 0.00 195 S 8.97 4.31 0.00 3.62 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 0.00 196 R 7.55 4.33 0.00 1.76 1.73 0.00 3.24 0.00 0.00 3.28 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.14 0.00 197 P 0.00 4.70 0.00 2.26 2.08 0.00 3.42 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 1.95 2.24 0.00 198 R 8.72 3.94 0.00 1.88 1.92 0.00 3.15 0.00 0.00 3.09 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.65 0.00 199 H 7.51 5.18 0.00 3.02 3.18 0.00 5.82 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 200 I 7.88 3.93 1.81 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 1.22 0.03 0.84 0.00 0.00 201 P 0.00 4.55 0.00 1.74 1.38 0.00 2.51 0.00 0.00 3.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.75 0.00 202 L 8.05 5.13 0.00 1.78 1.52 1.02 0.83 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 0.00 203 I 8.66 4.96 1.51 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.29 1.05 0.00 0.00 204 I 9.24 4.89 1.91 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 1.20 0.95 0.00 0.00 205 Q 9.50 4.97 0.00 1.93 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.89 0.00 0.00 0.00 0.00 0.00 2.24 2.35 0.00 206 T 7.84 4.62 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 207 S 7.85 3.41 0.00 3.96 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 0.00 208 R 8.18 4.04 0.00 1.88 1.80 0.00 3.24 0.00 0.00 4.01 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.22 0.00 *213 F 8.08 4.66 0.00 2.08 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 214 R 7.52 4.25 0.00 1.81 1.78 0.00 3.12 0.00 0.00 3.34 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.57 0.00 215 I 8.30 4.71 1.90 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 1.19 0.72 0.99 0.00 0.00 216 S 8.45 4.51 0.00 3.92 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 0.00 217 Q 8.07 5.26 0.00 1.98 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.76 0.00 0.00 0.00 0.00 0.00 2.26 2.51 0.00 218 P 0.00 4.33 0.00 2.11 2.01 0.00 3.74 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.11 0.00 219 T 8.27 4.39 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 1.20 0.00 0.00 220 I 8.17 4.39 1.88 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 1.26 1.11 0.93 0.00 0.00 221 S 8.68 4.49 0.00 3.83 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 0.00 222 M 9.51 4.53 0.00 1.80 2.27 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.55 0.00 223 T 7.36 3.85 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 1.16 0.00 0.00 224 G 9.02 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 0.00 0.00 0.00 225 V 7.52 4.50 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 0.65 0.00 0.00 0.94 0.00 0.00 226 N 8.15 5.02 0.00 2.62 2.69 0.00 0.00 6.95 7.69 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 0.00 227 P 0.00 4.50 0.00 2.27 2.00 0.00 3.66 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.10 0.00 228 T 8.49 4.84 4.51 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 1.45 0.00 0.00 229 L 8.67 4.13 0.00 2.04 2.01 0.93 0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 230 K 8.56 4.16 0.00 2.19 1.89 0.00 1.68 0.00 0.00 1.56 0.00 0.00 2.81 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.18 1.51 7.81 231 D 7.99 4.46 0.00 3.01 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 0.00 232 I 7.56 4.60 1.94 0.00 0.00 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 1.64 1.02 0.96 0.00 0.00 233 E 8.11 4.22 0.00 1.95 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 2.51 2.18 0.00 234 G 8.08 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 0.00 235 D 8.06 4.99 0.00 2.80 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 0.00 236 I 7.40 4.31 2.14 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 1.26 0.83 1.04 0.00 0.00 *247 D 9.39 4.84 0.00 2.39 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 0.00 0.00 0.00 0.00 248 V 9.25 4.89 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 0.93 0.00 0.00 249 M 9.02 4.69 0.00 2.16 1.95 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.42 0.00 250 V 8.07 4.07 1.56 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 0.75 0.00 0.00 -0.02 0.00 0.00 251 I 8.56 4.88 1.94 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 1.08 0.83 0.90 0.00 0.00 252 C 8.82 4.79 0.00 2.91 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 0.00 253 Q 9.88 3.60 0.00 2.24 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.84 0.00 0.00 0.00 0.00 0.00 2.38 2.33 0.00 254 G 8.81 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 0.00 0.00 0.00 255 I 7.45 4.63 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 1.32 0.85 0.91 0.00 0.00 256 E 8.56 4.51 0.00 1.99 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 2.31 0.00 257 I 8.10 4.50 1.67 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 1.15 0.97 0.79 0.00 0.00 258 P 0.00 4.36 0.00 1.82 1.85 0.00 3.51 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 2.05 2.09 0.00 259 W 9.08 4.10 0.00 3.47 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 0.00 260 H 8.15 4.72 0.00 3.30 3.50 0.00 5.72 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 0.00 261 M 7.79 4.25 0.00 2.07 1.95 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 2.58 2.51 0.00 262 L 8.32 4.66 0.00 1.81 1.67 1.11 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 263 L 8.86 3.98 0.00 1.91 1.76 0.97 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 264 Y 8.13 4.24 0.00 3.14 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 0.00 265 D 8.14 4.16 0.00 2.88 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 0.00 266 L 8.07 3.88 0.00 1.92 1.83 0.92 1.15 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 0.00 267 Y 8.20 3.93 0.00 3.15 3.08 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 0.00 268 S 7.88 3.95 0.00 3.64 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 0.00 269 K 7.73 4.35 0.00 1.78 1.85 0.00 1.65 0.00 0.00 1.70 0.00 0.00 3.03 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.39 1.40 7.81 270 L 8.02 4.63 0.00 1.65 1.70 0.92 1.05 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 0.00 271 R 7.31 4.01 0.00 1.76 1.24 0.00 2.86 0.00 0.00 2.25 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.63 0.00 272 S 9.76 5.15 0.00 4.50 4.29 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 0.00 273 F 9.68 5.13 0.00 3.34 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 0.00 274 D 8.00 4.39 0.00 2.71 2.46 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 0.00 0.00 0.00 0.00 275 G 8.42 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 0.00 0.00 0.00 276 F 8.20 4.69 0.00 2.86 2.33 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 0.00 277 L 8.73 5.10 0.00 2.03 1.65 1.03 0.92 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 0.00 278 Y 8.88 5.27 0.00 2.92 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 279 I 8.94 4.86 1.90 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 1.26 1.12 0.87 0.00 0.00 280 T 8.86 5.04 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 281 L 8.66 4.93 0.00 1.53 1.63 0.94 0.79 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 0.00 282 V 8.50 4.53 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 0.71 0.00 0.00 0.99 0.00 0.00 283 P 0.00 4.59 0.00 1.94 2.00 0.00 3.80 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.11 0.00 284 I 7.63 3.61 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 1.16 0.50 0.91 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.