NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 C 4.5339 8.1876 120.8975 58.2171 33.7579 173.1369 2 S 4.7205 8.2660 122.7024 56.1720 64.4149 172.6316 3 L 4.6815 9.4464 128.0747 53.7657 42.4421 177.0448 4 I 4.6320 8.1263 124.1486 58.6674 40.5052 173.4642 5 P 4.3795 0.0000 0.0000 62.0862 31.8131 176.0793 6 D 4.3480 8.5574 121.9751 53.3918 39.6697 175.3986 7 Y 4.1887 8.7047 124.8263 57.7191 38.5602 175.1596 8 Q 4.0447 8.2640 126.9976 53.9174 28.7436 175.0870 9 R 3.5890 7.2754 124.3302 55.0605 30.4592 174.6834 10 P 4.5131 0.0000 0.0000 61.9651 32.2170 175.7506 11 E 4.0827 8.3941 119.0556 55.8024 29.7427 177.0622 12 A 4.0504 8.4672 125.7224 51.7892 18.5527 176.8419 13 P 4.0184 0.0000 0.0000 64.6861 31.7787 177.4810 14 V 3.5880 6.7193 111.0354 59.6801 32.3973 175.9010 15 A 3.9756 7.3870 124.1303 52.0075 18.9500 177.8616 16 A 3.9845 8.7154 123.3159 54.7813 18.5556 178.1400 17 A 4.6480 7.4512 115.7930 50.1315 21.2891 176.0431 18 Y 4.3071 7.7894 116.8804 57.0909 38.6096 174.5817 19 P 4.2663 0.0000 0.0000 62.7764 31.7315 175.4764 20 Q 4.6113 9.0686 117.9792 53.9719 32.4126 175.2434 21 G 4.2582 8.9536 104.5690 43.6638 0.0000 173.8565 22 Q 3.8226 8.5362 118.4301 58.6037 28.6525 178.1268 23 A 4.3749 7.7519 118.2349 51.5717 19.4168 175.1722 24 Y 4.7805 7.9645 115.2427 55.9606 40.7829 176.1698 25 G 3.9203 8.8133 113.3540 45.5126 0.0000 173.0211 26 Q 4.4827 8.3013 118.3800 55.0426 29.3755 176.4355 27 N 4.6441 8.5362 117.4572 53.5223 39.3044 176.0745 28 T 3.9705 8.5496 119.4010 64.6509 69.2191 175.8693 29 G 3.7436 8.0398 107.3919 44.2390 0.0000 172.2778 30 A 4.1227 8.3257 121.3399 51.8148 19.1641 177.0171 31 A 4.4852 8.3285 124.2003 50.4294 20.0140 176.7757 32 A 3.9262 8.6099 127.3735 54.5203 18.6274 177.9330 33 V 4.2221 7.3453 121.2632 58.7154 32.2020 173.9826 34 P 4.4277 0.0000 0.0000 62.1125 32.2674 177.2506 35 A 3.9205 8.7881 121.6292 55.5221 18.1880 179.6949 36 A 4.2160 7.8653 114.9540 53.5258 18.6791 177.5253 37 D 4.7696 8.0649 115.3268 54.5892 41.9674 176.7924 38 I 4.1890 7.6810 121.1360 60.7570 37.8610 176.1789 39 G 4.2647 8.5764 114.1981 44.9342 0.0000 174.4538 40 W 4.6628 8.7693 119.0433 58.1916 28.3144 177.5357 41 R 4.0624 7.2743 117.1085 57.0370 30.0794 176.4307 42 E 4.3940 8.3232 118.4750 57.5719 31.3521 176.5761 43 F 4.1838 8.1785 120.6540 60.8662 40.6472 174.5526 44 F 4.8087 7.5957 120.0475 55.9861 39.0820 177.1343 45 R 3.9932 8.6482 123.9799 57.7938 30.7035 176.8122 46 D 4.6057 7.7844 119.7544 52.4286 41.3096 174.6631 47 P 4.2467 0.0000 0.0000 65.9694 31.4275 178.3994 48 Q 3.9133 8.0534 117.6789 58.8913 29.0599 177.6316 49 L 3.1780 8.2820 121.8256 57.8171 42.0026 178.9008 50 Q 4.1990 8.0149 117.9207 59.4232 28.7997 179.0639 51 Q 4.0797 8.1109 118.7238 58.8079 28.6300 179.0457 52 L 3.9404 7.5581 119.7050 57.4582 41.7433 179.1451 53 I 3.3806 7.8434 120.3396 64.2589 37.0772 178.3650 54 G 3.7991 7.8789 106.2141 48.1183 0.0000 175.5569 55 V 3.5845 7.8096 120.6420 65.7014 31.4512 177.9900 56 A 4.0139 7.8096 120.4148 54.9100 17.9832 179.5861 57 L 3.9339 7.6611 116.8043 57.8000 41.8211 178.8389 58 E 4.3315 7.7990 114.9137 57.2982 29.7421 176.8818 59 N 4.9374 7.6109 112.6161 51.8677 41.7267 175.0982 60 N 4.3956 8.5644 118.0376 53.8981 40.4147 175.6259 61 R 4.1384 8.5333 126.0221 58.7577 30.6693 178.6779 62 D 4.3592 8.2626 119.0021 57.1634 40.7947 178.6673 63 L 3.9331 8.0219 120.2412 58.2524 42.3273 178.6985 64 R 3.9491 7.7857 117.6499 59.4074 29.9328 178.9059 65 V 3.5535 8.0137 117.5398 66.2659 31.3380 178.0471 66 A 3.9746 7.7913 118.2310 54.7835 18.4097 179.2350 67 A 4.1446 8.0624 119.7050 55.3683 18.6441 179.8353 68 L 4.0771 8.5717 117.6655 57.8343 41.5126 179.6013 69 N 4.5517 8.5583 117.1034 56.2289 38.3246 176.9819 70 V 3.5765 7.6946 119.5540 66.6854 31.5412 178.0056 71 E 4.0996 8.2730 117.0783 59.3573 29.2666 178.9219 72 A 4.2186 8.3473 120.0676 54.1039 18.4217 178.8689 73 F 4.1552 8.9205 116.4402 58.8110 39.4767 178.1048 74 R 4.1213 8.0524 116.0516 58.5651 29.3232 178.7997 75 A 3.9406 8.0490 121.8040 55.3396 18.7018 179.5991 76 Q 3.9467 7.6307 115.5590 58.3639 28.3939 178.5424 77 Y 4.2051 7.5155 120.4247 60.8461 38.7720 177.4820 78 R 3.7166 7.9271 118.4464 58.3807 29.6516 179.2354 79 I 3.7074 7.8593 120.4724 64.4268 37.0074 177.6509 80 Q 4.3699 7.2091 113.8159 56.5373 28.6359 176.9809 81 R 4.0137 7.2476 120.2973 58.5341 30.6378 180.0364 82 A 4.5173 7.3509 119.7871 52.2872 17.6142 178.0797 83 D 4.9210 8.8877 122.8721 56.9314 42.0597 178.4941 84 L 4.3183 8.1455 119.9828 57.4707 42.4643 177.2170 85 F 4.1888 8.5068 117.4343 56.5326 39.4708 172.9267 86 P 2.9700 0.0000 0.0000 61.9332 32.2090 175.6952 87 R 4.2985 6.9076 121.4709 55.4789 31.2554 175.7649 88 I 4.3009 8.4427 124.6244 59.4946 39.6311 175.5524 89 G 3.8620 8.6477 116.8642 43.4777 0.0000 172.7423 90 V 3.8739 8.1562 126.8519 61.9875 30.3811 175.7668 91 D 4.4459 8.4553 126.0195 57.2093 42.6256 177.3512 *122 T 4.4231 7.2515 110.2502 61.9756 68.0126 175.0733 123 A 4.4091 9.0635 121.0547 51.9305 18.2997 177.7821 124 W 4.4414 8.0678 126.2621 57.6837 31.2382 174.7886 125 E 4.1520 6.8398 121.0308 54.2257 31.3911 177.3588 126 L 3.6904 7.0996 126.7734 53.7946 40.6794 176.3801 127 D 4.6349 7.0422 119.0655 53.4088 42.3658 177.7029 128 L 4.9460 8.0743 126.0208 54.4626 43.4593 176.8663 129 F 5.8651 7.1216 121.5042 57.1630 39.1278 178.8846 130 G 4.5708 8.9532 114.1625 44.4263 0.0000 170.8552 131 R 4.6098 7.6382 122.0581 58.0523 35.8776 176.7082 132 L 3.9942 8.0419 119.1520 58.1068 42.2727 178.6468 133 R 3.9744 7.9313 114.5274 57.5051 30.8059 177.6346 134 S 4.5151 7.8944 112.2017 60.5034 61.5666 175.2619 135 L 4.3287 8.3706 120.3939 56.0175 41.2587 178.6022 136 R 4.4704 7.5724 116.2490 57.8785 29.7106 178.4607 137 D 4.4689 7.8630 120.1845 57.2906 40.8591 178.5111 138 Q 4.0143 8.1710 117.5500 59.2226 28.6115 177.7760 139 A 4.0943 7.5604 121.8605 55.3436 18.3151 179.0642 140 L 3.6776 8.0612 117.9988 58.5012 41.8539 179.3925 141 E 3.9007 7.9036 117.6863 59.6073 29.4813 179.1724 142 Q 3.5461 8.5653 118.0476 58.5085 28.7291 178.6334 143 Y 4.1862 8.1636 121.1882 60.6907 39.1011 177.3919 144 L 3.5528 8.1014 119.8361 57.2553 41.5708 179.5358 145 A 3.8614 8.6567 122.2302 55.2681 18.2890 179.8063 146 T 3.4904 7.0093 112.8856 66.5900 68.3118 176.5513 147 E 3.7195 8.0331 121.5007 59.0630 29.4686 178.9476 148 Q 3.7428 7.6661 117.9912 58.5349 28.8862 177.9824 149 A 4.1553 8.1544 122.2228 55.1491 18.2391 179.6337 150 Q 3.8836 7.9265 118.0858 59.3696 29.2055 178.3470 151 R 3.9229 7.3320 119.2347 59.2632 30.0441 178.7509 152 S 4.0326 8.4276 112.9195 61.6342 62.3348 176.1289 153 A 4.0247 8.0011 123.1051 55.1953 17.9045 179.4707 154 Q 3.9709 8.3327 118.4950 59.5299 29.2107 178.3868 155 T 3.9406 8.1305 110.9726 65.1051 68.7516 176.6478 156 T 3.8798 8.1047 118.6348 66.2886 68.4631 176.3686 157 L 3.8977 7.6962 121.8810 57.9134 42.1155 178.8197 158 V 3.3343 7.9522 118.2844 66.1393 31.4015 177.8035 159 A 4.2063 8.0621 120.1496 55.5431 18.2305 179.8616 160 S 4.2000 8.2671 113.7377 61.4110 62.7703 177.1326 161 V 3.4368 8.2073 121.2515 65.8187 31.3608 177.5313 162 A 3.7720 8.0592 120.8987 55.6914 18.1236 179.5639 163 T 3.7997 8.3534 113.8847 66.8778 68.5945 176.5085 164 A 4.0039 8.3705 122.8766 55.3421 18.3269 179.0466 165 Y 3.9814 8.3932 118.2187 60.9464 38.8517 178.2962 166 L 3.8538 8.4874 120.2658 58.0345 41.7101 179.6140 167 T 3.8106 8.3036 116.1337 66.4800 68.2851 176.4315 168 L 4.1128 7.7951 123.5069 57.4804 42.1643 178.7740 169 K 3.7860 7.8782 119.4285 59.3515 31.9248 178.5060 170 A 3.8749 8.1381 121.1896 55.4550 18.3252 179.4980 171 D 4.1656 8.0704 117.1918 57.1536 40.7847 179.1087 172 Q 3.8779 8.3184 119.0320 58.8089 28.7428 178.3060 173 A 3.9012 7.8548 121.6960 55.4908 18.3669 179.7375 174 Q 3.5926 7.9576 116.3923 58.6633 28.4761 178.7387 175 L 3.9119 7.9298 121.6937 58.2115 42.1792 178.8109 176 Q 3.8734 8.3511 119.8213 59.0364 28.9566 177.9365 177 L 3.8774 8.2744 121.6640 58.4495 42.1436 178.9382 178 T 3.7411 8.3895 115.9718 66.5519 68.4408 176.4379 179 K 3.7953 8.2172 120.5048 59.7169 32.1447 178.8154 180 D 4.2814 7.9768 118.7601 57.8155 40.7171 179.3433 181 T 3.2355 7.5574 115.9155 66.1234 68.2201 176.4406 182 L 3.8011 8.0630 122.6706 58.2072 42.0145 179.1096 183 G 3.6746 7.9614 105.3912 48.2043 0.0000 175.7690 184 T 3.8764 7.7324 117.7031 66.8273 68.5985 176.6381 185 Y 4.4023 7.8604 118.5147 60.9892 37.8826 178.6563 186 Q 4.0715 8.5463 121.2640 59.1629 29.2045 178.2996 187 K 4.1159 8.0315 119.2833 59.3494 32.0914 179.3583 188 S 4.2054 8.5717 113.8595 61.3994 62.2901 175.9185 189 F 4.1144 8.4939 123.3752 61.5356 39.0971 176.8313 190 D 4.3778 8.3298 117.9367 56.9273 40.5179 178.7336 191 L 4.0712 8.1740 120.0054 58.0081 41.6409 179.4230 192 T 4.1138 8.0677 115.5979 65.9963 68.4132 176.9577 193 Q 3.6441 8.0061 122.1746 59.2531 29.0972 178.5669 194 R 4.0335 7.8000 118.5801 58.9429 29.9946 179.0237 195 S 4.1077 7.9681 113.0225 61.4629 62.4504 175.4809 196 Y 4.3181 8.0594 123.6002 60.1193 38.2304 177.8732 197 D 4.3976 7.7524 118.6058 57.4671 41.1150 178.6829 198 V 3.8934 7.5742 108.5206 60.9461 31.8172 176.1461 199 G 3.6661 7.7740 106.4464 47.1910 0.0000 174.8357 200 V 4.0237 8.2300 118.3999 63.6829 33.5205 175.3944 201 A 4.5875 7.3261 122.2394 50.9141 20.2133 177.1388 202 S 4.6443 8.8308 116.9738 57.5493 65.6885 175.5695 203 A 4.0272 8.5571 122.8706 54.8354 18.0587 179.3910 204 L 3.8309 7.9562 118.5668 58.5657 42.1781 178.3219 205 D 4.0986 7.6642 118.5444 57.5185 40.8288 178.7711 206 L 3.6320 7.6122 119.8808 58.4640 42.0247 179.4572 207 R 3.9322 8.0197 117.7829 59.1356 29.7421 178.9508 208 Q 3.8424 8.4487 117.9738 58.9705 28.3468 178.4846 209 A 4.0259 7.6177 121.9638 55.6564 18.3200 179.5054 210 Q 3.6585 8.2553 117.6335 59.4049 29.0429 178.3914 211 T 3.7859 7.8874 116.6451 66.5946 68.5228 176.0339 212 A 3.8401 7.5751 122.4143 55.1937 18.1950 179.7962 213 V 3.5906 7.2887 115.8509 66.3177 31.5610 178.0895 214 E 4.0009 8.1613 118.3738 59.2413 29.3189 179.2108 215 G 3.8560 7.9137 105.1699 48.2619 0.0000 175.4399 216 A 4.2161 8.2651 123.7739 54.4893 18.3866 179.6426 217 R 3.8172 8.3997 117.3367 59.4665 30.1668 178.5239 218 A 3.9704 8.2539 120.7279 55.6937 18.3215 179.8123 219 T 3.7785 8.0973 114.1683 66.3731 68.4313 176.4259 220 L 4.0017 8.4740 122.6428 58.3303 42.0830 178.7575 221 A 3.9724 7.8908 120.2843 55.3229 18.3330 179.2608 222 Q 3.7982 8.0414 117.7073 59.7801 29.1637 178.3561 223 Y 4.3340 8.1893 117.5729 60.8577 37.6740 178.3930 224 T 3.8984 8.1701 117.3642 66.5898 68.4898 176.4208 225 R 3.9084 7.9895 120.3935 59.5759 30.0898 178.5970 226 L 3.9893 8.0336 118.7586 57.6819 41.5666 179.3976 227 V 3.5454 8.0614 118.0916 66.0294 31.5797 177.5905 228 A 3.9944 7.8144 120.2957 55.7737 18.2307 179.7160 229 Q 4.0278 8.3911 116.2796 58.9066 28.3805 178.6040 230 D 4.3819 8.4436 120.6305 57.2316 40.7376 178.7082 231 Q 4.0496 8.0414 118.5367 59.0866 28.7665 178.4893 232 N 4.2977 8.0861 116.9907 56.3365 38.7038 177.2964 233 A 3.9913 8.1207 122.0522 54.9787 18.4534 179.4502 234 L 3.8790 8.1220 118.9567 58.2168 42.1199 179.3101 235 V 3.5126 8.0947 118.5356 65.8982 31.2550 177.2441 236 L 3.9027 7.5878 118.6208 58.6677 41.9523 178.9815 237 L 4.0872 7.6120 116.5169 57.4510 41.7426 179.0971 238 L 4.1542 8.0148 119.0895 55.0410 41.5039 179.5450 239 G 3.9610 8.3004 105.0849 45.8089 0.0000 172.8436 240 S 4.7311 7.7931 112.7398 55.6237 65.9725 173.6007 241 G 3.7844 8.2840 109.5655 44.8907 0.0000 173.3478 242 I 3.7870 8.0483 120.6829 60.2811 37.1906 174.9758 243 P 4.3683 0.0000 0.0000 62.2455 31.5124 176.1049 244 A 4.0618 8.2319 122.4536 54.2867 19.1587 178.0960 245 N 5.0089 7.4888 111.5232 50.7891 37.0088 174.7285 246 L 4.1032 7.5714 119.3211 54.9285 42.9427 176.1869 247 P 4.3464 0.0000 0.0000 61.8393 31.9661 175.9674 248 Q 3.7834 8.7895 121.9576 56.7307 28.9272 177.6268 249 G 4.0766 8.4776 114.9135 44.7182 0.0000 171.7085 250 L 4.8722 9.0768 118.9428 52.3771 44.4705 177.1392 251 G 3.8231 8.9394 111.3185 45.3738 0.0000 174.5539 252 L 4.1380 8.2175 118.7879 56.3604 41.8823 177.7194 253 D 4.7402 7.9526 117.2352 53.0723 39.6039 175.8184 254 Q 4.6172 7.3770 117.7166 54.1210 31.7220 175.5309 255 T 3.8854 8.4317 116.9455 64.4874 68.3987 173.9885 256 L 4.5778 8.4168 126.6185 54.9806 43.7969 176.5405 257 L 4.9529 7.5047 116.8306 52.7402 45.5392 176.4105 258 T 4.1418 8.1303 119.4975 62.9262 69.2678 174.4035 259 E 4.0157 8.8601 127.5028 56.2386 30.0961 175.8344 260 V 4.2988 8.2423 126.4066 60.4361 33.1062 173.5469 261 P 4.4898 0.0000 0.0000 62.1423 32.1810 176.2648 262 A 3.9304 8.7158 123.6276 53.5311 18.8823 179.3215 263 G 3.9601 7.9200 103.3407 45.3461 0.0000 172.3060 264 L 4.7460 8.5001 118.4414 51.9734 44.4581 175.6969 265 P 4.1933 0.0000 0.0000 65.0063 31.6452 178.9804 266 S 4.1459 7.9932 113.0027 61.3356 62.8075 175.8270 267 D 4.4924 8.2066 122.3215 57.0272 40.3721 178.8744 268 L 4.1493 7.7725 119.8259 57.5611 41.3687 179.2250 269 L 4.1192 8.1930 118.5782 56.7231 41.6062 177.7283 270 Q 4.6589 7.9264 114.1568 55.6375 30.1248 175.7857 271 R 4.4425 7.7690 112.7488 54.4986 32.8166 175.5600 272 R 4.2928 7.7120 119.6242 54.2770 30.5695 174.2045 273 P 4.1193 0.0000 0.0000 65.4898 31.3261 177.1870 274 D 4.6721 7.8752 114.9175 53.9882 39.9620 178.2687 275 I 3.7876 7.8915 122.7941 64.3879 37.4910 177.9729 276 L 4.0644 7.8563 119.2375 57.5521 41.3830 179.1667 277 E 3.8966 8.2987 119.3427 59.2191 29.7176 178.6453 278 A 4.0992 7.8527 120.9188 55.0373 18.2820 179.3094 279 E 3.6110 8.4817 118.0890 59.8153 29.8700 178.8414 280 H 4.0846 8.0235 115.5790 58.5587 28.4159 177.3942 281 Q 4.1699 8.0348 119.2620 57.5608 28.7115 177.9963 282 L 3.9739 7.5315 121.6995 58.2535 42.3735 178.5554 283 M 3.8889 8.0942 118.0777 57.3256 31.3161 178.6560 284 A 4.0849 7.8394 121.1479 55.0126 18.6499 179.4472 285 A 3.9619 7.4437 117.5791 55.2159 18.4888 179.0854 286 N 4.3881 8.1342 115.5474 56.7431 38.9198 177.0061 287 A 4.0726 7.6993 120.7155 54.5976 18.0623 178.9037 288 S 4.3162 7.7008 110.2920 60.0113 62.6124 176.2223 289 I 3.7419 7.5174 123.1230 64.8009 37.0197 178.2011 290 G 3.8419 8.3440 107.1697 47.3470 0.0000 175.4196 291 A 4.3307 7.9567 122.9057 53.6945 18.2837 178.8479 292 A 4.2683 7.5580 118.6670 53.9578 18.6243 179.1481 293 R 4.1962 7.8247 115.1864 57.4913 30.4303 177.7624 294 A 3.7598 7.5745 118.1032 52.5652 18.7396 178.1129 295 A 3.9292 7.2755 120.4141 54.6331 18.0347 178.4119 296 F 3.7814 6.8900 113.8704 59.6350 39.3572 174.8272 297 F 4.6480 7.0455 117.0161 56.1467 39.3651 173.4512 298 P 4.6354 0.0000 0.0000 59.7399 33.2323 174.9141 299 S 5.2656 8.6392 116.4975 56.7001 65.5500 173.5239 300 I 4.9658 8.2133 112.5937 58.6979 40.6371 174.3705 301 S 4.4840 8.6563 123.4315 56.1011 62.7328 173.0987 302 L 4.6475 8.1575 131.7377 55.2297 38.6265 175.5456 303 T 5.1479 8.0315 115.0746 59.3959 69.4170 174.5406 *323 S 4.1612 8.2690 120.9476 58.0855 62.9442 172.6164 324 W 4.6378 7.6529 119.8729 56.0551 30.1961 174.2187 325 L 4.2708 7.8152 119.1774 53.7569 44.9711 174.6989 326 F 5.0874 8.5436 120.1774 56.0596 41.1148 174.7503 327 Q 4.5984 8.6367 128.0130 53.4436 29.5932 172.2131 328 P 5.0129 0.0000 0.0000 61.9389 32.2918 176.0501 329 S 4.9030 8.7792 120.0285 57.0872 65.9542 173.1117 330 I 4.7703 8.1550 121.8713 60.1460 39.7697 175.4100 331 N 4.7472 8.4703 122.9306 52.7887 41.6788 172.9353 332 L 4.7582 8.4096 128.3957 52.3879 44.2545 174.3923 333 P 4.5564 0.0000 0.0000 62.8054 32.1934 175.5970 334 I 4.3623 7.9702 119.0075 62.0840 39.7072 176.1185 335 F 4.4018 7.8177 119.6504 57.8717 40.4486 172.9861 *339 S 4.3506 8.6605 123.3910 57.4883 64.3832 174.4725 340 L 4.2688 7.6816 120.1271 56.7147 42.8360 177.4259 341 R 4.2598 7.6822 115.7602 57.3792 30.2621 177.5996 342 A 4.0275 7.7610 120.3330 55.6477 18.6792 178.9205 343 S 4.0522 8.0987 110.5312 62.1240 62.2119 175.8061 344 L 3.8521 7.8531 121.4932 59.2115 41.7831 178.7785 345 D 4.3856 8.1194 117.7342 57.6513 40.8288 177.6652 346 Y 4.0590 8.2278 119.5671 61.1861 38.5563 178.0685 347 A 3.7068 8.6960 121.3273 55.3160 18.3818 179.6060 348 K 4.0299 7.8849 116.7884 58.8607 32.2581 179.4587 349 I 3.7665 8.3148 113.9727 63.7043 37.5880 177.7820 350 Q 3.6208 8.5027 121.9815 59.0581 28.7000 178.6346 351 K 3.9626 7.7167 120.4784 59.2312 32.1048 178.6691 352 D 4.3698 7.7090 119.7105 57.0328 40.6935 178.4212 353 I 3.6796 8.2899 120.9299 64.8025 37.1372 178.2898 354 N 4.5176 7.9280 116.8768 55.9050 38.2444 177.8695 355 V 3.6047 7.5988 119.3890 65.8914 31.6274 177.7928 356 A 4.5825 8.2247 122.2182 54.9241 18.2672 179.5842 357 Q 3.9312 8.3487 116.6722 59.1149 28.2874 178.3225 358 Y 4.1609 8.2034 120.6688 60.9525 38.9615 178.2682 359 E 3.8399 8.3662 119.2385 59.2628 29.5057 179.1091 360 K 3.8365 8.2947 119.6201 59.6697 32.0406 178.6128 361 A 3.9340 8.0196 120.7813 55.0063 18.1928 179.6671 362 I 3.6810 7.1245 117.4089 64.2282 37.1105 178.6616 363 Q 3.9474 8.0147 119.0097 59.3087 28.6289 178.6326 364 T 3.8730 8.1857 116.7951 66.7584 68.5108 176.4788 365 A 4.0445 7.8323 122.6944 55.0487 18.2642 179.5325 366 F 4.1144 8.2849 119.3756 61.2547 39.4883 177.1230 367 Q 4.1031 8.4941 119.4186 59.4920 28.8316 178.4327 368 E 3.9855 8.2535 119.4413 59.2232 29.4887 179.4301 369 V 3.3259 7.7906 117.9814 65.8889 31.5744 177.5631 370 A 3.7214 7.7097 120.6446 55.5483 18.2129 179.3155 371 D 4.4464 8.6298 117.5565 57.5596 40.8391 179.2869 372 G 3.6953 8.2283 106.2301 47.6759 0.0000 175.4958 373 L 4.1455 7.8966 120.6403 57.0263 41.8095 179.0274 374 A 3.6620 8.4010 120.8092 54.8010 18.1169 179.6318 375 A 3.8880 7.8934 120.3910 54.8878 18.3764 179.6321 376 R 4.0237 8.0954 116.1286 59.7461 30.1614 178.3840 377 G 3.8776 8.6450 105.2974 45.7173 0.0000 174.6644 378 T 4.3850 7.2251 109.6026 62.6391 70.3708 176.4448 379 F 4.4716 8.5002 120.9271 60.4810 38.8413 177.6895 380 T 3.9458 8.0322 115.1941 66.8434 68.3810 176.2891 381 E 4.0219 8.1182 119.9389 59.2758 29.5528 179.0399 382 Q 4.0033 8.0867 119.8382 59.1288 29.1726 178.1388 383 L 4.1041 8.5336 120.5721 57.5956 41.6273 179.2604 384 Q 3.9779 8.2041 119.5991 59.1210 28.9724 178.1051 385 A 4.0267 7.9163 121.4109 55.1330 18.4007 179.4333 386 Q 3.9744 8.1521 118.2235 59.1877 29.1475 178.5021 387 R 3.9493 8.5242 119.6379 59.4035 30.1017 178.7469 388 D 4.4417 8.2361 118.6826 57.2062 40.7712 178.5629 389 L 3.9929 8.2850 121.3468 58.1159 42.0718 179.2571 390 V 3.6041 7.9190 118.1737 65.7403 31.5170 177.7651 391 K 3.8852 8.6018 119.5066 59.7660 32.0207 178.6454 392 A 4.1427 8.5097 121.2112 55.0767 18.2979 179.8120 393 S 4.3191 8.3930 114.0448 61.5388 62.7588 176.2942 394 D 4.3858 8.3482 120.9100 57.6399 41.1003 178.2323 395 E 4.0259 8.1380 118.5505 59.4897 29.3637 178.8677 396 Y 4.3163 8.3416 119.8455 60.9224 38.9652 177.2888 397 Y 3.8438 8.5822 120.7926 60.7118 38.8528 178.2106 398 Q 3.7051 8.4595 119.1150 59.0361 28.8854 178.1288 399 L 3.8770 7.9851 119.6116 58.1141 41.7039 179.3359 400 A 4.1679 8.3023 120.4133 55.3386 18.3294 179.3509 401 D 4.0079 7.6634 116.3835 57.1239 41.2956 178.0634 402 K 3.8138 7.7925 120.1118 59.9228 32.3014 178.9515 403 R 3.9907 8.4831 118.2226 58.9743 29.8733 178.6536 404 Y 4.5359 7.7030 120.6063 60.3553 38.7559 177.8767 405 R 3.8121 7.6885 116.7164 59.1209 30.1342 178.9050 406 T 3.9968 7.5700 115.4355 64.8272 68.5174 175.6523 407 G 3.9178 7.8311 108.1173 45.2344 0.0000 174.9360 408 V 3.8212 7.4247 111.6281 63.2416 32.1711 175.9964 409 D 4.9016 7.9246 119.2213 52.0636 44.0896 175.1256 410 N 5.1224 8.6052 120.2956 52.3853 38.5899 175.4339 411 Y 3.4748 8.6753 119.2064 60.3488 38.7643 177.5953 412 L 3.9818 7.6844 121.3203 58.6167 42.0698 179.2068 413 T 3.9902 7.6883 115.0714 66.1794 68.3175 176.5953 414 L 3.6415 7.5506 121.8403 57.9134 42.0128 178.4967 415 L 3.9546 7.7150 120.2770 58.2896 41.9075 178.4550 416 D 4.2995 8.0163 117.4679 57.2542 41.0798 178.0491 417 A 3.2935 7.7355 121.2066 54.9291 18.2160 179.5759 418 Q 3.9799 8.3421 116.8679 59.3018 28.8376 179.3952 419 R 4.0643 8.3058 119.2777 59.2806 30.1089 179.2522 420 S 4.1737 8.3932 115.1982 61.5755 62.8943 176.2821 421 L 3.9329 8.2066 123.1012 58.2948 41.8676 178.6385 422 F 4.5273 8.4731 120.3295 61.9636 39.3836 177.3239 423 T 3.7029 8.1700 115.0007 66.5270 68.2435 176.7021 424 A 4.0627 8.6292 123.0867 54.9852 18.3298 179.8346 425 Q 3.9506 8.3096 116.9296 59.2838 28.7236 178.7804 426 Q 3.9359 8.0818 119.0986 58.9299 28.6875 178.6562 427 Q 3.9575 8.2039 120.7061 58.7681 28.9940 177.7653 428 L 3.9178 7.8659 121.5492 58.2442 42.0623 178.8646 429 I 3.6097 7.4699 119.0248 64.8101 37.1024 178.2244 430 T 3.8244 7.5802 116.0307 66.9599 68.3633 176.1109 431 D 4.3885 8.6049 120.7271 57.4874 40.9046 179.0343 432 R 3.7387 8.2527 119.3521 59.3220 30.1262 178.1869 433 L 3.8790 8.4397 120.4382 58.3405 41.9972 178.7867 434 N 4.3052 8.4644 117.0573 55.9463 38.4227 177.4703 435 Q 2.9310 7.3840 119.1550 58.8091 28.5633 178.5901 436 L 3.9478 7.6128 121.3123 57.6816 41.6159 179.6901 437 T 3.8451 7.9364 109.6830 64.6990 68.6661 176.8309 438 S 4.1954 8.0326 118.0770 61.5107 62.9454 176.2868 439 E 4.0256 8.2773 121.9637 59.1381 29.3847 178.8436 440 V 4.0723 8.6148 118.8661 66.5085 31.6078 177.7520 441 N 4.4316 9.0497 116.9713 56.1729 38.3145 177.1983 442 L 3.8995 8.5521 122.1225 58.1650 42.2685 178.1980 443 Y 3.8810 8.0127 119.4423 60.6845 38.5860 177.9509 444 K 3.7185 8.0694 120.1116 59.5791 31.9853 178.3520 445 A 3.9617 7.9388 120.0936 55.1367 18.4141 179.0769 446 L 4.1665 7.6264 115.0969 55.5001 41.6954 177.7101 447 G 3.9468 8.0759 108.6157 45.6971 0.0000 176.8079 448 G 2.0000 7.5520 109.0518 47.8610 0.0000 177.2346 449 G 4.3512 7.5179 107.7958 45.2336 0.0000 174.9576 450 W 4.3965 8.2890 131.3748 59.8979 31.0669 176.3233 451 N 4.5329 8.2626 117.0432 52.1945 38.9065 175.5263 452 Q 2.5200 8.6550 125.0438 57.9616 29.2710 176.1889 453 Q 4.6834 7.2506 113.5812 53.5618 32.2290 175.0862 454 T 4.8516 8.1003 113.9914 61.9547 68.1063 173.9320 455 V 4.5327 7.9828 118.2210 59.8854 35.4182 176.1785 456 T 4.2533 8.2240 113.9297 60.7556 67.9874 174.4969 457 Q 3.5594 8.3554 126.4082 57.1815 30.2464 174.8515 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 C 8.19 4.53 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 2 S 8.27 4.72 0.00 4.12 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 3 L 9.45 4.68 0.00 1.86 1.93 0.87 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 4 I 8.13 4.63 1.91 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.66 0.94 0.00 0.00 5 P 0.00 4.38 0.00 2.06 2.00 0.00 3.71 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.09 0.00 6 D 8.56 4.35 0.00 2.80 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 7 Y 8.70 4.19 0.00 2.82 2.94 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 8 Q 8.26 4.04 0.00 2.05 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.72 0.00 0.00 0.00 0.00 0.00 2.19 2.27 0.00 9 R 7.28 3.59 0.00 1.10 1.58 0.00 3.38 0.00 0.00 3.26 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.29 0.00 10 P 0.00 4.51 0.00 2.19 2.01 0.00 3.62 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 2.12 2.09 0.00 11 E 8.39 4.08 0.00 1.95 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 2.29 2.28 0.00 12 A 8.47 4.05 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 P 0.00 4.02 0.00 1.97 2.07 0.00 3.59 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.07 0.00 14 V 6.72 3.59 1.11 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 0.34 0.00 0.00 0.85 0.00 0.00 15 A 7.39 3.98 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 A 8.72 3.98 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 A 7.45 4.65 1.20 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 0.00 0.00 0.00 0.00 0.00 18 Y 7.79 4.31 0.00 2.95 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 P 0.00 4.27 0.00 1.40 1.94 0.00 3.25 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 1.94 2.27 0.00 20 Q 9.07 4.61 0.00 2.05 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.95 0.00 0.00 0.00 0.00 0.00 2.28 2.25 0.00 21 G 8.95 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 22 Q 8.54 3.82 0.00 2.02 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.02 0.00 0.00 0.00 0.00 0.00 2.38 2.33 0.00 23 A 7.75 4.37 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 Y 7.96 4.78 0.00 2.93 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 G 8.81 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 26 Q 8.30 4.48 0.00 2.08 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.89 0.00 0.00 0.00 0.00 0.00 2.40 2.32 0.00 27 N 8.54 4.64 0.00 2.73 2.77 0.00 0.00 6.99 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 28 T 8.55 3.97 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 1.24 0.00 0.00 29 G 8.04 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 30 A 8.33 4.12 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 31 A 8.33 4.49 1.26 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 32 A 8.61 3.93 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 33 V 7.35 4.22 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 0.95 0.00 0.00 34 P 0.00 4.43 0.00 2.25 2.24 0.00 3.83 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 1.98 0.00 35 A 8.79 3.92 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 36 A 7.87 4.22 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 D 8.06 4.77 0.00 2.94 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 38 I 7.68 4.19 2.11 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 0.51 0.93 0.00 0.00 39 G 8.58 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 40 W 8.77 4.66 0.00 3.99 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 41 R 7.27 4.06 0.00 1.64 1.83 0.00 3.09 0.00 0.00 3.30 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.62 0.97 0.00 42 E 8.32 4.39 0.00 1.81 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 2.22 2.19 0.00 43 F 8.18 4.18 0.00 2.41 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 0.00 0.00 0.00 0.00 44 F 7.60 4.81 0.00 3.29 2.85 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 0.00 0.00 0.00 45 R 8.65 3.99 0.00 1.69 1.97 0.00 3.10 0.00 0.00 3.28 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.57 0.00 46 D 7.78 4.61 0.00 2.86 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 P 0.00 4.25 0.00 2.19 2.10 0.00 3.66 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 2.12 2.16 0.00 48 Q 8.05 3.91 0.00 2.36 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.90 0.00 0.00 0.00 0.00 0.00 2.41 2.41 0.00 49 L 8.28 3.18 0.00 1.05 1.52 0.28 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 50 Q 8.01 4.20 0.00 2.42 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.56 0.00 0.00 0.00 0.00 0.00 2.64 2.68 0.00 51 Q 8.11 4.08 0.00 2.04 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.83 0.00 0.00 0.00 0.00 0.00 2.58 2.54 0.00 52 L 7.56 3.94 0.00 1.61 1.54 0.76 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 53 I 7.84 3.38 1.26 0.00 0.00 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.55 -0.56 0.00 0.00 54 G 7.88 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 0.00 0.00 0.00 55 V 7.81 3.58 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 0.96 0.00 0.00 0.92 0.00 0.00 56 A 7.81 4.01 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 57 L 7.66 3.93 0.00 1.70 1.69 0.74 0.57 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 58 E 7.80 4.33 0.00 1.96 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.56 0.00 59 N 7.61 4.94 0.00 2.90 2.80 0.00 0.00 6.87 7.88 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 60 N 8.56 4.40 0.00 2.74 2.68 0.00 0.00 7.01 7.52 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 61 R 8.53 4.14 0.00 1.86 1.95 0.00 3.35 0.00 0.00 3.34 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.65 0.00 62 D 8.26 4.36 0.00 2.85 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 63 L 8.02 3.93 0.00 1.76 1.81 0.98 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 64 R 7.79 3.95 0.00 2.16 2.01 0.00 3.21 0.00 0.00 3.11 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.67 0.00 65 V 8.01 3.55 2.29 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 1.12 0.00 0.00 0.99 0.00 0.00 66 A 7.79 3.97 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 67 A 8.06 4.14 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 L 8.57 4.08 0.00 1.85 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0.00 7.23 6.78 0.00 0.00 0.00 0.00 0.00 2.34 2.21 0.00 77 Y 7.52 4.21 0.00 2.91 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 78 R 7.93 3.72 0.00 2.00 1.85 0.00 3.32 0.00 0.00 3.15 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.96 0.00 79 I 7.86 3.71 1.83 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 1.48 1.31 0.88 0.00 0.00 80 Q 7.21 4.37 0.00 2.08 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.86 0.00 0.00 0.00 0.00 0.00 2.37 2.54 0.00 81 R 7.25 4.01 0.00 1.36 1.63 0.00 2.75 0.00 0.00 2.85 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.28 0.00 82 A 7.35 4.52 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 83 D 8.89 4.92 0.00 2.65 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 84 L 8.15 4.32 0.00 1.67 1.84 0.96 0.69 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 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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 0.00 1.22 0.00 0.00 157 L 7.70 3.90 0.00 1.90 1.70 0.89 1.23 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 0.00 158 V 7.95 3.33 2.31 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 1.29 0.00 0.00 0.75 0.00 0.00 159 A 8.06 4.21 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 0.00 0.00 0.00 0.00 0.00 160 S 8.27 4.20 0.00 3.99 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 0.00 161 V 8.21 3.44 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 0.86 0.00 0.00 0.89 0.00 0.00 162 A 8.06 3.77 1.18 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 0.00 163 T 8.35 3.80 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 164 A 8.37 4.00 1.37 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 2.33 2.42 0.00 173 A 7.85 3.90 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 174 Q 7.96 3.59 0.00 1.17 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.75 0.00 0.00 0.00 0.00 0.00 2.27 2.05 0.00 175 L 7.93 3.91 0.00 1.82 1.80 0.98 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 176 Q 8.35 3.87 0.00 2.17 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.58 0.00 0.00 0.00 0.00 0.00 2.31 2.36 0.00 177 L 8.27 3.88 0.00 1.73 1.83 0.96 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 178 T 8.39 3.74 4.48 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 1.33 0.00 0.00 179 K 8.22 3.80 0.00 1.89 1.81 0.00 1.65 0.00 0.00 1.62 0.00 0.00 2.94 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.64 7.81 180 D 7.98 4.28 0.00 2.71 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 0.00 181 T 7.56 3.24 3.40 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 -0.38 0.00 0.00 182 L 8.06 3.80 0.00 1.57 1.69 0.91 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 183 G 7.96 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 0.00 0.00 0.00 184 T 7.73 3.88 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 1.28 0.00 0.00 185 Y 7.86 4.40 0.00 3.04 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 0.00 186 Q 8.55 4.07 0.00 2.32 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.81 0.00 0.00 0.00 0.00 0.00 2.38 2.51 0.00 187 K 8.03 4.12 0.00 2.01 1.90 0.00 1.75 0.00 0.00 1.60 0.00 0.00 2.90 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.50 1.65 7.81 188 S 8.57 4.21 0.00 4.05 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 0.00 189 F 8.49 4.11 0.00 3.30 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 D 8.33 4.38 0.00 2.84 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 0.00 191 L 8.17 4.07 0.00 1.96 1.80 0.99 0.60 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 0.00 192 T 8.07 4.11 4.15 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 0.00 0.00 1.03 0.00 0.00 193 Q 8.01 3.64 0.00 1.60 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.82 0.00 0.00 0.00 0.00 0.00 2.29 2.38 0.00 194 R 7.80 4.03 0.00 1.90 1.96 0.00 3.35 0.00 0.00 3.10 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.70 0.00 195 S 7.97 4.11 0.00 3.95 3.96 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 0.00 196 Y 8.06 4.32 0.00 3.14 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 0.00 197 D 7.75 4.40 0.00 2.92 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 0.00 198 V 7.57 3.89 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 0.70 0.00 0.00 0.98 0.00 0.00 199 G 7.77 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 0.00 0.00 0.00 200 V 8.23 4.02 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 0.75 0.00 0.00 0.89 0.00 0.00 201 A 7.33 4.59 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 202 S 8.83 4.64 0.00 4.15 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 0.00 203 A 8.56 4.03 1.43 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 0.00 0.00 204 L 7.96 3.83 0.00 1.78 1.70 0.93 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 205 D 7.66 4.10 0.00 2.95 2.61 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 0.00 206 L 7.61 3.63 0.00 1.44 1.58 0.39 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 207 R 8.02 3.93 0.00 1.92 1.92 0.00 3.33 0.00 0.00 3.15 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.78 0.00 208 Q 8.45 3.84 0.00 1.92 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.69 0.00 0.00 0.00 0.00 0.00 2.38 2.40 0.00 209 A 7.62 4.03 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 210 Q 8.26 3.66 0.00 2.46 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.71 0.00 0.00 0.00 0.00 0.00 2.08 1.99 0.00 211 T 7.89 3.79 4.39 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 1.19 0.00 0.00 212 A 7.58 3.84 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 213 V 7.29 3.59 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 0.99 0.00 0.00 0.90 0.00 0.00 214 E 8.16 4.00 0.00 2.01 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 2.49 2.40 0.00 215 G 7.91 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 0.00 0.00 0.00 216 A 8.27 4.22 1.44 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 0.00 0.00 0.00 0.00 0.00 0.00 217 R 8.40 3.82 0.00 1.95 2.12 0.00 3.08 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 1.61 1.64 0.00 218 A 8.25 3.97 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 219 T 8.10 3.78 4.60 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 1.49 0.00 0.00 220 L 8.47 4.00 0.00 1.85 1.94 0.94 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 221 A 7.89 3.97 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 0.00 222 Q 8.04 3.80 0.00 1.99 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.75 0.00 0.00 0.00 0.00 0.00 1.75 2.16 0.00 223 Y 8.19 4.33 0.00 3.10 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 0.00 224 T 8.17 3.90 4.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 225 R 7.99 3.91 0.00 1.88 2.07 0.00 3.20 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 1.62 1.66 0.00 226 L 8.03 3.99 0.00 1.87 1.77 0.89 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 227 V 8.06 3.55 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 1.00 0.00 0.00 0.96 0.00 0.00 228 A 7.81 3.99 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 0.00 229 Q 8.39 4.03 0.00 2.10 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.76 0.00 0.00 0.00 0.00 0.00 2.38 2.55 0.00 230 D 8.44 4.38 0.00 2.85 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 0.00 231 Q 8.04 4.05 0.00 2.25 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.79 0.00 0.00 0.00 0.00 0.00 2.37 2.58 0.00 232 N 8.09 4.30 0.00 2.90 2.87 0.00 0.00 6.97 7.22 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 0.00 233 A 8.12 3.99 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 0.00 234 L 8.12 3.88 0.00 1.85 1.94 0.94 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 235 V 8.09 3.51 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 1.08 0.00 0.00 0.99 0.00 0.00 236 L 7.59 3.90 0.00 1.67 1.87 0.92 1.04 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 0.00 237 L 7.61 4.09 0.00 1.82 1.69 0.99 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 238 L 8.01 4.15 0.00 1.97 1.67 0.89 0.79 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 0.00 239 G 8.30 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 240 S 7.79 4.73 0.00 3.93 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 0.00 241 G 8.28 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 0.00 0.00 0.00 242 I 8.05 3.79 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 1.43 0.58 0.92 0.00 0.00 243 P 0.00 4.37 0.00 2.03 1.99 0.00 3.67 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.07 0.00 244 A 8.23 4.06 1.26 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 0.00 245 N 7.49 5.01 0.00 2.78 2.83 0.00 0.00 6.02 7.79 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 0.00 246 L 7.57 4.10 0.00 1.67 1.66 0.94 1.12 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 0.00 247 P 0.00 4.35 0.00 2.04 1.98 0.00 3.71 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 2.02 2.06 0.00 248 Q 8.79 3.78 0.00 1.99 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.98 0.00 0.00 0.00 0.00 0.00 2.36 2.47 0.00 249 G 8.48 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 250 L 9.08 4.87 0.00 1.69 1.56 0.96 1.17 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 0.00 251 G 8.94 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 0.00 0.00 0.00 252 L 8.22 4.14 0.00 1.59 1.68 0.84 0.96 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 0.00 253 D 7.95 4.74 0.00 2.76 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 254 Q 7.38 4.62 0.00 2.12 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.49 6.98 0.00 0.00 0.00 0.00 0.00 2.26 2.26 0.00 255 T 8.43 3.89 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 1.18 0.00 0.00 256 L 8.42 4.58 0.00 1.55 1.69 0.91 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 257 L 7.50 4.95 0.00 1.24 0.80 0.82 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 258 T 8.13 4.14 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 259 E 8.86 4.02 0.00 1.95 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 2.33 2.33 0.00 260 V 8.24 4.30 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 0.88 0.00 0.00 0.79 0.00 0.00 261 P 0.00 4.49 0.00 2.24 2.05 0.00 3.84 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.98 0.00 262 A 8.72 3.93 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 0.00 263 G 7.92 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 264 L 8.50 4.75 0.00 1.63 1.46 0.90 0.99 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 0.00 265 P 0.00 4.19 0.00 2.03 2.12 0.00 3.67 0.00 0.00 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.44 0.00 266 S 7.99 4.15 0.00 4.03 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 0.00 267 D 8.21 4.49 0.00 2.82 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 0.00 268 L 7.77 4.15 0.00 1.71 1.73 1.14 0.69 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 0.00 269 L 8.19 4.12 0.00 1.66 1.82 0.95 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 270 Q 7.93 4.66 0.00 1.99 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.81 0.00 0.00 0.00 0.00 0.00 2.25 2.41 0.00 271 R 7.77 4.44 0.00 2.00 1.87 0.00 3.15 0.00 0.00 3.16 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.54 0.00 272 R 7.71 4.29 0.00 1.90 1.82 0.00 3.37 0.00 0.00 3.12 7.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.77 0.00 273 P 0.00 4.12 0.00 2.13 2.00 0.00 3.58 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 2.08 2.08 0.00 274 D 7.88 4.67 0.00 2.83 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 0.00 275 I 7.89 3.79 1.99 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 1.37 0.58 0.77 0.00 0.00 276 L 7.86 4.06 0.00 1.80 1.70 0.88 0.93 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 0.00 277 E 8.30 3.90 0.00 2.09 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 2.25 2.47 0.00 278 A 7.85 4.10 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 279 E 8.48 3.61 0.00 2.41 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 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3.94 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 0.00 289 I 7.52 3.74 2.02 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 1.46 1.15 0.92 0.00 0.00 290 G 8.34 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 0.00 0.00 0.00 291 A 7.96 4.33 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 0.00 292 A 7.56 4.27 1.43 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 0.00 0.00 293 R 7.82 4.20 0.00 2.10 1.90 0.00 3.02 0.00 0.00 3.16 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.70 0.00 294 A 7.57 3.76 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 0.00 295 A 7.28 3.93 1.20 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 0.00 0.00 0.00 0.00 0.00 296 F 6.89 3.78 0.00 2.66 2.73 0.00 0.00 0.00 0.00 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1.99 2.16 0.00 3.29 0.00 0.00 3.26 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.72 0.00 377 G 8.64 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 378 T 7.23 4.38 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 1.01 0.00 0.00 379 F 8.50 4.47 0.00 3.24 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 380 T 8.03 3.95 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 0.00 381 E 8.12 4.02 0.00 2.18 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.42 0.00 382 Q 8.09 4.00 0.00 2.20 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.81 0.00 0.00 0.00 0.00 0.00 2.43 2.41 0.00 383 L 8.53 4.10 0.00 1.82 1.73 0.96 0.72 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 0.00 384 Q 8.20 3.98 0.00 2.30 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.80 0.00 0.00 0.00 0.00 0.00 2.37 2.43 0.00 385 A 7.92 4.03 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 386 Q 8.15 3.97 0.00 2.37 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.75 0.00 0.00 0.00 0.00 0.00 2.51 2.45 0.00 387 R 8.52 3.95 0.00 2.00 1.97 0.00 3.19 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.93 0.00 388 D 8.24 4.44 0.00 2.92 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 389 L 8.29 3.99 0.00 1.85 1.86 0.96 0.76 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 0.00 390 V 7.92 3.60 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 0.99 0.00 0.00 391 K 8.60 3.89 0.00 1.99 1.93 0.00 1.70 0.00 0.00 1.67 0.00 0.00 2.97 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.47 1.49 7.81 392 A 8.51 4.14 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 0.00 393 S 8.39 4.32 0.00 4.15 4.04 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 0.00 394 D 8.35 4.39 0.00 3.02 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 0.00 395 E 8.14 4.03 0.00 2.25 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 2.58 2.51 0.00 396 Y 8.34 4.32 0.00 3.07 3.15 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 0.00 0.00 0.00 397 Y 8.58 3.84 0.00 2.97 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 0.00 398 Q 8.46 3.71 0.00 2.17 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.53 0.00 0.00 0.00 0.00 0.00 2.44 2.59 0.00 399 L 7.99 3.88 0.00 2.00 1.75 0.97 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 400 A 8.30 4.17 1.21 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 0.00 0.00 401 D 7.66 4.01 0.00 2.20 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 0.00 402 K 7.79 3.81 0.00 1.84 1.92 0.00 1.68 0.00 0.00 1.64 0.00 0.00 2.92 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.42 1.47 7.81 403 R 8.48 3.99 0.00 1.86 2.14 0.00 3.20 0.00 0.00 3.13 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.85 0.00 404 Y 7.70 4.54 0.00 3.03 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 0.00 405 R 7.69 3.81 0.00 1.83 1.95 0.00 3.47 0.00 0.00 3.46 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.84 0.00 406 T 7.57 4.00 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 1.21 0.00 0.00 407 G 7.83 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 0.00 408 V 7.42 3.82 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 0.72 0.00 0.00 1.01 0.00 0.00 409 D 7.92 4.90 0.00 2.80 2.57 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 0.00 410 N 8.61 5.12 0.00 3.07 3.05 0.00 0.00 5.88 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 0.00 411 Y 8.68 3.47 0.00 3.09 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 0.00 412 L 7.68 3.98 0.00 1.73 1.90 0.96 0.80 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 0.00 413 T 7.69 3.99 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 1.37 0.00 0.00 414 L 7.55 3.64 0.00 1.32 1.14 0.68 -0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 415 L 7.72 3.95 0.00 1.98 1.79 0.94 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 416 D 8.02 4.30 0.00 2.92 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 0.00 417 A 7.74 3.29 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 418 Q 8.34 3.98 0.00 2.19 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.75 0.00 0.00 0.00 0.00 0.00 2.59 2.73 0.00 419 R 8.31 4.06 0.00 1.88 2.03 0.00 3.16 0.00 0.00 3.20 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.88 0.00 420 S 8.39 4.17 0.00 4.11 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 0.00 421 L 8.21 3.93 0.00 1.83 1.78 0.96 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 422 F 8.47 4.53 0.00 3.17 3.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 423 T 8.17 3.70 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 424 A 8.63 4.06 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 0.00 425 Q 8.31 3.95 0.00 2.39 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.75 0.00 0.00 0.00 0.00 0.00 2.39 2.54 0.00 426 Q 8.08 3.94 0.00 1.94 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.81 0.00 0.00 0.00 0.00 0.00 2.21 2.14 0.00 427 Q 8.20 3.96 0.00 2.24 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.77 0.00 0.00 0.00 0.00 0.00 2.36 2.57 0.00 428 L 7.87 3.92 0.00 1.90 1.83 0.92 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 429 I 7.47 3.61 2.09 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 1.45 0.54 0.85 0.00 0.00 430 T 7.58 3.82 4.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 431 D 8.60 4.39 0.00 2.81 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 0.00 432 R 8.25 3.74 0.00 1.83 2.09 0.00 3.07 0.00 0.00 3.04 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.61 0.00 433 L 8.44 3.88 0.00 1.68 1.74 0.90 0.80 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 0.00 434 N 8.46 4.31 0.00 2.63 2.83 0.00 0.00 6.76 7.42 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 0.00 435 Q 7.38 2.93 0.00 1.82 1.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.81 0.00 0.00 0.00 0.00 0.00 2.20 2.22 0.00 436 L 7.61 3.95 0.00 1.82 1.75 0.87 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 437 T 7.94 3.85 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 1.30 0.00 0.00 438 S 8.03 4.20 0.00 4.15 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 439 E 8.28 4.03 0.00 2.34 2.17 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 2.38 2.54 0.00 440 V 8.61 4.07 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 1.28 0.00 0.00 441 N 9.05 4.43 0.00 2.99 2.90 0.00 0.00 6.74 5.12 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 0.00 442 L 8.55 3.90 0.00 1.78 1.95 0.84 0.80 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 0.00 443 Y 8.01 3.88 0.00 2.13 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 0.00 444 K 8.07 3.72 0.00 1.90 1.94 0.00 1.70 0.00 0.00 1.84 0.00 0.00 3.00 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.42 1.43 7.81 445 A 7.94 3.96 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 0.00 446 L 7.63 4.17 0.00 1.52 1.67 0.86 0.99 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 0.00 447 G 8.08 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 0.00 448 G 7.55 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 449 G 7.52 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 0.00 0.00 0.00 450 W 8.29 4.40 0.00 3.46 3.20 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 0.00 0.00 0.00 451 N 8.26 4.53 0.00 2.87 2.95 0.00 0.00 6.68 7.74 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 0.00 452 Q 8.66 2.52 0.00 1.74 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.17 6.81 0.00 0.00 0.00 0.00 0.00 2.00 1.38 0.00 453 Q 7.25 4.68 0.00 1.93 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.79 0.00 0.00 0.00 0.00 0.00 2.02 2.12 0.00 454 T 8.10 4.85 4.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 455 V 7.98 4.53 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.98 0.00 0.00 456 T 8.22 4.25 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 1.22 0.00 0.00 457 Q 8.36 3.56 0.00 2.27 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.59 6.68 0.00 0.00 0.00 0.00 0.00 2.27 2.29 0.00 * Residues marked with a * may have inaccurate shift predictions.