NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 C 4.5569 8.3449 115.6377 58.4562 30.8678 172.7904 3 N 4.6612 8.2909 114.1018 51.3137 39.5952 172.7613 4 L 4.8134 8.1453 118.4978 54.7053 46.4480 172.8019 5 Y 5.4931 8.5558 123.2625 56.9000 41.3874 172.8516 6 R 5.3854 9.6878 117.4245 53.7587 34.2763 177.4028 *8 E 4.2653 8.7097 124.2803 56.8533 30.8998 175.2634 9 D 4.5978 7.8745 119.3370 52.9407 40.5409 176.2052 10 K 4.0999 8.7070 126.4249 59.3751 32.6183 178.1537 11 D 4.7932 7.8699 119.7518 52.4343 39.9711 175.0399 12 W 4.8688 8.0991 119.8811 57.6751 30.5677 179.3727 13 V 2.7893 6.5985 118.4893 65.3532 30.8507 177.5233 14 S 4.0507 8.0385 113.1423 60.3165 62.1308 174.4975 15 K 4.4222 8.1431 115.8715 56.0117 32.8853 176.4373 16 W 5.0544 8.1384 116.9965 57.0481 32.1053 175.3139 17 A 4.7960 7.9727 120.9004 51.6789 19.1847 178.0058 18 Q 3.8589 8.4430 123.1245 60.7269 29.2302 176.5860 19 D 4.5727 8.0270 113.8883 53.4269 39.6116 175.4402 20 A 4.6358 7.3932 121.9695 51.1284 21.5139 177.6391 21 E 4.1529 8.8871 121.2316 55.0920 29.5105 174.5115 22 S 4.6969 8.4304 121.5548 56.4607 60.4979 173.3949 23 L 4.9386 7.6436 128.9285 53.1486 38.6205 175.8057 24 I 4.4913 7.1400 110.5328 60.7616 40.6999 175.6189 25 N 4.6647 8.3604 120.0497 51.5408 37.0543 176.1097 26 L 4.3936 7.7354 123.4976 54.1231 42.9674 174.0263 *28 P 4.4622 0.0000 0.0000 62.5983 33.0162 176.1290 29 A 4.7007 7.2146 118.5790 50.7400 22.4071 174.5622 30 Y 4.7380 8.2653 116.2850 56.2017 41.9640 174.5692 31 Q 4.7898 8.3519 123.4522 54.2272 32.3874 173.9878 *33 N 4.8930 8.2779 119.5441 52.1474 39.8784 172.1339 34 P 3.6688 0.0000 0.0000 64.4111 31.6437 176.1602 35 D 4.6287 8.8128 120.1833 55.0126 42.2190 173.2399 36 Q 4.2730 8.2462 118.9588 56.6609 27.1253 178.4171 *38 G 3.9595 8.9376 112.2901 45.8732 0.0000 170.3087 39 P 5.1518 0.0000 0.0000 62.4554 32.3136 175.5435 40 I 4.7281 8.7753 115.6263 59.4577 41.8627 174.0154 41 V 4.5971 8.7034 124.1192 61.5399 33.0896 174.7253 42 R 5.0717 8.7810 124.9058 54.5797 32.4676 174.9272 43 N 5.2564 8.5273 117.1930 52.6238 40.3843 174.9789 44 T 4.6268 8.2465 117.3133 61.3485 71.2678 175.6973 45 A 4.0902 8.5604 125.8933 55.4051 18.5980 179.1282 46 D 4.4378 8.0166 115.1513 57.4139 41.1307 176.5169 47 G 3.7727 7.7604 107.6420 45.8049 0.0000 174.2577 48 K 4.3223 8.0435 119.5464 55.9425 33.3756 174.8698 49 K 5.1038 8.4274 117.8536 55.0678 35.1628 175.5420 50 Q 4.8197 9.0746 123.7604 53.9237 31.7206 174.3446 51 L 4.9435 8.3866 126.1485 53.9356 43.5574 175.4831 52 V 4.4936 8.4524 119.0237 60.4577 36.9157 173.7102 53 H 5.3509 8.6987 117.9372 55.1754 30.0142 174.9252 54 A 4.9351 8.5226 122.0846 50.3945 23.0056 175.6623 55 R 4.4313 9.5244 121.0705 55.6419 31.6095 175.5447 56 W 3.6115 9.4031 135.0000 59.7775 31.2164 173.8094 57 G 3.7016 8.2346 122.0430 44.3236 0.0000 171.4908 58 L 4.0325 8.1251 128.3996 52.8327 42.4521 175.4926 59 P 4.6403 0.0000 0.0000 62.7217 31.6853 177.1199 60 S 4.4004 8.7403 118.4971 57.2944 63.7149 172.6660 61 P 3.4178 0.0000 0.0000 62.6078 31.7118 177.5149 62 I 3.6049 8.1274 116.8612 64.4700 36.8899 178.1127 63 F 4.6828 7.6981 118.5273 60.1229 38.6232 177.8944 64 V 3.6913 7.9141 117.7971 65.7413 31.3696 177.7800 65 Q 3.8567 8.0189 116.9766 57.7582 28.6812 178.2918 66 K 3.9546 7.5598 119.3950 59.2332 32.2201 178.7240 67 K 3.9970 7.9878 119.7395 59.9182 32.1391 178.3837 68 A 3.9638 7.6035 119.9905 54.8747 18.3401 179.3666 69 A 4.5104 7.6515 120.1231 55.1263 18.6528 179.8519 70 E 3.8280 9.0467 117.9464 59.3056 29.3291 179.4209 71 A 4.8554 8.1265 121.7020 54.2964 18.5451 179.5859 72 R 3.8440 7.7090 117.1143 59.6694 30.2462 178.2148 73 A 3.2362 7.4026 120.0157 55.3866 17.8655 179.2385 74 D 4.4632 7.8706 116.6806 56.8537 40.6254 178.3943 75 K 4.2549 8.3099 117.6058 57.8775 33.1308 178.2709 76 L 4.2898 8.0066 121.2732 57.2152 41.7575 178.6251 77 K 4.9708 8.3898 119.1336 57.8451 33.0948 176.6106 78 A 4.4555 7.5921 122.5893 51.2586 18.1864 176.9282 79 K 4.2401 8.1407 114.6865 56.5730 34.4471 174.6769 80 G 4.0170 8.4603 102.2846 44.7618 0.0000 174.0031 81 K 4.3525 7.6847 115.1363 55.7426 37.2402 176.4772 82 A 4.5529 8.1170 125.6945 52.3447 21.4827 175.0053 83 F 4.6844 7.3260 108.7324 58.2511 40.8429 173.7397 84 D 4.7195 8.6636 115.0856 52.3685 42.1462 176.1079 85 I 3.6171 8.6527 124.8509 64.0224 38.2649 175.9661 86 N 4.3198 8.4174 116.7108 56.5433 38.2901 176.8217 87 E 4.0139 8.1020 119.4757 58.9207 29.8335 178.3088 88 L 4.1019 7.9294 120.4278 58.0037 42.2070 178.7517 89 I 3.9176 7.7572 118.8838 64.2626 37.1893 179.7778 90 R 3.9306 7.4198 115.9813 55.6346 30.6046 175.3169 *92 E 4.0387 7.8041 117.0747 54.5144 30.4979 173.3857 93 P 4.7876 0.0000 0.0000 63.2988 32.2967 175.8773 94 D 4.4536 9.0345 121.0382 53.0941 42.7006 176.0755 95 R 3.8973 8.5410 127.8154 57.3948 30.4793 177.6833 96 G 3.9745 8.4725 101.5775 45.7431 0.0000 172.6205 97 V 4.2350 8.5651 119.9232 61.1818 32.8740 176.5816 98 T 3.4777 8.2673 118.9344 63.6241 69.9727 174.1681 99 N 4.8837 7.7198 117.8654 50.6953 41.8277 174.6608 100 V 3.4684 7.9734 122.6875 60.2492 32.7585 175.4277 101 R 4.0882 8.7448 126.1279 57.6255 30.7699 176.1570 102 K 4.1426 7.8702 124.9876 57.0965 31.5019 177.2557 103 L 4.9168 8.6760 122.8789 55.2535 41.6986 177.5460 104 N 4.9313 8.0819 115.9654 52.8214 39.1455 174.8397 105 L 3.9739 7.8179 121.8091 54.7466 42.1725 175.3914 106 P 4.0999 0.0000 0.0000 66.1389 31.4143 177.6138 107 H 3.6289 8.1303 117.1066 58.9683 29.6831 177.0641 108 W 3.9793 7.3110 118.6567 59.4016 28.9922 178.5585 109 T 3.4963 7.0129 107.5516 63.8971 67.9910 175.3264 110 R 3.7770 6.4861 117.5095 57.3437 29.7311 177.0640 111 W 4.6101 7.1866 118.4002 56.5237 29.4062 176.3224 112 F 4.5130 7.6665 115.6837 57.1637 39.1972 176.3577 113 G 3.9560 7.5408 110.0386 44.4549 0.0000 174.8778 114 V 3.5695 8.2966 118.7948 65.5155 31.9060 177.0854 115 E 4.3850 8.2111 115.6257 57.5314 30.1598 176.6864 116 H 4.7124 8.2435 116.1362 55.7855 30.7774 173.6347 117 R 5.1000 7.7088 117.3013 55.7849 32.2046 175.1612 118 C 5.1912 9.3811 114.1874 57.7396 33.6912 172.5401 119 L 4.7165 9.1466 121.4730 53.4698 43.3515 175.8816 120 V 4.4606 8.1371 125.6437 60.1398 31.9738 172.7312 121 P 3.8188 0.0000 0.0000 62.6545 31.5972 176.2043 122 V 4.3637 7.0173 120.9683 60.8789 33.3619 173.8596 123 T 4.2378 8.5848 113.7847 62.5660 70.4084 174.7681 124 S 5.1107 7.5868 114.6929 57.0620 66.2810 173.4863 125 F 5.6752 8.9901 116.0962 55.3629 41.3587 173.4951 126 A 4.7441 8.6636 122.2059 50.4149 21.4669 176.0264 127 E 4.6292 8.4219 117.1365 53.7646 34.3921 173.4951 128 P 4.4881 0.0000 0.0000 63.2537 32.1133 176.4143 129 D 5.0307 8.9546 125.5414 51.7872 39.8447 174.5586 130 P 4.2512 0.0000 0.0000 65.4531 31.9290 178.9700 131 A 4.2190 8.0700 119.0649 53.7080 18.1870 177.4305 132 S 4.6047 7.7781 110.1513 57.5405 64.0743 174.0085 133 K 4.0815 8.2517 123.3250 56.1644 31.7485 176.2808 134 Q 4.2929 8.8042 125.5834 58.8499 29.5067 176.1358 135 E 4.5204 7.2151 123.1479 55.8131 35.1376 176.5818 136 G 3.6226 9.1565 104.1393 45.7071 0.0000 173.1376 137 G 3.9756 7.5354 110.2066 43.6705 0.0000 173.7773 138 N 4.3929 8.2944 116.1995 52.5382 39.0778 175.4559 139 V 3.8638 8.2091 122.1538 62.6610 32.1681 174.1410 140 P 4.8129 0.0000 0.0000 62.7672 33.4245 174.4532 141 N 5.5306 9.5207 116.6556 51.3330 42.7220 173.5437 142 A 4.9876 8.3673 122.3238 50.0114 21.8997 175.2247 143 W 4.9244 9.4371 123.4399 55.0665 31.4973 175.3948 144 F 5.2402 8.8309 123.1039 55.8097 41.4549 174.5311 145 A 4.8264 8.4878 122.2702 50.4166 22.6343 177.3788 146 R 3.8168 8.7418 119.4220 59.3554 30.5738 175.5922 147 D 4.4985 7.3059 114.9772 52.6479 41.5234 175.9248 148 E 3.9278 8.7912 117.8447 59.0238 29.4101 178.1868 149 A 4.1388 8.0455 119.4224 51.9385 19.2848 176.7395 150 K 3.7929 7.8933 114.1844 56.5794 29.8940 176.2802 151 S 4.1102 8.0741 113.4483 58.6826 63.6281 175.1023 152 L 3.6877 8.0706 124.9151 55.0047 42.7386 175.9827 *154 F 4.2318 8.2112 118.9381 57.1921 40.4368 174.6812 155 F 4.7957 8.3962 121.2047 55.7967 40.7592 175.2171 156 A 3.2930 8.2982 123.8534 51.5411 18.7358 176.7561 157 G 4.7267 8.8005 109.3407 45.5819 0.0000 171.5201 158 I 5.6054 9.3647 121.6483 59.6124 41.0278 174.3981 159 H 5.4338 8.9318 121.3446 53.7560 31.9775 173.6170 160 V 4.1207 8.3438 118.7191 60.1991 33.8884 172.9056 161 P 4.6548 0.0000 0.0000 63.5643 32.0281 176.7233 162 Q 3.1963 8.8213 118.7621 56.6884 26.5163 173.0586 163 W 4.8920 8.8837 130.2036 55.5544 33.2140 175.2745 164 K 4.9577 7.6086 126.9321 55.6857 33.7384 175.5840 165 S 4.3819 8.6703 118.5208 57.9940 67.2518 174.6401 166 V 4.8719 7.9923 119.9023 60.9232 30.7580 176.4142 167 R 4.6121 8.4855 126.3923 57.7956 30.6224 177.9532 168 K 4.5983 7.7511 116.9486 54.2819 35.7611 177.2132 169 V 3.5935 8.7482 123.8067 64.8568 31.2342 178.4620 170 R 3.8577 7.9846 119.4986 58.9128 30.0935 176.7639 171 D 4.5529 8.2969 116.2878 54.2677 42.1974 178.7149 172 G 3.8360 7.5429 107.1341 45.6353 0.0000 172.1835 173 L 4.8122 8.3915 125.4892 54.4867 43.1446 176.8552 174 T 4.7761 8.8616 115.2958 60.4785 72.9347 172.8313 175 T 5.0339 8.5106 119.6164 62.4726 69.7632 173.8300 176 D 5.0885 9.5347 126.6315 52.3876 45.5226 174.8845 177 D 5.1220 8.7667 121.5984 54.0756 42.2888 176.0146 178 L 5.2765 8.6531 124.1920 53.6710 45.1348 174.6709 179 Y 5.1674 8.4474 115.9782 57.2063 41.7517 173.3153 180 G 4.4026 8.9517 107.3195 45.8915 0.0000 171.6813 181 F 5.5683 7.7703 113.8697 54.7567 41.9511 174.2857 182 L 4.6119 8.9346 120.2245 55.2681 42.6040 176.1904 183 T 4.7781 8.1716 116.4714 61.1369 70.7954 172.1563 184 T 4.5183 7.6950 116.5876 61.3672 70.0818 172.0665 185 D 4.6922 8.6115 121.4386 53.6340 41.4055 175.1670 186 P 4.4050 0.0000 0.0000 62.4219 32.5291 176.0820 187 N 4.8064 8.1894 117.3934 51.9083 39.6026 175.0694 188 D 4.4173 8.8694 117.7325 56.8803 40.6598 178.0419 189 L 4.2630 7.7803 120.2638 57.4159 42.6048 178.1259 190 V 3.8773 7.5985 117.4396 65.3802 31.5395 177.3459 191 K 4.3696 8.0950 121.2256 58.8558 31.7306 176.5267 192 P 4.1120 0.0000 0.0000 65.0821 31.2037 177.1160 193 I 4.2027 7.1505 116.6966 62.5407 38.6251 175.5566 194 H 4.6926 9.0037 121.1586 54.7431 31.7225 172.9925 195 E 4.1694 8.6520 128.0520 57.5438 30.2929 177.0129 196 K 3.9039 7.9857 119.1394 57.6173 32.7337 175.8952 197 A 4.2858 7.3849 120.0123 51.9046 22.9072 173.2706 *199 P 4.1350 0.0000 0.0000 63.1505 32.8660 177.1423 200 V 3.8440 8.2471 121.9141 62.7988 32.6129 174.7854 201 L 4.9487 8.3299 126.6076 52.8657 45.0757 175.5426 202 L 4.6333 8.6952 123.4078 53.2088 42.7359 176.4866 203 L 4.5343 9.6959 123.3202 54.5778 43.9858 177.1312 204 T 4.8385 7.6970 108.5988 59.5685 72.7317 175.0083 205 R 4.4661 8.7805 121.8815 59.6253 30.0498 178.6606 206 E 4.0910 8.2653 117.3100 59.3359 29.7594 178.9023 207 E 4.0529 8.2282 119.8618 59.3076 29.3328 179.2224 208 T 3.9126 7.7452 108.8981 64.8958 68.7705 176.0678 209 E 4.1667 8.0552 120.4107 59.2814 29.3729 178.9926 210 I 3.9383 7.6535 119.9591 63.8546 36.9425 177.5273 211 W 4.1987 7.9484 127.8281 57.9691 31.2127 177.7099 *213 R 4.2728 7.9975 115.4946 55.4544 31.5825 175.9602 214 A 4.0127 7.4089 118.9827 51.8723 19.0182 176.3192 215 P 4.4811 0.0000 0.0000 62.2488 33.3703 177.2964 216 W 4.3682 8.8717 128.6457 61.2824 30.2944 177.6989 217 D 4.2478 8.2344 116.5125 57.3005 40.3306 178.1839 218 E 4.0263 7.8532 118.5847 58.7506 30.0738 177.7992 219 A 3.9745 8.1122 121.2730 55.1288 18.2707 179.2857 220 K 3.2341 7.5511 116.2645 58.8430 32.1012 178.2408 221 H 4.4693 7.7166 116.8327 57.3146 28.8805 176.3499 222 L 4.2539 7.6592 119.8668 55.4129 42.6132 177.1533 223 A 4.3302 7.5388 124.0198 52.0971 17.3207 176.9965 224 R 4.7319 7.2849 116.9374 53.3756 32.9171 174.0804 225 P 4.3898 0.0000 0.0000 62.4332 32.0938 176.4026 226 L 4.1980 8.1276 120.3897 53.7237 42.4147 175.2413 227 P 4.4515 0.0000 0.0000 62.7275 31.9361 177.4741 228 N 4.3721 8.7191 117.5758 56.2627 38.5444 175.9788 229 D 4.7107 7.9872 114.4735 53.1743 39.8794 177.0411 230 A 4.1186 7.7798 124.1487 54.4055 18.5559 177.2340 231 L 5.2529 7.6851 113.6613 52.9540 46.0630 175.3141 232 I 4.7048 8.6033 112.3215 59.7854 41.7553 174.7763 233 I 3.8405 8.1491 123.5976 59.6925 36.1859 175.4562 234 L 4.1733 8.5292 130.7337 57.8710 42.6904 176.5587 235 S 4.5727 7.3359 110.5721 57.8758 66.0347 175.2081 236 R 4.9559 8.6735 118.5962 54.7573 32.4963 174.9136 237 E 4.9860 9.0356 123.5932 53.4912 33.7037 174.4841 238 P 4.8216 0.0000 0.0000 62.0166 32.5411 174.9470 239 Y 4.1375 8.3477 120.0869 59.0209 39.0196 176.0208 240 G 4.0358 8.4991 115.1576 45.1026 0.0000 173.3979 241 S 4.1752 7.6481 114.7739 58.3295 62.6667 173.1712 242 S 5.1267 8.6139 120.8943 55.3295 65.3049 173.2757 243 I 4.0095 8.1694 117.9611 61.7352 38.5042 176.1037 244 V 3.8380 7.3943 124.4849 61.6230 31.4496 175.6134 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 2 C 8.34 4.56 0.00 3.30 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 3 N 8.29 4.66 0.00 2.66 2.57 0.00 0.00 6.64 6.97 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 4 L 8.15 4.81 0.00 1.76 1.42 1.18 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 5 Y 8.56 5.49 0.00 3.44 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 6 R 9.69 5.39 0.00 1.81 1.86 0.00 2.23 0.00 0.00 2.88 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.68 0.00 *8 E 8.71 4.27 0.00 1.93 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 2.16 2.26 0.00 9 D 7.87 4.60 0.00 2.52 2.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 K 8.71 4.10 0.00 1.83 1.91 0.00 1.92 0.00 0.00 1.66 0.00 0.00 3.04 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.47 1.53 7.81 11 D 7.87 4.79 0.00 2.68 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 W 8.10 4.87 0.00 3.82 3.49 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 0.00 0.00 0.00 0.00 13 V 6.60 2.79 1.65 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 0.64 0.00 0.00 -0.30 0.00 0.00 14 S 8.04 4.05 0.00 3.91 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 K 8.14 4.42 0.00 1.42 1.67 0.00 1.59 0.00 0.00 1.86 0.00 0.00 2.99 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.44 1.23 7.81 16 W 8.14 5.05 0.00 3.60 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 17 A 7.97 4.80 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 0.00 0.00 0.00 0.00 0.00 0.00 18 Q 8.44 3.86 0.00 2.11 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 7.25 0.00 0.00 0.00 0.00 0.00 2.29 2.29 0.00 19 D 8.03 4.57 0.00 2.81 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 20 A 7.39 4.64 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 21 E 8.89 4.15 0.00 2.03 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 2.24 2.23 0.00 22 S 8.43 4.70 0.00 3.85 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 23 L 7.64 4.94 0.00 1.71 1.66 0.93 0.90 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 24 I 7.14 4.49 1.67 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 1.57 0.38 0.87 0.00 0.00 25 N 8.36 4.66 0.00 2.80 2.91 0.00 0.00 6.88 7.85 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 26 L 7.74 4.39 0.00 1.68 1.72 1.38 1.17 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 *28 P 0.00 4.46 0.00 2.22 2.20 0.00 3.68 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.93 0.00 29 A 7.21 4.70 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 Y 8.27 4.74 0.00 2.88 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 31 Q 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 1.13 0.00 0.00 42 R 8.78 5.07 0.00 1.34 1.75 0.00 2.51 0.00 0.00 2.99 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.47 0.00 43 N 8.53 5.26 0.00 2.78 2.80 0.00 0.00 6.82 7.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 T 8.25 4.63 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 1.25 0.00 0.00 45 A 8.56 4.09 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 46 D 8.02 4.44 0.00 2.69 2.75 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 47 G 7.76 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 48 K 8.04 4.32 0.00 1.84 1.79 0.00 1.61 0.00 0.00 1.82 0.00 0.00 3.06 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.53 1.46 7.81 49 K 8.43 5.10 0.00 1.67 1.68 0.00 1.63 0.00 0.00 1.84 0.00 0.00 2.83 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.58 1.43 7.81 50 Q 9.07 4.82 0.00 1.94 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.77 0.00 0.00 0.00 0.00 0.00 2.26 2.26 0.00 51 L 8.39 4.94 0.00 1.71 1.51 0.64 0.91 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 52 V 8.45 4.49 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 0.63 0.00 0.00 0.92 0.00 0.00 53 H 8.70 5.35 0.00 3.09 3.24 0.00 5.69 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 A 8.52 4.94 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 R 9.52 4.43 0.00 2.00 1.92 0.00 3.18 0.00 0.00 3.17 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.79 0.00 56 W 9.40 3.61 0.00 3.37 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 57 G 8.23 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 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 75 K 8.31 4.25 0.00 1.84 1.89 0.00 1.58 0.00 0.00 1.67 0.00 0.00 3.02 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.59 1.44 7.81 76 L 8.01 4.29 0.00 1.87 1.98 0.84 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 77 K 8.39 4.97 0.00 2.33 2.01 0.00 1.57 0.00 0.00 2.38 0.00 0.00 3.27 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.49 1.42 7.81 78 A 7.59 4.46 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 79 K 8.14 4.24 0.00 1.74 1.80 0.00 1.94 0.00 0.00 1.72 0.00 0.00 3.01 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.23 1.32 7.81 80 G 8.46 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 K 7.68 4.35 0.00 1.88 1.73 0.00 1.70 0.00 0.00 1.67 0.00 0.00 3.04 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.35 1.52 7.81 82 A 8.12 4.55 1.10 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 0.00 0.00 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0.00 0.00 109 T 7.01 3.50 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 110 R 6.49 3.78 0.00 1.23 1.54 0.00 2.21 0.00 0.00 2.25 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.50 0.00 111 W 7.19 4.61 0.00 3.19 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 F 7.67 4.51 0.00 2.34 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 G 7.54 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 0.00 114 V 8.30 3.57 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.97 0.00 0.00 115 E 8.21 4.38 0.00 2.17 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.33 0.00 116 H 8.24 4.71 0.00 3.17 3.35 0.00 5.60 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 R 7.71 5.10 0.00 1.71 1.67 0.00 2.21 0.00 0.00 2.55 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.46 0.00 118 C 9.38 5.19 0.00 3.15 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 L 9.15 4.72 0.00 1.51 1.36 1.00 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 120 V 8.14 4.46 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 0.96 0.00 0.00 1.09 0.00 0.00 121 P 0.00 3.82 0.00 0.92 0.99 0.00 3.77 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.92 0.00 122 V 7.02 4.36 0.99 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 -0.93 0.00 0.00 0.78 0.00 0.00 123 T 8.58 4.24 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 124 S 7.59 5.11 0.00 4.19 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 0.00 125 F 8.99 5.68 0.00 3.34 3.42 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 0.00 126 A 8.66 4.74 -0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 E 8.42 4.63 0.00 2.13 1.74 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 2.48 2.42 0.00 128 P 0.00 4.49 0.00 2.02 2.08 0.00 3.23 0.00 0.00 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.09 0.00 129 D 8.95 5.03 0.00 2.75 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 0.00 130 P 0.00 4.25 0.00 2.28 2.33 0.00 3.87 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.01 0.00 131 A 8.07 4.22 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 0.00 132 S 7.78 4.60 0.00 4.12 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 0.00 133 K 8.25 4.08 0.00 1.80 1.80 0.00 2.02 0.00 0.00 1.77 0.00 0.00 2.99 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.61 1.40 7.81 134 Q 8.80 4.29 0.00 2.21 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.58 0.00 0.00 0.00 0.00 0.00 2.36 2.39 0.00 135 E 7.22 4.52 0.00 2.01 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 0.00 0.00 0.00 2.22 2.30 0.00 136 G 9.16 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 G 7.54 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 0.00 0.00 0.00 138 N 8.29 4.39 0.00 2.73 2.44 0.00 0.00 6.75 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 0.00 139 V 8.21 3.86 2.21 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 0.87 0.00 0.00 0.96 0.00 0.00 140 P 0.00 4.81 0.00 2.21 2.24 0.00 3.74 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.18 0.00 141 N 9.52 5.53 0.00 2.62 2.35 0.00 0.00 7.10 7.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 A 8.37 4.99 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 W 9.44 4.92 0.00 3.12 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 0.00 144 F 8.83 5.24 0.00 1.51 2.54 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 0.00 145 A 8.49 4.83 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 146 R 8.74 3.82 0.00 1.72 1.93 0.00 3.48 0.00 0.00 3.26 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.67 0.00 147 D 7.31 4.50 0.00 2.87 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 0.00 148 E 8.79 3.93 0.00 1.96 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.29 0.00 149 A 8.05 4.14 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 0.00 150 K 7.89 3.79 0.00 1.88 1.84 0.00 1.66 0.00 0.00 1.62 0.00 0.00 2.93 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.33 1.50 7.81 151 S 8.07 4.11 0.00 3.84 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 0.00 152 L 8.07 3.69 0.00 1.66 1.45 0.24 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 *154 F 8.21 4.23 0.00 2.71 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 0.00 155 F 8.40 4.80 0.00 2.28 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 156 A 8.30 3.29 -0.05 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 0.00 0.00 157 G 8.80 4.73 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 0.00 0.00 0.00 158 I 9.36 5.61 1.98 0.00 0.00 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 1.60 1.23 1.07 0.00 0.00 159 H 8.93 5.43 0.00 3.34 3.33 0.00 5.70 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 160 V 8.34 4.12 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.00 0.00 -0.61 0.00 0.00 161 P 0.00 4.65 0.00 2.18 2.11 0.00 3.87 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.00 0.00 162 Q 8.82 3.20 0.00 2.17 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.66 0.00 0.00 0.00 0.00 0.00 2.38 2.46 0.00 163 W 8.88 4.89 0.00 3.37 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 0.00 164 K 7.61 4.96 0.00 1.65 1.67 0.00 1.45 0.00 0.00 1.53 0.00 0.00 2.13 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.94 1.16 7.81 165 S 8.67 4.38 0.00 4.00 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 0.00 166 V 7.99 4.87 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 1.47 0.00 0.00 0.94 0.00 0.00 167 R 8.49 4.61 0.00 1.88 2.01 0.00 3.67 0.00 0.00 4.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.62 0.00 168 K 7.75 4.60 0.00 1.77 1.66 0.00 1.71 0.00 0.00 1.89 0.00 0.00 2.96 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.43 1.43 7.81 169 V 8.75 3.59 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 0.79 0.00 0.00 0.94 0.00 0.00 170 R 7.98 3.86 0.00 1.80 2.01 0.00 3.24 0.00 0.00 3.24 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.66 0.00 171 D 8.30 4.55 0.00 2.73 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 0.00 172 G 7.54 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 0.00 173 L 8.39 4.81 0.00 1.66 1.57 0.89 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 174 T 8.86 4.78 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 0.00 175 T 8.51 5.03 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 1.22 0.00 0.00 176 D 9.53 5.09 0.00 2.63 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177 D 8.77 5.12 0.00 2.69 2.68 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 0.00 178 L 8.65 5.28 0.00 1.42 1.65 0.82 0.98 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 0.00 179 Y 8.45 5.17 0.00 3.15 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 0.00 180 G 8.95 4.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 181 F 7.77 5.57 0.00 2.96 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 0.00 182 L 8.93 4.61 0.00 1.62 1.63 1.36 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 183 T 8.17 4.78 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 1.17 0.00 0.00 184 T 7.69 4.52 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 185 D 8.61 4.69 0.00 2.59 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 0.00 186 P 0.00 4.41 0.00 2.27 1.93 0.00 3.74 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 1.97 2.08 0.00 187 N 8.19 4.81 0.00 3.14 3.02 0.00 0.00 6.10 8.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 188 D 8.87 4.42 0.00 2.78 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 0.00 189 L 7.78 4.26 0.00 1.69 1.76 1.02 1.11 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 0.00 190 V 7.60 3.88 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 0.90 0.00 0.00 0.52 0.00 0.00 191 K 8.09 4.37 0.00 1.93 1.86 0.00 1.75 0.00 0.00 1.74 0.00 0.00 2.93 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.46 1.39 7.81 192 P 0.00 4.11 0.00 2.12 2.15 0.00 3.75 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.22 0.00 193 I 7.15 4.20 2.21 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.67 1.14 0.00 0.00 194 H 9.00 4.69 0.00 3.10 3.14 0.00 5.57 0.00 0.00 0.00 0.00 6.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 195 E 8.65 4.17 0.00 1.95 1.91 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 2.23 2.27 0.00 196 K 7.99 3.90 0.00 1.53 1.72 0.00 1.77 0.00 0.00 1.67 0.00 0.00 3.10 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.42 1.50 7.81 197 A 7.38 4.29 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 *199 P 0.00 4.13 0.00 1.80 1.77 0.00 3.26 0.00 0.00 3.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.63 0.00 200 V 8.25 3.84 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 0.79 0.00 0.00 0.87 0.00 0.00 201 L 8.33 4.95 0.00 1.43 1.37 0.93 0.61 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 0.00 202 L 8.70 4.63 0.00 1.38 1.51 0.63 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 203 L 9.70 4.53 0.00 1.53 1.69 0.85 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 204 T 7.70 4.84 4.57 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 1.26 0.00 0.00 205 R 8.78 4.47 0.00 2.17 2.11 0.00 3.13 0.00 0.00 3.31 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.89 0.00 206 E 8.27 4.09 0.00 2.24 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.38 0.00 207 E 8.23 4.05 0.00 2.26 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 2.35 2.34 0.00 208 T 7.75 3.91 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 209 E 8.06 4.17 0.00 2.19 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.54 0.00 210 I 7.65 3.94 2.10 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 1.77 1.45 1.02 0.00 0.00 211 W 7.95 4.20 0.00 3.47 3.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *213 R 8.00 4.27 0.00 1.98 2.01 0.00 3.32 0.00 0.00 3.24 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.66 0.00 214 A 7.41 4.01 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 0.00 215 P 0.00 4.48 0.00 2.31 2.22 0.00 3.72 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 2.06 2.03 0.00 216 W 8.87 4.37 0.00 3.39 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 0.00 217 D 8.23 4.25 0.00 2.65 2.68 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 0.00 218 E 7.85 4.03 0.00 1.99 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 2.33 2.37 0.00 219 A 8.11 3.97 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 0.00 220 K 7.55 3.23 0.00 0.79 0.74 0.00 0.89 0.00 0.00 0.84 0.00 0.00 2.81 0.00 0.00 2.74 0.00 0.00 0.00 0.00 0.79 0.84 7.81 221 H 7.72 4.47 0.00 3.19 3.30 0.00 5.67 0.00 0.00 0.00 0.00 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 222 L 7.66 4.25 0.00 1.77 1.68 1.09 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 223 A 7.54 4.33 1.27 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 0.00 0.00 0.00 224 R 7.28 4.73 0.00 1.86 1.85 0.00 3.02 0.00 0.00 3.25 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.53 0.00 225 P 0.00 4.39 0.00 2.18 2.36 0.00 3.74 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.97 0.00 226 L 8.13 4.20 0.00 1.66 1.64 0.92 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 227 P 0.00 4.45 0.00 2.18 1.99 0.00 3.60 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 2.12 2.12 0.00 228 N 8.72 4.37 0.00 2.73 2.91 0.00 0.00 6.92 8.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 229 D 7.99 4.71 0.00 2.77 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 230 A 7.78 4.12 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 0.00 231 L 7.69 5.25 0.00 1.61 1.79 1.11 0.86 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 0.00 232 I 8.60 4.70 1.86 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 1.40 0.71 0.92 0.00 0.00 233 I 8.15 3.84 1.77 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 0.76 0.56 0.66 0.00 0.00 234 L 8.53 4.17 0.00 1.63 1.66 0.86 0.92 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 0.00 235 S 7.34 4.57 0.00 3.83 3.83 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 0.00 236 R 8.67 4.96 0.00 1.67 1.89 0.00 3.14 0.00 0.00 3.33 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.57 0.00 237 E 9.04 4.99 0.00 2.16 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 2.17 2.26 0.00 238 P 0.00 4.82 0.00 2.30 2.26 0.00 3.75 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 2.13 1.99 0.00 239 Y 8.35 4.14 0.00 3.22 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 0.00 240 G 8.50 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 0.00 0.00 0.00 241 S 7.65 4.18 0.00 3.97 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 242 S 8.61 5.13 0.00 3.82 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 0.00 243 I 8.17 4.01 1.75 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 1.34 0.67 0.64 0.00 0.00 244 V 7.39 3.84 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 0.66 0.00 0.00 0.88 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.