NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 G 3.7317 8.3544 109.7334 45.1141 0.0000 172.4148 *22 K 4.0072 8.2545 119.1637 55.9701 32.8420 174.9727 23 D 4.5143 8.7463 128.5174 55.0915 41.8134 176.8598 24 N 5.0196 8.4726 120.0587 52.2744 38.8868 172.2527 25 T 4.7993 7.8463 116.0373 62.3255 70.9216 175.1235 26 K 4.7142 8.9310 125.2854 54.5800 36.4419 174.9246 27 V 4.8726 8.3913 121.0229 61.4250 34.0383 174.1093 28 I 4.8992 8.7778 128.9188 59.4497 39.6616 174.8869 29 A 4.7102 8.9994 130.3471 51.3959 18.4646 175.8165 30 H 4.3795 9.2204 122.7924 57.9703 31.0852 175.7929 31 R 3.8085 9.3294 123.2586 56.2071 28.0931 177.6077 32 G 4.5830 7.6198 104.4566 44.6999 0.0000 174.1202 33 Y 4.6804 8.6946 120.4237 56.5844 37.1102 175.1512 34 W 4.8661 8.3956 122.5107 56.0978 30.2556 177.7306 35 K 3.9460 7.0470 120.5401 54.2069 30.4759 175.7170 36 T 4.2490 6.9304 113.0152 60.1204 70.5890 171.8244 37 E 3.8894 8.5985 126.6312 58.2082 29.6520 177.7053 38 G 3.8701 8.9019 113.4062 45.6486 0.0000 172.8667 39 S 4.6116 7.6368 114.5621 57.1388 64.1086 172.1261 40 A 4.8088 8.0379 122.8075 50.7285 21.4806 176.2874 41 Q 3.8193 8.4448 119.6595 57.4749 29.4653 176.5557 42 N 4.2191 8.9747 118.2719 54.8220 36.9542 173.8977 43 S 5.2595 7.9133 111.0622 56.1003 67.4032 173.8535 44 I 3.4252 8.7313 123.0643 64.5166 36.6914 178.8499 45 R 4.0424 8.3316 119.7997 59.4341 29.8202 178.7476 46 S 4.7011 8.3851 115.6490 60.7424 63.1073 176.2597 47 L 3.9493 7.9173 123.8642 57.9969 41.7538 178.8025 48 E 3.9278 8.3188 118.7011 59.6200 29.4150 179.6914 49 R 4.0001 8.4798 118.2299 58.9748 30.0968 178.8069 50 A 4.0693 8.1910 120.2897 55.3157 18.4120 179.4232 51 S 3.9953 8.0234 111.3448 61.5636 62.2735 175.8935 52 E 3.9893 8.3403 121.3399 59.1767 29.4948 178.1818 53 I 4.0796 7.9452 110.4298 60.8403 38.0505 175.9575 54 G 3.8082 8.0744 108.4518 46.5304 0.0000 174.1202 55 A 4.1744 7.7226 121.7835 51.7084 19.2973 177.9623 56 Y 4.3213 9.0380 122.8168 60.4785 39.6527 176.3066 57 G 4.4568 8.4845 104.2862 44.4893 0.0000 170.9984 58 S 5.2180 8.9065 114.9766 56.3176 64.9680 172.5203 59 E 5.4034 9.3761 128.5691 54.6947 31.4381 174.6415 60 F 5.5110 7.6079 118.3834 56.0853 41.8018 172.2042 61 D 5.2916 8.8099 119.5648 52.5905 43.5427 175.3097 62 V 4.9205 8.7330 122.8710 61.4104 34.5318 173.9806 63 H 5.3612 9.1954 123.8839 53.9368 32.8410 172.3232 64 L 5.0659 8.6820 122.9808 53.6888 43.6462 176.4856 65 T 4.5450 9.0505 117.1455 60.8835 69.7781 175.1173 66 A 3.9793 8.4928 125.6001 55.3720 18.2503 178.3483 67 D 4.7686 8.0440 112.5598 53.3382 39.7017 175.8029 68 N 4.2127 8.0422 114.6045 55.1278 36.5412 174.0267 69 V 4.2496 7.6965 117.8376 61.4042 33.6574 174.4543 70 L 4.9875 8.3739 127.6506 54.2888 43.2327 176.1554 71 V 4.8961 8.9697 116.1934 59.5482 36.6433 174.6386 72 V 4.7075 7.8647 121.8976 62.0405 32.7386 174.2273 73 Y 4.3519 8.3174 126.0222 57.5895 41.8181 173.5070 74 H 4.3018 8.2159 126.4927 59.2557 30.4349 175.5109 75 D 4.4492 7.2072 118.0374 53.8875 41.5805 176.6523 76 N 4.5319 8.6639 118.4002 55.2849 39.0318 174.8848 77 D 5.3148 7.9786 117.6929 52.1498 44.2260 174.3835 78 I 4.2882 8.3871 123.1470 59.9420 39.8218 175.3611 79 Q 3.3962 9.7741 128.4640 57.1339 26.0533 174.9830 80 G 3.9095 8.4220 103.5754 45.3547 0.0000 173.6024 81 K 4.3594 7.8906 120.4550 54.6035 33.7184 174.9888 82 H 5.1114 8.5090 123.4231 54.4314 30.4075 175.5918 83 I 3.6162 8.3507 129.1564 64.6408 37.3541 178.6995 84 Q 4.5748 7.9665 117.6127 57.1877 28.7358 177.2778 85 S 4.7324 7.6968 110.4684 58.0014 64.0531 173.6704 86 C 4.8200 7.6275 119.5912 58.2401 29.9208 173.4946 87 T 4.6343 8.3919 112.6552 61.2732 69.5456 174.7918 88 Y 4.2583 9.4227 124.2794 61.0252 38.4509 178.0334 89 D 4.1260 8.0899 117.5338 57.5808 41.3057 177.8883 90 E 4.0061 7.7487 117.8961 58.6610 29.7182 178.3996 91 L 4.3414 7.5647 117.9160 55.0722 42.2074 178.8065 92 K 3.6633 7.5437 117.2827 58.9996 32.6075 177.2854 93 D 4.6916 7.6290 116.5701 53.7212 41.6196 176.4820 94 L 4.1004 7.6849 121.0823 54.7703 42.1081 176.1581 95 Q 5.0750 8.2650 120.5306 54.1139 31.2076 175.6794 96 L 4.4354 8.8751 121.9045 53.6025 42.8113 178.2957 97 S 4.1454 8.6671 114.0562 60.9349 62.7492 174.8301 98 N 4.7273 8.2981 116.6224 52.3141 37.1926 175.9172 99 G 4.0149 8.2777 107.6207 45.0138 0.0000 174.3270 100 E 4.2340 7.9818 119.1419 56.2353 30.6459 176.8822 101 K 4.5956 8.5354 121.3999 55.8026 33.2884 176.5811 102 L 3.9328 8.3046 124.7794 55.6378 42.5089 175.2136 103 P 4.9403 0.0000 0.0000 62.2816 32.9351 176.3912 104 T 4.3307 8.7898 113.8125 60.9672 69.9513 175.4605 105 L 3.8788 8.6614 125.0840 58.2394 41.9306 178.8792 106 E 3.9280 8.2068 118.7589 59.6605 29.5126 178.6967 107 Q 3.9729 8.2086 117.8455 59.1089 28.7394 178.3408 108 Y 3.7232 7.9404 120.4573 60.7133 38.7762 178.1786 109 L 4.0101 8.4605 120.3586 57.4040 41.4654 179.3198 110 K 3.8838 8.1037 119.3639 59.4450 32.2800 178.5920 111 R 3.9230 7.9395 118.7708 59.3524 30.0173 178.3232 112 A 3.8939 7.9615 120.6155 54.8868 18.0555 179.3410 113 K 3.8267 7.9827 117.6639 59.7297 32.3228 178.7240 114 K 4.3332 7.7250 116.7788 57.1661 33.0587 177.6270 115 L 4.4402 7.4665 120.7920 53.1238 40.3187 177.0804 116 K 3.9882 8.1912 123.0723 58.7360 32.4949 178.2685 117 N 4.5252 8.1011 114.1515 53.7352 37.7254 174.5010 118 I 4.4740 6.9148 118.8969 58.8949 40.7656 174.4907 119 R 4.1620 8.2347 127.7897 55.9728 31.5188 174.9935 120 L 4.8976 8.9344 126.4315 53.6720 43.6124 175.8694 121 I 4.3126 8.6346 126.9475 59.8183 38.1244 174.6409 122 F 3.5506 8.7601 131.4225 56.1311 40.4338 174.2264 123 E 5.2337 8.5200 129.6387 54.5562 30.5330 174.9264 124 L 4.8248 8.7957 130.2606 54.2836 42.7848 176.6446 125 K 4.3158 8.8529 126.5513 56.1334 32.9795 177.0254 126 S 4.3753 8.6388 117.5042 58.7851 62.8485 173.6316 127 H 5.4155 9.4974 125.0455 53.5224 30.5832 174.4468 128 D 4.6437 8.5391 118.5225 54.9241 40.0149 176.4729 129 T 4.7090 7.4054 109.8055 58.7598 73.0780 172.5588 130 P 4.2428 0.0000 0.0000 65.9116 31.3294 178.7529 131 E 3.9376 8.1706 116.8189 59.4952 29.2863 179.3425 132 R 3.8780 8.4746 119.1285 59.3456 30.1346 178.2089 133 N 4.2500 8.3206 116.4145 56.3843 38.4612 177.5559 134 R 3.7458 8.0647 119.3519 59.2770 30.1297 178.7993 135 D 4.2697 8.2120 118.5128 57.3542 40.7847 178.8079 136 A 3.9076 8.1912 121.2861 54.8772 18.2767 179.6331 137 A 3.2014 7.8048 119.3632 54.8625 18.3172 179.6585 138 R 3.6897 7.9648 117.6210 59.7869 29.9191 178.8136 139 L 4.0497 7.7747 117.1470 57.6242 41.6018 179.4314 140 S 4.4894 8.0395 114.6744 61.7504 63.0734 176.5407 141 V 3.8910 7.9434 120.9168 65.9557 31.1106 178.3517 142 Q 4.2812 8.0073 113.9633 56.8601 28.1971 178.2180 *144 V 4.0792 7.7051 122.2196 62.9698 33.3930 177.4826 145 K 3.9589 8.4427 120.0432 59.5354 32.1261 180.5327 146 R 4.2034 7.7826 115.7841 55.7672 28.3702 176.7276 *148 K 4.1877 7.8264 112.9355 58.1555 33.7330 176.6222 149 L 4.7634 8.0256 114.7421 54.3081 43.2328 179.0363 150 A 4.0477 8.1712 124.0850 55.1281 18.4622 180.0043 151 K 4.1031 8.0987 114.1450 58.8708 32.4462 177.7314 152 R 4.5638 8.0623 115.8170 55.8936 31.7829 175.2832 153 T 4.8971 7.7748 116.3143 61.8083 70.6079 173.1572 154 D 4.7780 8.7029 126.6820 52.6235 43.7241 174.9904 155 Y 5.0915 8.4165 120.4468 56.2643 40.6585 174.8611 156 I 5.4064 8.4768 115.3349 58.6722 41.7121 173.9604 157 S 4.8721 8.3084 115.6822 57.6489 65.0996 175.7406 158 F 4.0153 9.1373 124.2119 59.6840 39.3458 174.9185 159 N 4.8848 8.2003 119.4237 52.3709 41.2815 174.1879 *161 D 4.5292 8.5211 115.2956 54.5826 43.1215 177.8902 162 A 3.7471 8.6755 120.8438 55.3346 18.3233 179.2972 163 C 4.2353 8.1933 115.1969 63.2201 28.2088 176.6885 164 K 3.7933 7.9542 119.3394 59.3353 31.5646 178.9170 165 E 3.7780 7.9630 119.3412 59.0839 29.4310 178.8007 166 F 4.1148 7.8765 117.8824 60.5461 38.6915 177.6263 167 I 3.6199 7.6186 118.3324 64.3506 36.9698 178.1816 168 R 3.9788 7.8348 118.2520 59.5262 30.0292 178.2958 169 L 4.2289 7.9555 117.7118 56.4397 43.2613 177.2511 170 C 4.8973 8.2938 116.2914 56.9352 28.2752 172.8609 171 P 4.3766 0.0000 0.0000 64.8074 31.4249 178.2399 172 K 4.3459 7.8976 116.2375 56.3950 32.6710 176.5004 173 S 4.5785 7.6670 115.5496 57.4312 64.1124 173.3599 174 E 4.3554 8.3776 121.6637 56.1934 30.8832 176.0891 175 V 4.8834 8.7870 123.7255 61.3977 34.9729 174.2013 176 S 6.0199 9.2385 123.6460 56.0718 66.6954 172.6154 177 Y 5.0323 8.4849 124.0967 57.2659 39.6622 175.6855 178 L 5.2335 8.1005 124.8639 55.1278 42.1832 177.4417 179 N 4.4538 6.6419 115.9925 54.3859 39.1632 175.6158 180 G 2.7185 7.5831 105.2953 44.5959 0.0000 173.4171 181 E 4.5558 7.8184 115.5663 55.9838 30.8661 175.6508 182 L 4.7909 7.4264 119.3505 52.7680 43.5545 176.6321 183 S 2.7900 8.8241 117.9393 56.7718 63.8845 174.0598 184 P 4.1652 0.0000 0.0000 62.7047 30.4127 178.6516 *186 E 4.2630 8.3768 119.3380 56.5193 31.6580 178.4510 187 L 3.8749 7.9943 118.8541 57.5854 41.5681 179.4361 188 K 3.9512 8.5058 119.9695 59.5566 31.9014 178.4001 189 E 3.9830 8.1160 118.0369 59.1027 29.6944 177.8943 190 L 4.3247 7.5596 116.0257 55.1338 41.9023 177.7646 191 G 3.8867 7.9210 107.4359 45.3519 0.0000 173.9789 192 F 4.2032 8.0036 117.9091 57.6339 39.2749 175.4361 193 T 4.4826 8.2672 112.7847 61.8254 69.9435 173.8954 194 G 4.2034 7.7213 108.6190 45.9947 0.0000 171.9806 195 L 4.7977 8.2005 119.9575 54.0071 43.6766 175.4970 196 D 5.4256 8.8428 119.6822 52.8348 42.5756 173.1332 197 Y 5.5814 8.9925 120.9518 55.3927 42.2061 174.6543 198 H 2.9806 8.2622 121.4023 55.6921 30.6060 175.7176 199 Y 4.1372 7.5414 124.3738 60.5464 37.4352 179.3801 200 K 4.1365 6.8239 120.7002 58.3682 32.0541 179.3133 201 V 3.5394 7.4767 118.4787 66.0615 30.9397 178.1616 202 L 4.1045 7.8776 118.1840 57.6354 41.3430 179.3013 203 Q 4.0009 8.3504 118.4424 59.1814 28.4660 179.0463 204 S 4.1866 8.2972 115.2448 60.1681 64.3644 174.4276 205 H 4.4291 7.8440 118.8214 52.9117 28.1316 172.4436 206 P 4.5632 0.0000 0.0000 64.1359 32.0788 177.9435 207 D 4.6988 7.8580 118.1408 55.0514 41.7191 178.2676 208 W 4.5115 8.2250 120.3282 59.5844 29.0235 178.4760 209 V 3.6213 7.9247 117.9853 65.7833 31.0617 177.7157 210 K 3.9097 8.0867 118.8509 59.7789 32.0033 178.0784 211 D 4.4003 8.2514 119.0056 57.6795 40.4975 178.6769 212 C 4.0385 7.9491 116.0828 62.5890 28.4302 175.6478 213 K 3.9836 7.8491 120.6996 59.7266 31.5605 178.8517 214 V 3.6221 7.6688 116.8555 65.8783 31.5373 177.1449 215 L 4.3242 8.0843 115.8708 53.8481 42.9950 176.2553 216 G 3.5823 7.5507 108.5657 45.9707 0.0000 173.2179 *218 T 4.4698 7.2408 111.0291 61.7966 71.4907 174.1720 219 S 5.2347 9.1701 117.7821 56.6706 65.8341 172.4446 220 N 5.9293 9.3966 121.4613 50.6411 42.7940 173.1520 221 V 5.3163 8.5314 123.1554 59.7543 35.2263 174.2072 222 W 5.7143 8.5447 118.9107 55.2731 32.2747 174.1068 223 T 4.9568 9.0101 117.6369 62.3967 69.2795 174.4641 224 V 4.1371 8.7592 128.4925 61.6670 31.7611 174.9827 225 D 4.8218 8.6743 127.2494 54.3847 43.5821 176.2949 226 D 4.5019 7.7735 119.6377 52.8876 41.8434 174.9778 227 P 4.3133 0.0000 0.0000 65.5347 31.8862 177.6859 228 K 4.0385 8.0804 118.9952 59.3609 32.2402 179.2773 229 L 4.2009 7.0843 117.3368 55.2718 41.3526 177.5556 *231 E 4.3433 8.3681 117.9218 56.0437 31.1522 178.1090 232 E 3.9105 8.0872 114.2606 57.6116 29.4921 177.2776 *234 I 4.2322 7.7837 118.6192 61.4188 38.7774 178.2913 235 D 4.3676 8.1603 118.8012 54.6287 40.1386 177.3642 *237 G 3.8155 8.0635 105.3456 45.0133 0.0000 174.1876 238 V 4.1239 7.7571 111.9415 60.8595 32.2094 176.2612 239 D 4.4172 8.5367 123.6286 56.1810 41.7590 176.3287 240 F 5.5352 8.3069 115.6082 55.6564 43.6296 174.1495 241 I 4.6164 8.7402 122.6189 59.9547 39.9229 174.5934 242 T 5.0363 9.1608 124.7403 62.5635 70.1753 173.8763 243 T 5.0100 8.8566 120.3410 60.8391 71.1343 174.0258 244 D 4.7650 9.5476 125.8643 55.2645 41.8956 176.8602 245 L 4.7922 7.9769 119.5770 52.1363 42.0653 175.4182 246 P 4.1692 0.0000 0.0000 65.9915 31.6539 178.5352 247 E 4.1570 7.5909 119.0894 58.4780 29.3761 178.9512 248 E 3.9313 8.0366 118.2312 59.7816 29.6084 179.3115 249 T 3.8782 7.5793 115.6323 66.6941 68.1261 176.7056 250 Q 3.9860 8.1420 119.9378 58.6921 28.6440 178.6772 251 K 3.9303 8.1691 120.6335 59.6838 32.2570 178.7318 252 I 3.6828 7.7872 119.8758 64.5449 37.1674 178.4827 253 L 4.0044 8.0879 119.7314 57.8665 41.1766 179.0851 254 H 4.1074 8.3002 117.6081 59.3607 30.1758 177.1738 255 S 4.2514 8.3194 117.1421 61.8401 62.4866 177.0430 256 R 3.9655 7.8218 119.0605 58.8166 29.8543 178.1638 257 A 4.2420 7.5005 117.8113 52.9432 18.7031 177.3185 258 Q 4.0571 7.6758 121.3222 55.9990 28.8365 175.9113 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 0 G 8.35 3.73 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 *22 K 8.25 4.01 0.00 1.73 1.75 0.00 1.76 0.00 0.00 1.68 0.00 0.00 2.92 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.29 1.45 7.81 23 D 8.75 4.51 0.00 2.68 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 24 N 8.47 5.02 0.00 2.60 2.71 0.00 0.00 6.74 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 25 T 7.85 4.80 4.20 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 1.19 0.00 0.00 26 K 8.93 4.71 0.00 1.53 1.71 0.00 1.21 0.00 0.00 1.41 0.00 0.00 2.79 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.33 1.20 7.81 27 V 8.39 4.87 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.96 0.00 0.00 28 I 8.78 4.90 2.07 0.00 0.00 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.98 0.96 0.00 0.00 29 A 9.00 4.71 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 30 H 9.22 4.38 0.00 3.42 3.69 0.00 5.75 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 31 R 9.33 3.81 0.00 2.01 1.90 0.00 2.82 0.00 0.00 2.93 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.11 0.00 32 G 7.62 4.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 Y 8.69 4.68 0.00 2.94 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 34 W 8.40 4.87 0.00 3.57 3.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 K 7.05 3.95 0.00 1.46 1.48 0.00 1.14 0.00 0.00 1.35 0.00 0.00 2.85 0.00 0.00 2.77 0.00 0.00 0.00 0.00 0.30 0.21 7.81 36 T 6.93 4.25 2.99 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 0.63 0.00 0.00 37 E 8.60 3.89 0.00 1.91 1.83 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 2.28 2.33 0.00 38 G 8.90 3.87 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 0.00 0.00 0.00 39 S 7.64 4.61 0.00 3.84 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 40 A 8.04 4.81 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 41 Q 8.44 3.82 0.00 1.63 1.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.84 0.00 0.00 0.00 0.00 0.00 1.16 1.16 0.00 42 N 8.97 4.22 0.00 2.74 2.75 0.00 0.00 6.37 7.04 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 43 S 7.91 5.26 0.00 4.47 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 44 I 8.73 3.43 1.94 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.90 0.83 0.00 0.00 45 R 8.33 4.04 0.00 2.07 1.95 0.00 3.33 0.00 0.00 3.21 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.68 0.00 46 S 8.39 4.70 0.00 4.28 4.45 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 47 L 7.92 3.95 0.00 1.48 1.58 0.84 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 48 E 8.32 3.93 0.00 2.19 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 2.27 2.44 0.00 49 R 8.48 4.00 0.00 2.00 2.09 0.00 3.49 0.00 0.00 3.14 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.72 0.00 50 A 8.19 4.07 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 0.00 0.00 0.00 0.00 0.00 51 S 8.02 4.00 0.00 3.92 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 52 E 8.34 3.99 0.00 2.12 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.34 0.00 53 I 7.95 4.08 1.83 0.00 0.00 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.66 1.10 0.00 0.00 54 G 8.07 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 0.00 0.00 0.00 55 A 7.72 4.17 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 56 Y 9.04 4.32 0.00 3.21 3.30 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 57 G 8.48 4.46 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 0.00 0.00 0.00 58 S 8.91 5.22 0.00 3.95 3.85 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 59 E 9.38 5.40 0.00 2.08 1.83 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 2.29 2.17 0.00 60 F 7.61 5.51 0.00 2.82 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 D 8.81 5.29 0.00 2.55 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 62 V 8.73 4.92 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 1.18 0.00 0.00 0.32 0.00 0.00 63 H 9.20 5.36 0.00 3.10 3.16 0.00 5.65 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 L 8.68 5.07 0.00 1.80 1.62 0.96 0.67 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 65 T 9.05 4.55 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 1.31 0.00 0.00 66 A 8.49 3.98 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 D 8.04 4.77 0.00 2.82 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 68 N 8.04 4.21 0.00 2.91 2.97 0.00 0.00 6.71 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 69 V 7.70 4.25 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 0.53 0.00 0.00 0.89 0.00 0.00 70 L 8.37 4.99 0.00 1.69 1.65 1.09 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 71 V 8.97 4.90 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 1.05 0.00 0.00 72 V 7.86 4.71 1.82 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 0.30 0.00 0.00 0.54 0.00 0.00 73 Y 8.32 4.35 0.00 2.92 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 74 H 8.22 4.30 0.00 2.99 2.93 0.00 5.98 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 D 7.21 4.45 0.00 2.88 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 N 8.66 4.53 0.00 2.77 2.90 0.00 0.00 6.66 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 77 D 7.98 5.31 0.00 2.67 2.51 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 78 I 8.39 4.29 0.95 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 1.27 0.67 0.00 0.00 79 Q 9.77 3.40 0.00 2.13 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.55 0.00 0.00 0.00 0.00 0.00 2.25 2.29 0.00 80 G 8.42 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 0.00 0.00 0.00 81 K 7.89 4.36 0.00 1.84 1.66 0.00 1.59 0.00 0.00 1.52 0.00 0.00 2.84 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.32 1.28 7.81 82 H 8.51 5.11 0.00 3.23 3.18 0.00 5.72 0.00 0.00 0.00 0.00 6.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 I 8.35 3.62 1.60 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.81 0.83 0.00 0.00 84 Q 7.97 4.57 0.00 2.01 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.00 6.79 0.00 0.00 0.00 0.00 0.00 2.63 2.25 0.00 85 S 7.70 4.73 0.00 3.97 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 86 C 7.63 4.82 0.00 3.00 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 87 T 8.39 4.63 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 1.22 0.00 0.00 88 Y 9.42 4.26 0.00 3.08 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 D 8.09 4.13 0.00 2.66 2.65 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 90 E 7.75 4.01 0.00 2.03 1.93 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 2.30 2.31 0.00 91 L 7.56 4.34 0.00 1.67 1.58 0.91 0.36 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 92 K 7.54 3.66 0.00 1.42 0.74 0.00 1.40 0.00 0.00 1.40 0.00 0.00 2.97 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.27 1.27 7.81 93 D 7.63 4.69 0.00 2.60 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 94 L 7.68 4.10 0.00 1.67 1.47 0.78 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 95 Q 8.27 5.08 0.00 2.08 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.97 6.91 0.00 0.00 0.00 0.00 0.00 2.59 2.33 0.00 96 L 8.88 4.44 0.00 1.89 1.68 1.01 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 97 S 8.67 4.15 0.00 4.01 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 98 N 8.30 4.73 0.00 2.93 3.13 0.00 0.00 6.15 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 G 8.28 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 0.00 100 E 7.98 4.23 0.00 2.02 1.93 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 2.35 2.45 0.00 101 K 8.54 4.60 0.00 1.67 1.77 0.00 1.78 0.00 0.00 1.63 0.00 0.00 2.85 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.44 1.44 7.81 102 L 8.30 3.93 0.00 1.60 1.65 0.94 0.88 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 0.00 103 P 0.00 4.94 0.00 2.19 2.12 0.00 3.91 0.00 0.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.21 0.00 104 T 8.79 4.33 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 0.89 0.00 0.00 105 L 8.66 3.88 0.00 1.76 1.74 0.90 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 106 E 8.21 3.93 0.00 2.06 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 2.38 2.42 0.00 107 Q 8.21 3.97 0.00 2.35 2.16 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 2.39 2.38 0.00 108 Y 7.94 3.72 0.00 3.04 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 0.00 109 L 8.46 4.01 0.00 1.73 1.74 1.10 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 110 K 8.10 3.88 0.00 1.82 1.97 0.00 1.79 0.00 0.00 1.62 0.00 0.00 2.96 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.43 1.43 7.81 111 R 7.94 3.92 0.00 1.84 1.80 0.00 3.12 0.00 0.00 3.09 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.53 0.00 112 A 7.96 3.89 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 0.00 113 K 7.98 3.83 0.00 1.84 2.00 0.00 1.68 0.00 0.00 1.70 0.00 0.00 3.11 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.45 1.52 7.81 114 K 7.73 4.33 0.00 1.78 1.82 0.00 1.71 0.00 0.00 1.68 0.00 0.00 3.01 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.45 1.44 7.81 115 L 7.47 4.44 0.00 1.79 1.58 0.83 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 116 K 8.19 3.99 0.00 1.73 1.85 0.00 1.75 0.00 0.00 1.84 0.00 0.00 3.08 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.43 1.36 7.81 117 N 8.10 4.53 0.00 2.82 2.93 0.00 0.00 5.73 7.81 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 0.00 118 I 6.91 4.47 1.83 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 1.14 1.15 0.93 0.00 0.00 119 R 8.23 4.16 0.00 1.20 1.29 0.00 3.02 0.00 0.00 2.99 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.58 0.00 120 L 8.93 4.90 0.00 1.69 1.99 1.02 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 121 I 8.63 4.31 1.77 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 1.01 0.79 0.00 0.00 122 F 8.76 3.55 0.00 2.73 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 E 8.52 5.23 0.00 1.95 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 2.31 2.23 0.00 124 L 8.80 4.82 0.00 2.24 1.94 1.23 0.66 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 0.00 125 K 8.85 4.32 0.00 1.57 1.61 0.00 1.76 0.00 0.00 1.56 0.00 0.00 2.85 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.43 1.00 7.81 126 S 8.64 4.38 0.00 3.91 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 H 9.50 5.42 0.00 3.26 3.29 0.00 5.86 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 D 8.54 4.64 0.00 2.79 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 T 7.41 4.71 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 130 P 0.00 4.24 0.00 2.18 2.39 0.00 3.61 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.30 0.00 131 E 8.17 3.94 0.00 2.00 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 2.38 2.36 0.00 132 R 8.47 3.88 0.00 1.90 2.07 0.00 3.14 0.00 0.00 3.18 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.76 0.00 133 N 8.32 4.25 0.00 2.93 2.83 0.00 0.00 7.02 7.28 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 0.00 134 R 8.06 3.75 0.00 1.95 1.87 0.00 3.06 0.00 0.00 3.10 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.79 0.00 135 D 8.21 4.27 0.00 2.78 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 136 A 8.19 3.91 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 0.00 137 A 7.80 3.20 0.31 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 0.00 138 R 7.96 3.69 0.00 1.82 2.00 0.00 3.06 0.00 0.00 3.11 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.62 0.00 139 L 7.77 4.05 0.00 1.67 1.74 0.92 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 140 S 8.04 4.49 0.00 4.13 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 0.00 141 V 7.94 3.89 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.93 0.00 0.00 142 Q 8.01 4.28 0.00 2.31 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.16 0.00 0.00 0.00 0.00 0.00 2.38 2.49 0.00 *144 V 7.71 4.08 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 1.04 0.00 0.00 1.18 0.00 0.00 145 K 8.44 3.96 0.00 1.89 2.04 0.00 1.88 0.00 0.00 1.77 0.00 0.00 3.01 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.47 1.40 7.81 146 R 7.78 4.20 0.00 1.97 2.03 0.00 3.16 0.00 0.00 3.24 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.63 0.00 *148 K 7.83 4.19 0.00 1.80 1.92 0.00 1.69 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.35 1.48 7.81 149 L 8.03 4.76 0.00 1.72 1.63 0.97 1.07 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 0.00 150 A 8.17 4.05 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 0.00 151 K 8.10 4.10 0.00 1.75 1.89 0.00 1.70 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.45 1.46 7.81 152 R 8.06 4.56 0.00 1.73 1.84 0.00 3.05 0.00 0.00 3.15 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.54 0.00 153 T 7.77 4.90 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 0.80 0.00 0.00 154 D 8.70 4.78 0.00 2.38 2.40 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 0.00 155 Y 8.42 5.09 0.00 2.40 1.88 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 0.00 156 I 8.48 5.41 1.82 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 1.79 0.88 0.00 0.00 157 S 8.31 4.87 0.00 4.13 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 0.00 158 F 9.14 4.02 0.00 3.08 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 159 N 8.20 4.88 0.00 2.88 2.86 0.00 0.00 6.99 7.77 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 *161 D 8.52 4.53 0.00 2.95 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 0.00 162 A 8.68 3.75 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 0.00 163 C 8.19 4.24 0.00 3.19 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 164 K 7.95 3.79 0.00 1.74 1.78 0.00 1.66 0.00 0.00 1.72 0.00 0.00 2.90 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.46 1.47 7.81 165 E 7.96 3.78 0.00 2.02 1.70 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 2.23 2.11 0.00 166 F 7.88 4.11 0.00 3.09 2.65 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 0.00 167 I 7.62 3.62 1.83 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.29 0.84 0.00 0.00 168 R 7.83 3.98 0.00 1.82 2.02 0.00 3.21 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 1.59 1.62 0.00 169 L 7.96 4.23 0.00 1.66 1.68 0.78 1.09 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 0.00 170 C 8.29 4.90 0.00 3.11 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 171 P 0.00 4.38 0.00 2.17 2.17 0.00 3.75 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.98 0.00 172 K 7.90 4.35 0.00 1.77 1.89 0.00 1.75 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.38 1.39 7.81 173 S 7.67 4.58 0.00 4.09 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 0.00 174 E 8.38 4.36 0.00 1.95 1.88 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 2.40 2.29 0.00 175 V 8.79 4.88 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 0.96 0.00 0.00 0.97 0.00 0.00 176 S 9.24 6.02 0.00 3.84 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 0.00 177 Y 8.48 5.03 0.00 2.07 2.61 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.30 0.00 187 L 7.99 3.87 0.00 1.66 1.53 0.55 -0.17 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 0.00 188 K 8.51 3.95 0.00 1.89 1.79 0.00 1.54 0.00 0.00 1.58 0.00 0.00 2.99 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.43 1.49 7.81 189 E 8.12 3.98 0.00 1.99 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 2.29 2.40 0.00 190 L 7.56 4.32 0.00 2.09 1.79 0.95 0.89 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 0.00 191 G 7.92 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 0.00 192 F 8.00 4.20 0.00 3.15 2.98 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 0.00 193 T 8.27 4.48 4.34 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 1.28 0.00 0.00 194 G 7.72 4.20 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 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4.00 0.00 2.23 2.13 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 2.52 2.60 0.00 204 S 8.30 4.19 0.00 3.78 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 205 H 7.84 4.43 0.00 2.20 1.37 0.00 5.81 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 0.00 206 P 0.00 4.56 0.00 2.14 2.13 0.00 3.18 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.87 0.00 207 D 7.86 4.70 0.00 2.87 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 208 W 8.23 4.51 0.00 3.56 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 209 V 7.92 3.62 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.99 0.00 0.00 210 K 8.09 3.91 0.00 1.88 2.00 0.00 1.80 0.00 0.00 1.83 0.00 0.00 2.94 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.53 1.55 7.81 211 D 8.25 4.40 0.00 2.95 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 0.00 212 C 7.95 4.04 0.00 3.10 2.95 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 0.00 213 K 7.85 3.98 0.00 1.83 2.01 0.00 1.64 0.00 0.00 1.57 0.00 0.00 2.90 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.42 1.43 7.81 214 V 7.67 3.62 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 0.89 0.00 0.00 0.98 0.00 0.00 215 L 8.08 4.32 0.00 1.69 1.67 0.93 1.17 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 0.00 216 G 7.55 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 *218 T 7.24 4.47 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 219 S 9.17 5.23 0.00 3.86 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 0.00 220 N 9.40 5.93 0.00 3.05 2.97 0.00 0.00 6.57 7.49 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 0.00 221 V 8.53 5.32 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 0.98 0.00 0.00 1.01 0.00 0.00 222 W 8.54 5.71 0.00 3.47 3.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 223 T 9.01 4.96 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 1.32 0.00 0.00 224 V 8.76 4.14 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 0.61 0.00 0.00 0.91 0.00 0.00 225 D 8.67 4.82 0.00 2.69 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 226 D 7.77 4.50 0.00 2.66 2.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 227 P 0.00 4.31 0.00 2.05 2.08 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 2.01 2.06 0.00 228 K 8.08 4.04 0.00 1.84 1.75 0.00 1.84 0.00 0.00 1.74 0.00 0.00 2.79 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.50 1.00 7.81 229 L 7.08 4.20 0.00 1.52 1.60 0.70 -0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 *231 E 8.37 4.34 0.00 2.22 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 2.27 2.46 0.00 232 E 8.09 3.91 0.00 2.01 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 2.30 2.27 0.00 *234 I 7.78 4.23 1.96 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 1.39 0.64 0.91 0.00 0.00 235 D 8.16 4.37 0.00 2.81 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 *237 G 8.06 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 0.00 238 V 7.76 4.12 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 0.96 0.00 0.00 239 D 8.54 4.42 0.00 2.15 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 0.00 240 F 8.31 5.54 0.00 3.10 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 241 I 8.74 4.62 1.93 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 1.26 0.86 0.96 0.00 0.00 242 T 9.16 5.04 4.61 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 1.36 0.00 0.00 243 T 8.86 5.01 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 1.26 0.00 0.00 244 D 9.55 4.76 0.00 3.07 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 0.00 245 L 7.98 4.79 0.00 1.61 1.51 0.95 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 246 P 0.00 4.17 0.00 1.98 2.18 0.00 3.52 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 1.69 0.00 247 E 7.59 4.16 0.00 1.96 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 2.38 1.84 0.00 248 E 8.04 3.93 0.00 2.08 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 2.37 2.32 0.00 249 T 7.58 3.88 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 1.22 0.00 0.00 250 Q 8.14 3.99 0.00 2.24 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.79 0.00 0.00 0.00 0.00 0.00 2.38 2.48 0.00 251 K 8.17 3.93 0.00 1.81 1.98 0.00 1.64 0.00 0.00 1.64 0.00 0.00 2.98 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.50 7.81 252 I 7.79 3.68 1.99 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 1.51 0.45 0.90 0.00 0.00 253 L 8.09 4.00 0.00 1.83 1.72 0.97 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 254 H 8.30 4.11 0.00 3.17 3.50 0.00 5.96 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 0.00 255 S 8.32 4.25 0.00 3.89 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 0.00 256 R 7.82 3.97 0.00 1.92 1.98 0.00 3.32 0.00 0.00 3.30 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.73 0.00 257 A 7.50 4.24 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 0.00 258 Q 7.68 4.06 0.00 2.11 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.02 6.49 0.00 0.00 0.00 0.00 0.00 2.58 2.40 0.00 * Residues marked with a * may have inaccurate shift predictions.