NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.3649 8.2649 123.5891 51.0263 19.9343 176.3710 2 P 4.3707 0.0000 0.0000 61.9557 31.8942 175.7563 3 R 4.2518 8.3663 119.5229 58.9551 31.2536 176.9610 4 S 4.5689 7.6070 109.8086 56.7186 66.3347 173.9026 5 V 3.9248 7.7776 120.4913 61.3272 35.2684 173.9884 6 D 4.7829 7.8071 126.1221 52.7180 42.8668 175.2475 7 W 4.2354 9.3943 127.0533 58.5932 29.8124 179.1017 8 R 4.0217 8.6368 120.1719 59.2116 29.2825 178.4517 9 E 4.1535 7.8536 116.9838 58.1358 29.5320 178.2859 10 K 4.5996 7.9784 116.6055 55.8728 32.7204 176.9833 11 G 3.6421 7.9309 107.2672 45.9242 0.0000 174.2162 12 Y 3.7371 7.7204 116.2889 58.1635 38.3543 175.7846 13 V 4.4276 7.3864 119.5215 60.8050 34.0760 175.1883 14 T 4.2573 8.3946 117.0210 60.2534 69.6982 172.0961 15 P 4.5311 0.0000 0.0000 62.0998 31.9604 176.5168 16 V 3.7528 8.2622 120.0343 63.3225 32.1692 175.3951 17 K 4.6362 8.5715 125.9995 54.7128 35.8183 174.3073 18 N 5.2511 8.2355 119.0191 51.8534 40.9424 174.2655 19 Q 3.6843 8.9093 125.8053 56.6298 29.7906 177.6335 20 G 3.8595 8.2638 107.8735 46.6840 0.0000 175.2459 21 Q 4.3547 8.4339 116.1136 54.1910 27.6360 176.0117 22 C 4.8521 7.7641 115.0614 55.1249 47.9912 174.7934 23 G 3.9810 8.7273 118.2489 45.5184 0.0000 173.7795 24 S 4.3845 7.7569 109.3488 57.9345 64.2901 176.1403 25 C 3.9308 8.4837 119.3364 62.1025 28.8726 175.4883 26 W 4.2156 8.4104 118.4485 59.4510 27.3194 177.9243 27 A 3.4896 6.7311 121.3545 54.3957 17.6195 179.6773 28 F 3.8085 7.6172 117.2997 59.7911 39.1756 177.6877 29 S 4.0587 8.4266 113.0220 61.2963 62.1137 176.1411 30 A 4.0704 7.9968 123.5696 55.4996 18.1025 179.7689 31 T 3.9470 8.0527 108.5171 64.7545 68.8199 176.9617 32 G 3.7184 8.3008 108.4192 46.9920 0.0000 175.6358 33 A 4.0907 8.1046 123.4001 54.7612 18.3922 179.5455 34 L 3.9486 8.4109 119.1000 58.1131 41.9883 178.8156 35 E 4.1068 8.9917 119.4562 59.4512 29.3763 179.7232 36 G 3.7083 8.0459 105.2008 48.0256 0.0000 175.9294 37 Q 3.9995 8.2570 120.9237 58.7122 28.5972 178.6968 38 M 4.0236 8.4696 120.2745 58.3278 32.0009 178.5110 39 F 4.0010 8.2705 120.7916 61.1453 39.2681 176.8631 40 R 3.6452 7.6171 117.3246 59.4512 29.8615 178.0099 41 K 4.0677 7.6795 118.1817 58.6216 32.3886 177.9025 42 T 4.4220 7.9458 107.5667 60.3881 70.1927 175.3170 43 G 3.1428 7.7213 109.3663 45.2637 0.0000 173.1317 44 R 4.5514 7.4751 118.0747 53.8344 32.2100 175.0688 45 L 4.3978 8.8726 125.7298 54.2535 42.3994 175.7409 46 I 4.5552 8.1182 126.5789 59.0230 40.2124 175.2415 47 S 4.4022 8.7314 120.5635 58.6786 63.1946 172.8770 48 L 4.8856 9.0793 127.3831 53.1755 44.1805 176.4714 49 S 4.3732 8.6174 117.1221 57.7529 62.4796 174.8040 50 E 3.5703 8.4424 128.5128 59.0931 29.0115 178.9760 51 Q 3.8473 7.8330 119.2750 59.0050 29.0182 177.3764 52 N 3.4725 7.3626 118.1833 56.6793 38.9381 176.7852 53 L 3.7090 7.0454 119.0136 57.6809 41.4813 179.6219 54 V 3.8573 7.6580 117.4653 66.1541 31.5251 177.3935 55 D 4.6851 8.1668 117.6285 56.0768 40.9778 176.4791 56 C 4.9215 7.7221 114.1156 56.5163 36.6668 174.5198 57 S 5.0785 7.0670 113.4409 57.1001 63.1700 176.3097 58 G 3.9533 8.1777 112.6778 48.8141 0.0000 174.6469 59 P 4.2202 0.0000 0.0000 65.0563 31.7447 177.3057 60 Q 3.9567 7.8255 115.5231 55.7615 29.0685 176.5648 61 G 3.5224 7.3345 105.1256 45.0528 0.0000 174.1217 62 N 4.3593 7.9155 117.6013 52.7728 39.4348 174.9115 63 E 5.0605 8.0743 118.6853 56.3362 31.2326 178.5829 64 G 4.2759 7.8659 113.8308 47.5554 0.0000 177.1465 65 C 4.7562 8.9687 122.8870 57.7778 40.1278 173.8344 66 N 4.5712 8.5656 117.3100 52.5501 38.7564 173.8726 67 G 4.0355 7.6635 104.1426 43.5190 0.0000 173.2926 68 G 2.8974 6.8747 106.1312 44.0735 0.0000 172.5666 69 L 4.5169 7.4073 118.4115 52.2222 45.6831 177.7042 70 M 3.7011 8.3367 122.3557 58.6011 31.8869 178.8127 71 D 3.5948 7.3938 118.2917 57.2907 40.8151 178.2964 72 Y 4.2901 7.3464 116.4914 60.9517 37.9700 178.2971 73 A 4.1092 7.8438 121.7967 55.2280 18.6208 179.7014 74 F 4.6906 7.8859 116.6003 60.8599 38.9876 177.7109 75 Q 4.2072 8.5565 119.3808 59.3237 28.9110 177.4482 76 Y 4.1044 8.3826 120.7846 60.8431 38.6837 178.4303 77 V 3.3566 7.9425 118.7590 65.8127 31.3970 177.6727 78 Q 4.0262 7.7479 117.6965 59.5220 29.0630 177.6958 79 D 4.4237 8.2363 118.7929 57.3396 40.9515 178.0091 80 N 4.2343 8.1479 116.2778 54.0210 38.9238 176.0378 81 G 3.8243 7.6899 107.2806 44.5343 0.0000 172.8138 82 G 4.4026 6.8503 105.0855 45.9382 0.0000 172.0511 83 L 4.9355 7.6463 120.2355 53.7954 45.6295 174.7297 84 D 5.4396 10.0257 126.8804 54.0778 42.3005 176.2219 85 S 4.6721 8.6120 116.2178 58.3826 63.7726 174.8985 86 E 3.9176 9.2906 123.2094 59.5308 29.7202 178.9675 87 E 4.0387 8.3405 118.1755 59.2350 29.7677 178.0339 88 S 4.0873 8.0483 111.8962 60.7264 63.5889 174.0354 89 Y 4.8571 7.4013 120.8800 55.4449 38.6812 172.3552 90 P 4.7456 0.0000 0.0000 61.4021 32.7296 175.6041 91 Y 4.5720 8.4719 121.5160 57.4815 39.0124 174.9998 92 E 4.2387 9.1165 125.3386 55.1297 31.3780 176.6711 93 A 3.2850 6.5864 119.4686 52.3777 16.0458 176.6603 94 T 4.5259 6.7414 107.7270 62.0954 70.6072 172.8513 95 E 4.1553 8.6118 128.1756 56.0839 30.2366 175.6252 96 E 4.8401 8.9318 124.7367 53.9721 33.7960 175.4218 97 S 4.3050 8.4117 114.3503 58.1204 63.5796 174.7615 98 C 4.5675 8.7603 122.5174 57.2511 43.7316 173.5763 99 K 4.6263 8.9501 127.1207 55.8427 32.7536 175.8167 100 Y 4.5860 8.5179 119.8354 58.1853 39.3933 174.4294 101 N 4.7702 8.8352 124.8666 50.7199 41.2420 173.2402 102 P 4.1443 0.0000 0.0000 64.5593 31.7317 178.3288 103 K 3.6182 7.8164 119.9964 58.8801 32.0569 176.7259 104 Y 4.6598 7.6580 114.4974 57.4052 38.2403 174.9911 105 S 4.7092 7.9232 116.9322 58.6679 62.7643 174.7576 106 V 4.5547 8.6189 118.8663 60.8516 32.9673 174.9727 107 A 4.8513 7.6330 120.9267 50.9179 22.6841 174.7523 108 N 5.2860 8.5550 117.0246 52.9586 42.4570 172.3833 109 D 4.8818 8.4014 120.3263 51.6436 42.8764 174.4318 110 A 4.7131 8.7635 119.8418 51.5941 19.7454 174.9118 111 G 3.9265 9.4210 109.5227 44.3547 0.0000 171.9429 112 F 5.1382 7.3977 115.4100 56.0084 41.3898 173.9849 113 V 4.2031 8.5134 119.0027 61.0860 34.1026 173.8062 114 D 5.0586 8.7114 127.9608 52.9037 41.6234 176.4382 115 I 4.0157 8.3601 125.7823 60.3838 37.6661 175.0464 116 P 4.3735 0.0000 0.0000 62.3978 32.3163 177.1264 117 K 5.1811 8.2325 121.0589 56.1813 30.8066 177.5888 118 Q 4.6704 7.4778 118.3771 53.5067 33.8648 176.1014 119 E 4.2274 8.9552 123.3522 59.3586 29.5684 179.8709 120 K 3.9782 8.1563 118.1451 59.4717 32.2298 178.9819 121 A 4.0742 7.9291 120.5534 55.0030 18.2907 179.3108 122 L 3.9330 8.2015 118.9784 58.3450 42.0697 178.7332 123 M 4.2589 8.5968 118.4268 58.7773 32.2937 178.0381 124 K 3.9682 8.2334 119.4543 59.4582 32.2752 178.6072 125 A 3.9942 8.2115 121.0197 55.2179 18.0234 179.7328 126 V 4.0347 8.6435 118.3429 65.7884 31.4388 178.1463 127 A 4.1201 8.7004 120.0673 54.5313 18.2955 178.6868 128 T 4.4962 7.8589 106.3243 62.1468 70.1977 175.6834 129 V 3.7738 9.1250 120.4564 65.3140 32.9688 175.0761 130 G 2.1440 6.6224 104.4581 42.4899 0.0000 170.5641 131 P 4.8050 0.0000 0.0000 62.9869 32.1487 176.2244 132 I 4.6656 8.5147 123.4189 59.3804 40.6205 175.1890 133 S 4.7693 8.9311 123.4638 58.8130 63.8691 173.8397 134 V 4.7748 8.8521 116.6373 59.5192 35.8045 174.1890 135 A 5.1052 8.0130 124.7848 50.7228 20.8860 176.3677 136 I 4.6367 8.5707 114.5250 59.0807 41.9704 174.2259 137 D 4.7112 8.8124 123.5919 53.4648 40.7241 175.4820 138 A 3.9701 8.7398 128.1051 51.6102 19.6193 176.9021 139 G 3.9281 7.8342 106.8348 45.9206 0.0000 174.3719 140 H 4.9680 7.6759 114.9295 52.6972 33.3859 175.2522 141 E 3.7469 8.8309 121.7141 59.0838 29.0970 179.4931 142 S 4.3005 8.1465 114.5744 61.4953 63.2002 175.8645 143 F 4.0866 8.5607 124.3095 60.9306 38.9456 176.8503 144 L 4.4770 8.1856 118.5539 58.0069 42.0324 177.8991 145 F 5.0486 8.0376 114.5207 56.6086 39.7379 175.4978 146 Y 4.1418 7.5657 121.3751 58.0023 39.2382 175.8372 147 K 3.7518 7.3865 123.8443 57.4053 34.4849 175.8911 148 E 4.1381 6.9018 113.7010 55.8347 33.2648 175.1012 149 G 3.7964 8.6035 107.0476 44.5477 0.0000 172.1350 150 I 4.4665 7.9213 119.4134 60.3364 38.1709 175.4979 151 Y 4.5222 9.7196 131.0442 57.3748 39.7834 174.0656 152 F 4.7215 8.3630 128.3956 56.3469 42.7282 173.1193 153 E 4.2749 7.9697 126.2700 53.4532 30.9668 173.9954 154 P 4.1413 0.0000 0.0000 65.6600 31.4605 177.0309 155 D 4.6566 8.0953 115.0125 54.0039 40.9831 175.8573 156 C 4.4645 7.6520 120.4546 56.4163 41.3759 172.7600 157 S 4.6255 9.4000 121.3167 57.5825 62.9993 174.8526 158 S 4.6333 8.5309 121.7356 59.2786 63.3431 175.3345 159 E 4.4608 8.0681 118.3856 56.1657 31.6009 175.4987 160 D 4.8478 8.3336 118.6629 52.7027 42.4263 175.1340 161 M 4.9653 8.4117 123.4815 53.4571 35.0766 175.6962 162 D 4.8043 8.9594 118.2160 53.4095 41.9978 174.4478 163 H 4.8545 8.0635 118.9884 55.0287 33.5576 171.8207 164 G 4.2838 8.5096 112.5637 44.9292 0.0000 172.9422 165 V 4.4788 8.5267 118.0096 59.8378 36.8410 173.3803 166 L 4.9991 8.2298 121.9418 53.9042 45.3356 176.1961 167 V 4.5132 8.8744 127.5207 62.8024 32.4358 176.3542 168 V 4.5467 9.7049 121.1763 60.6931 33.2157 176.3795 169 G 3.7009 7.6805 108.0770 46.9607 0.0000 170.5794 170 Y 4.9042 6.9934 115.9345 56.9382 41.8231 173.9977 171 G 3.6556 7.3460 105.1147 45.7943 0.0000 171.5856 172 F 5.1330 7.2820 114.5019 56.4240 41.4502 174.9408 173 E 3.8193 9.6550 119.8397 58.7427 27.3684 177.5530 *179 N 4.4541 8.9112 114.5754 53.0151 39.2707 174.1264 180 N 4.1530 8.6408 111.7875 54.2040 36.3168 175.1819 181 K 4.5895 7.2770 113.1317 56.8901 33.6822 176.1163 182 Y 5.4135 8.2303 119.2496 55.4783 42.0472 173.8267 183 W 5.1260 9.6118 121.2573 55.8508 31.4818 175.2688 184 L 5.0337 9.3394 127.2500 54.0598 42.9734 175.0883 185 V 5.0017 8.9345 127.3967 60.9700 34.3557 174.2089 186 K 3.6283 9.3823 130.2501 55.7012 33.3101 175.6317 187 N 4.9575 8.1604 126.5914 51.3445 41.7141 173.7652 188 S 4.5952 7.4515 112.7982 57.6856 63.3363 175.2195 189 W 4.6787 8.1342 116.5948 57.3898 29.9236 177.2302 190 G 4.1267 8.2194 105.1639 45.2947 0.0000 174.8240 191 E 4.4290 8.1759 115.1549 57.6408 30.0356 178.8248 192 E 4.1072 8.1600 118.8689 58.4468 30.1666 176.9828 193 W 4.3939 8.0991 128.3888 57.7285 32.2610 176.4918 194 G 3.0122 7.1687 112.5818 45.8388 0.0000 175.8504 195 M 4.1422 8.8151 115.4943 54.9405 30.5721 176.2441 196 G 4.1779 9.4156 112.3520 45.8778 0.0000 172.1366 197 G 4.1906 8.8135 107.7015 44.7878 0.0000 173.3992 198 Y 5.2323 7.9846 117.5160 56.3098 41.1819 175.0785 199 V 4.6590 8.9170 120.1856 60.0090 35.3618 174.6617 200 K 4.9803 8.6944 123.0258 55.8869 33.2486 175.5377 201 M 5.0623 9.1812 125.7834 53.6333 34.0692 175.9184 202 A 4.4312 8.7248 124.9289 52.9337 18.9962 176.7071 203 K 4.6310 8.7260 124.0887 55.0805 34.4630 175.4954 204 D 4.6297 9.1448 124.9103 56.0720 39.3443 174.8455 205 R 4.5980 7.7434 113.9989 55.8820 30.5263 176.2123 206 R 3.8203 8.5779 118.6670 58.1300 28.8261 176.7806 207 N 4.2745 8.5051 113.5172 54.9222 37.7646 173.1756 208 H 4.4727 7.9584 116.5876 57.6552 31.0853 174.4408 209 C 4.1059 8.8328 121.2352 56.8938 38.4821 173.8612 210 G 4.0818 8.1689 106.8175 47.2673 0.0000 176.3848 211 I 3.6397 7.7611 120.2273 62.3704 38.2253 176.5051 212 A 4.5001 8.8314 122.2049 51.9537 18.9651 178.4655 213 S 4.2809 8.0554 115.0713 61.4265 63.5733 175.1629 214 A 4.7464 7.4420 121.1566 50.5461 18.7511 175.5753 215 A 4.9481 7.7968 124.8728 50.9283 21.4784 178.2018 216 S 5.5303 9.5207 115.5925 58.3501 67.2730 172.2632 217 Y 5.0293 7.8726 117.0405 55.2698 41.1063 171.9050 218 P 4.5115 0.0000 0.0000 62.1204 33.2200 175.7494 219 T 4.2491 8.5544 119.2568 63.0469 69.4424 175.4268 220 V 3.9613 8.1743 125.5664 62.9875 31.9643 174.8776 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 1 A 8.26 4.36 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 2 P 0.00 4.37 0.00 2.20 1.95 0.00 3.81 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 2.14 0.00 3 R 8.37 4.25 0.00 1.90 1.93 0.00 3.03 0.00 0.00 2.93 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.57 0.00 4 S 7.61 4.57 0.00 3.54 3.60 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 5 V 7.78 3.92 1.16 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 0.01 0.00 0.00 0.37 0.00 0.00 6 D 7.81 4.78 0.00 2.52 2.44 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 7 W 9.39 4.24 0.00 3.36 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 0.00 8 R 8.64 4.02 0.00 1.93 1.97 0.00 2.91 0.00 0.00 2.81 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.78 0.00 9 E 7.85 4.15 0.00 1.94 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 2.31 2.30 0.00 10 K 7.98 4.60 0.00 2.18 2.31 0.00 1.87 0.00 0.00 1.73 0.00 0.00 2.85 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.30 1.40 7.81 11 G 7.93 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 Y 7.72 3.74 0.00 3.10 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 13 V 7.39 4.43 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 1.04 0.00 0.00 1.13 0.00 0.00 14 T 8.39 4.26 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 1.26 0.00 0.00 15 P 0.00 4.53 0.00 2.11 2.10 0.00 3.72 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 2.06 2.12 0.00 16 V 8.26 3.75 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 0.74 0.00 0.00 0.92 0.00 0.00 17 K 8.57 4.64 0.00 1.77 1.79 0.00 1.84 0.00 0.00 1.96 0.00 0.00 2.80 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.50 1.62 7.81 18 N 8.24 5.25 0.00 2.65 2.66 0.00 0.00 6.98 7.08 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 19 Q 8.91 3.68 0.00 2.21 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.51 0.00 0.00 0.00 0.00 0.00 2.44 2.27 0.00 20 G 8.26 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 21 Q 8.43 4.35 0.00 2.03 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.14 6.61 0.00 0.00 0.00 0.00 0.00 2.28 2.24 0.00 22 C 7.76 4.85 0.00 3.16 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 23 G 8.73 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 24 S 7.76 4.38 0.00 3.74 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 C 8.48 3.93 0.00 3.26 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 W 8.41 4.22 0.00 3.50 3.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 A 6.73 3.49 0.11 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 28 F 7.62 3.81 0.00 3.09 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 29 S 8.43 4.06 0.00 3.91 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 30 A 8.00 4.07 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 31 T 8.05 3.95 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 1.15 0.00 0.00 32 G 8.30 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 0.00 0.00 0.00 33 A 8.10 4.09 1.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 L 8.41 3.95 0.00 1.93 1.78 0.97 1.08 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 35 E 8.99 4.11 0.00 2.24 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.42 0.00 36 G 8.05 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 Q 8.26 4.00 0.00 2.06 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.75 0.00 0.00 0.00 0.00 0.00 2.51 2.75 0.00 38 M 8.47 4.02 0.00 2.01 2.20 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.83 0.00 39 F 8.27 4.00 0.00 3.03 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 R 7.62 3.65 0.00 1.93 2.12 0.00 3.46 0.00 0.00 3.22 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.73 0.00 41 K 7.68 4.07 0.00 1.76 1.90 0.00 1.78 0.00 0.00 1.73 0.00 0.00 3.26 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.40 1.40 7.81 42 T 7.95 4.42 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 43 G 7.72 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 R 7.48 4.55 0.00 1.82 1.88 0.00 3.16 0.00 0.00 3.17 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.64 0.00 45 L 8.87 4.40 0.00 1.66 1.62 0.89 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 46 I 8.12 4.56 1.92 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 1.35 0.84 0.96 0.00 0.00 47 S 8.73 4.40 0.00 3.93 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 L 9.08 4.89 0.00 1.50 1.56 0.97 0.85 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 49 S 8.62 4.37 0.00 4.05 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 50 E 8.44 3.57 0.00 1.22 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 1.47 1.64 0.00 51 Q 7.83 3.85 0.00 2.21 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.83 0.00 0.00 0.00 0.00 0.00 2.67 2.69 0.00 52 N 7.36 3.47 0.00 2.22 2.77 0.00 0.00 7.26 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 53 L 7.05 3.71 0.00 1.69 1.69 0.79 0.85 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 54 V 7.66 3.86 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 0.89 0.00 0.00 0.81 0.00 0.00 55 D 8.17 4.69 0.00 2.81 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 56 C 7.72 4.92 0.00 2.46 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 57 S 7.07 5.08 0.00 3.93 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 58 G 8.18 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 59 P 0.00 4.22 0.00 2.08 2.13 0.00 3.77 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.12 0.00 60 Q 7.83 3.96 0.00 2.28 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.23 0.00 0.00 0.00 0.00 0.00 2.65 2.50 0.00 61 G 7.33 3.52 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 0.00 62 N 7.92 4.36 0.00 2.59 1.75 0.00 0.00 6.74 7.29 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 63 E 8.07 5.06 0.00 2.03 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.08 0.00 64 G 7.87 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 0.00 0.00 0.00 0.00 65 C 8.97 4.76 0.00 3.06 3.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 N 8.57 4.57 0.00 2.84 2.86 0.00 0.00 7.06 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 67 G 7.66 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 68 G 6.87 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 0.00 0.00 0.00 69 L 7.41 4.52 0.00 0.56 0.88 -0.03 0.65 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 70 M 8.34 3.70 0.00 1.57 1.86 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.85 2.63 0.00 71 D 7.39 3.59 0.00 2.11 1.68 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 72 Y 7.35 4.29 0.00 2.98 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 73 A 7.84 4.11 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 74 F 7.89 4.69 0.00 3.21 3.17 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 75 Q 8.56 4.21 0.00 2.58 2.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.77 0.00 0.00 0.00 0.00 0.00 2.47 2.68 0.00 76 Y 8.38 4.10 0.00 3.28 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 77 V 7.94 3.36 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 0.98 0.00 0.00 1.20 0.00 0.00 78 Q 7.75 4.03 0.00 2.38 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.73 0.00 0.00 0.00 0.00 0.00 2.36 2.40 0.00 79 D 8.24 4.42 0.00 2.65 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 80 N 8.15 4.23 0.00 1.44 1.93 0.00 0.00 7.33 7.84 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 81 G 7.69 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 82 G 6.85 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 83 L 7.65 4.94 0.00 1.85 1.58 1.13 1.24 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 84 D 10.03 5.44 0.00 3.18 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 85 S 8.61 4.67 0.00 3.91 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 86 E 9.29 3.92 0.00 2.15 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.34 0.00 87 E 8.34 4.04 0.00 1.99 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 2.27 2.31 0.00 88 S 8.05 4.09 0.00 3.60 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 89 Y 7.40 4.86 0.00 2.87 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 90 P 0.00 4.75 0.00 2.15 2.03 0.00 3.87 0.00 0.00 4.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.20 0.00 91 Y 8.47 4.57 0.00 2.85 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 92 E 9.12 4.24 0.00 1.96 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.21 0.00 93 A 6.59 3.29 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 94 T 6.74 4.53 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 95 E 8.61 4.16 0.00 2.01 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 2.32 2.37 0.00 96 E 8.93 4.84 0.00 2.00 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 2.40 2.71 0.00 97 S 8.41 4.30 0.00 4.01 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 C 8.76 4.57 0.00 3.05 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 99 K 8.95 4.63 0.00 1.24 1.50 0.00 1.74 0.00 0.00 1.50 0.00 0.00 2.78 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.31 1.56 7.81 100 Y 8.52 4.59 0.00 3.30 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 N 8.84 4.77 0.00 2.64 2.67 0.00 0.00 6.70 8.12 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 0.00 102 P 0.00 4.14 0.00 2.22 2.37 0.00 3.72 0.00 0.00 3.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.89 0.00 103 K 7.82 3.62 0.00 1.48 1.18 0.00 1.14 0.00 0.00 1.36 0.00 0.00 2.80 0.00 0.00 2.96 0.00 0.00 0.00 0.00 0.78 1.11 7.81 104 Y 7.66 4.66 0.00 3.19 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 0.00 105 S 7.92 4.71 0.00 4.11 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 0.00 106 V 8.62 4.55 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 0.83 0.00 0.00 1.01 0.00 0.00 107 A 7.63 4.85 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 0.00 108 N 8.55 5.29 0.00 2.72 2.66 0.00 0.00 6.81 8.47 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 0.00 109 D 8.40 4.88 0.00 2.85 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 0.00 110 A 8.76 4.71 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 0.00 111 G 9.42 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 0.00 0.00 0.00 112 F 7.40 5.14 0.00 3.10 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 V 8.51 4.20 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 0.81 0.00 0.00 0.59 0.00 0.00 114 D 8.71 5.06 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 0.00 115 I 8.36 4.02 2.02 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.63 0.97 0.00 0.00 116 P 0.00 4.37 0.00 2.07 2.01 0.00 3.73 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 2.06 2.10 0.00 117 K 8.23 5.18 0.00 1.72 1.78 0.00 1.54 0.00 0.00 2.37 0.00 0.00 2.98 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.43 1.49 7.81 118 Q 7.48 4.67 0.00 2.16 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.33 6.66 0.00 0.00 0.00 0.00 0.00 2.36 2.50 0.00 119 E 8.96 4.23 0.00 2.17 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 2.71 2.57 0.00 120 K 8.16 3.98 0.00 1.88 1.89 0.00 1.59 0.00 0.00 1.85 0.00 0.00 3.05 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.55 1.58 7.81 121 A 7.93 4.07 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 0.00 122 L 8.20 3.93 0.00 1.70 1.80 0.77 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 123 M 8.60 4.26 0.00 2.22 2.03 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 2.34 0.00 124 K 8.23 3.97 0.00 1.98 2.01 0.00 1.65 0.00 0.00 1.70 0.00 0.00 3.10 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.50 1.58 7.81 125 A 8.21 3.99 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 V 8.64 4.03 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 1.58 0.00 0.00 1.18 0.00 0.00 127 A 8.70 4.12 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 0.00 128 T 7.86 4.50 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 1.36 0.00 0.00 129 V 9.13 3.77 1.78 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 -0.13 0.00 0.00 0.61 0.00 0.00 130 G 6.62 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 P 0.00 4.80 0.00 1.96 2.08 0.00 3.42 0.00 0.00 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.18 0.00 132 I 8.51 4.67 1.88 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 1.38 1.07 1.04 0.00 0.00 133 S 8.93 4.77 0.00 4.19 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 0.00 134 V 8.85 4.77 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 0.63 0.00 0.00 0.82 0.00 0.00 135 A 8.01 5.11 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 0.00 136 I 8.57 4.64 1.72 0.00 0.00 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.89 0.81 0.00 0.00 137 D 8.81 4.71 0.00 2.79 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 0.00 138 A 8.74 3.97 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 G 7.83 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 0.00 0.00 0.00 140 H 7.68 4.97 0.00 3.38 3.24 0.00 5.82 0.00 0.00 0.00 0.00 6.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 E 8.83 3.75 0.00 1.37 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 2.33 2.20 0.00 142 S 8.15 4.30 0.00 4.33 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 F 8.56 4.09 0.00 3.25 3.44 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 0.00 144 L 8.19 4.48 0.00 1.66 1.57 0.75 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 0.00 145 F 8.04 5.05 0.00 3.16 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 0.00 146 Y 7.57 4.14 0.00 3.07 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 0.00 147 K 7.39 3.75 0.00 1.43 1.50 0.00 1.75 0.00 0.00 1.60 0.00 0.00 2.86 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.13 1.38 7.81 148 E 6.90 4.14 0.00 1.71 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 2.08 0.00 149 G 8.60 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 0.00 150 I 7.92 4.47 1.94 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.56 1.06 0.00 0.00 151 Y 9.72 4.52 0.00 2.83 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 0.00 152 F 8.36 4.72 0.00 2.93 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 153 E 7.97 4.27 0.00 1.63 1.49 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 2.12 2.15 0.00 154 P 0.00 4.14 0.00 2.08 2.20 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 2.08 2.28 0.00 155 D 8.10 4.66 0.00 2.65 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 0.00 156 C 7.65 4.46 0.00 2.83 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 0.00 157 S 9.40 4.63 0.00 3.83 3.90 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 0.00 158 S 8.53 4.63 0.00 3.93 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 0.00 159 E 8.07 4.46 0.00 1.90 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 2.19 2.28 0.00 160 D 8.33 4.85 0.00 2.56 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 0.00 161 M 8.41 4.97 0.00 1.92 1.86 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.56 0.00 162 D 8.96 4.80 0.00 2.54 2.62 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 0.00 163 H 8.06 4.85 0.00 3.07 2.88 0.00 5.83 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 164 G 8.51 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 0.00 0.00 0.00 0.00 165 V 8.53 4.48 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 0.31 0.00 0.00 0.85 0.00 0.00 166 L 8.23 5.00 0.00 1.74 1.45 1.07 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 167 V 8.87 4.51 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 1.21 0.00 0.00 0.79 0.00 0.00 168 V 9.70 4.55 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 1.31 0.00 0.00 169 G 7.68 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 0.00 170 Y 6.99 4.90 0.00 2.70 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 0.00 171 G 7.35 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 172 F 7.28 5.13 0.00 2.94 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 0.00 173 E 9.65 3.82 0.00 2.27 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 2.35 2.38 0.00 *179 N 8.91 4.45 0.00 2.91 2.97 0.00 0.00 5.97 6.96 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 0.00 180 N 8.64 4.15 0.00 3.04 2.99 0.00 0.00 6.91 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 181 K 7.28 4.59 0.00 1.77 1.53 0.00 1.48 0.00 0.00 1.64 0.00 0.00 2.90 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.47 1.38 7.81 182 Y 8.23 5.41 0.00 3.20 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 0.00 183 W 9.61 5.13 0.00 3.45 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 0.00 184 L 9.34 5.03 0.00 2.05 1.80 1.02 0.65 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 0.00 185 V 8.93 5.00 2.36 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 0.99 0.00 0.00 1.10 0.00 0.00 186 K 9.38 3.63 0.00 1.76 1.55 0.00 1.71 0.00 0.00 1.54 0.00 0.00 2.75 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.10 0.71 7.81 187 N 8.16 4.96 0.00 2.40 2.39 0.00 0.00 7.03 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 0.00 188 S 7.45 4.60 0.00 2.94 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 189 W 8.13 4.68 0.00 2.94 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 0.00 190 G 8.22 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 191 E 8.18 4.43 0.00 2.39 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.33 0.00 192 E 8.16 4.11 0.00 2.05 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.40 0.00 193 W 8.10 4.39 0.00 3.67 3.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 194 G 7.17 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 195 M 8.82 4.14 0.00 2.21 1.94 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.47 0.00 196 G 9.42 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 197 G 8.81 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 0.00 0.00 0.00 198 Y 7.98 5.23 0.00 3.28 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 0.00 199 V 8.92 4.66 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 0.93 0.00 0.00 -0.13 0.00 0.00 200 K 8.69 4.98 0.00 1.92 1.56 0.00 0.61 0.00 0.00 1.15 0.00 0.00 2.75 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.16 1.34 7.81 201 M 9.18 5.06 0.00 2.27 2.34 0.00 0.00 0.00 0.00 0.00 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.74 2.80 0.00 202 A 8.72 4.43 1.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 203 K 8.73 4.63 0.00 0.89 1.41 0.00 0.61 0.00 0.00 0.82 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.80 0.35 7.81 204 D 9.14 4.63 0.00 2.82 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 0.00 205 R 7.74 4.60 0.00 2.05 2.03 0.00 3.16 0.00 0.00 3.33 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.82 0.00 206 R 8.58 3.82 0.00 2.02 2.03 0.00 3.41 0.00 0.00 3.22 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.65 0.00 207 N 8.51 4.27 0.00 3.01 2.82 0.00 0.00 6.92 8.05 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 0.00 208 H 7.96 4.47 0.00 3.69 3.52 0.00 5.97 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 0.00 209 C 8.83 4.11 0.00 3.20 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 0.00 210 G 8.17 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 0.00 211 I 7.76 3.64 1.83 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 0.70 1.07 0.83 0.00 0.00 212 A 8.83 4.50 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 0.00 213 S 8.06 4.28 0.00 4.00 3.90 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 0.00 214 A 7.44 4.75 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 215 A 7.80 4.95 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 0.00 216 S 9.52 5.53 0.00 4.09 4.12 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 0.00 217 Y 7.87 5.03 0.00 2.87 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 0.00 218 P 0.00 4.51 0.00 1.85 1.08 0.00 3.61 0.00 0.00 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.65 0.00 219 T 8.55 4.25 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 1.18 0.00 0.00 220 V 8.17 3.96 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 0.83 0.00 0.00 0.95 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.