NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.6105 8.2048 117.5795 54.8279 32.5741 174.5520 2 R 3.9808 9.0047 119.0530 56.5258 31.6872 175.9599 3 L 2.8202 8.6714 117.2736 51.2538 43.8639 175.1529 4 P 4.8921 0.0000 0.0000 62.4800 33.1802 176.4025 5 I 4.8355 8.6437 123.8410 59.0237 42.1289 173.6416 6 L 5.0244 8.6590 129.3784 53.4834 44.8402 174.9320 7 I 4.6800 8.8924 128.4215 59.7490 39.4721 174.9619 8 I 4.7252 8.8230 129.5072 60.0447 38.7898 174.6853 9 N 4.9773 9.1943 128.4046 52.3578 39.3428 175.8883 10 F 4.7620 9.4818 126.3122 58.2617 40.2416 177.2218 11 K 3.5819 8.1442 120.7628 58.0248 31.1664 175.4719 12 A 4.6614 7.9827 128.7157 52.9164 19.5839 176.1238 13 Y 4.3677 7.4764 117.7853 59.4937 38.5783 178.3089 14 G 3.7178 8.9531 113.2243 48.5658 0.0000 175.3632 15 E 3.9668 8.3458 118.0081 58.3261 29.2671 177.3190 16 A 4.4142 8.0902 120.3105 51.4918 19.8560 175.6633 17 A 4.4561 8.0801 121.9842 51.8304 21.5569 179.0805 18 G 3.8174 8.5697 107.5132 46.3984 0.0000 176.9012 19 K 4.0232 8.6483 119.0943 59.4616 31.9429 178.8558 20 R 3.9322 7.9941 117.8325 58.9483 29.7959 178.8038 21 A 4.2506 7.9258 122.1094 54.7417 18.3726 179.8754 22 V 3.6153 7.8185 116.2237 66.0617 31.6688 177.8477 23 E 3.9480 8.2423 118.3740 59.3927 29.3782 179.1340 24 L 3.8742 8.4254 120.3933 58.0527 42.0133 178.7742 25 A 4.2560 8.4605 120.8835 55.3294 18.2638 179.7947 26 K 3.9532 8.4911 116.9626 59.5107 32.0739 179.5030 27 A 4.0767 8.2217 121.0218 55.0326 18.2122 179.5666 28 A 4.0032 8.1642 119.4585 55.1664 18.3969 179.4885 29 E 3.8816 8.5195 118.1959 59.4279 29.7364 179.1169 30 R 3.9492 8.3401 118.0747 59.3853 30.1889 178.7508 31 A 4.0555 8.2882 120.1585 55.2127 18.3435 179.4681 32 A 4.0208 8.2704 119.2800 55.5508 18.2586 180.1769 33 R 3.9328 8.0387 115.4103 59.3642 30.2060 178.7365 34 E 4.1554 8.5931 118.0157 58.8492 29.6120 178.5013 35 L 4.5356 8.0467 116.0819 53.2968 42.6534 176.5520 36 G 3.9181 8.1552 106.9298 46.7859 0.0000 173.7873 37 V 4.3055 7.6342 117.1051 60.3711 34.4258 174.8006 38 N 4.6090 8.5041 124.6284 53.2341 38.9360 172.6002 39 I 4.8056 8.0785 126.1232 59.4606 38.9914 175.2641 40 V 4.5071 9.0085 127.5565 60.8469 34.4833 174.5340 41 V 4.6791 8.1158 124.9389 59.8889 34.4762 174.4256 42 A 5.6026 8.6321 125.6226 48.2153 19.6987 173.7432 43 P 4.6185 0.0000 0.0000 61.7436 33.1340 176.2549 44 N 4.5094 8.7633 117.2221 52.7736 38.3604 175.4688 45 H 4.1430 8.8937 117.0199 59.6608 28.5067 177.8240 46 L 4.1146 7.9500 118.8486 56.9002 41.3808 178.3259 47 E 4.5619 8.3958 116.5161 55.6992 30.0029 177.3159 48 L 4.0668 7.7479 122.0621 58.2630 42.2094 179.0224 49 G 3.6224 8.0494 104.7964 47.7077 0.0000 174.8750 50 L 3.9409 7.8793 121.3650 57.9682 42.3211 178.8170 51 V 3.7643 8.2372 118.3765 66.1436 31.2445 178.0049 52 S 4.1436 8.2005 114.2437 61.3955 62.7192 175.7747 53 Q 4.4422 7.7624 117.6442 55.9999 28.7585 176.2960 54 S 4.6960 8.1804 115.7959 58.3393 64.8412 173.8976 55 V 4.6024 7.4798 111.5228 60.0215 35.3948 174.5597 56 D 4.8534 10.0018 120.0450 54.0536 41.8137 177.1293 57 I 4.0912 7.4434 112.7249 59.3837 38.8745 173.7061 58 P 4.4368 0.0000 0.0000 62.6550 32.6160 175.6350 59 V 4.5772 8.4719 123.1186 61.5244 34.0216 173.7283 60 Y 5.3720 8.9774 126.0373 56.4425 40.4901 175.1725 61 A 4.6742 8.9793 124.6440 51.6178 19.6319 179.0138 62 Q 3.8843 9.0443 119.3386 57.5583 29.1332 176.2088 63 G 4.4261 7.5894 104.6320 45.4864 0.0000 171.4418 64 A 4.6213 8.0884 120.3802 51.3530 21.6039 175.7787 65 D 4.8759 8.8574 116.5649 52.8377 41.5199 175.4953 66 V 4.3521 7.4635 118.6895 61.7248 35.0177 175.5157 67 E 4.0159 9.0478 126.3992 59.0136 30.1056 176.6761 68 A 4.8955 7.7156 119.1483 49.5176 22.0971 175.7181 69 G 3.8316 8.5324 109.0039 45.2204 0.0000 174.8497 70 G 3.6068 8.0094 104.9878 44.9884 0.0000 173.5996 71 A 4.2827 7.7397 119.7332 51.6965 17.2241 177.4026 72 H 5.0106 7.6060 120.6558 53.1415 29.7568 173.5121 73 T 3.9589 7.8672 115.6031 65.2577 69.1927 174.4266 74 A 3.6792 8.7554 126.4951 53.1323 16.1585 176.3667 75 H 4.9402 7.9603 114.3444 55.1600 32.0300 174.1783 76 V 4.3792 8.8414 120.0256 61.3339 33.5555 174.5161 77 S 5.6558 8.3390 122.3334 56.1676 65.5022 175.1886 78 L 3.9486 8.6104 121.9873 58.2423 41.3467 179.6891 79 E 3.9791 7.9273 118.4070 59.6042 29.3117 179.2533 80 N 4.5603 8.0734 117.7359 55.6974 38.5665 177.5104 81 I 3.6679 7.7730 121.3151 64.2835 37.2195 178.3862 82 K 3.9582 8.0917 120.3655 59.6289 31.8108 178.7774 83 E 4.0212 8.6081 118.9231 59.0544 29.1402 178.6701 84 A 4.3055 8.0900 119.5540 52.8120 18.6249 178.0974 85 G 4.0380 7.7796 105.2833 44.9699 0.0000 174.4970 86 G 3.8436 7.9244 108.4365 45.6231 0.0000 174.1400 87 S 4.6733 8.7913 116.2064 58.0754 65.0670 173.6500 88 G 3.7157 7.5662 106.2543 45.7266 0.0000 172.4349 89 V 5.0009 7.9811 118.4485 60.2249 35.1299 173.8754 90 I 4.9996 8.7535 123.9621 59.8465 39.5128 174.7134 91 L 4.8742 8.5148 125.5321 53.3550 45.9451 176.1493 92 N 4.3453 8.9768 118.2012 54.6927 37.4568 173.8912 93 H 4.2942 8.0732 114.8010 55.4944 30.6481 175.7526 94 S 4.1622 8.4440 120.8016 61.9894 62.6840 175.8796 95 E 4.1780 8.4493 116.7901 57.9066 30.1701 176.5713 96 A 4.7270 8.1088 121.8408 49.8730 19.1331 174.5041 97 P 4.5576 0.0000 0.0000 62.4546 32.5009 176.5878 98 L 4.8079 8.4882 120.5421 52.5010 44.4930 177.2888 99 K 4.1433 8.2574 120.4068 56.0074 33.7854 177.9790 100 L 3.9140 8.5184 125.0671 58.5050 41.9361 179.1098 101 N 4.2890 8.1124 115.6561 56.5600 38.5136 177.0057 102 D 4.3069 7.9772 119.6135 57.1246 40.9548 178.1720 103 L 3.8785 8.2922 121.0947 58.1868 42.1622 178.8154 104 A 3.9316 8.2026 120.7275 55.4292 18.2421 179.8808 105 R 3.8738 7.7164 116.4877 59.3625 30.0263 179.3517 106 L 3.9387 8.3364 119.2966 57.5905 41.5469 179.7977 107 V 3.4843 8.0032 118.1112 65.8048 31.5377 177.9010 108 A 3.9064 7.7343 120.0366 55.0984 18.1489 179.4370 109 K 3.8162 8.2554 118.0936 59.6576 32.2515 178.7548 110 A 3.9683 8.2681 121.2945 55.1527 18.2459 179.8042 111 K 3.9699 8.2315 117.3181 59.4875 31.9278 179.6221 112 S 4.2274 8.0370 113.0741 60.4288 63.0497 175.4328 113 L 4.4089 7.4135 121.2567 54.4058 41.7227 177.2484 114 G 3.8974 7.9473 107.3268 45.5356 0.0000 173.4363 115 L 4.5992 7.4796 118.7253 53.5464 43.2016 176.4973 116 D 4.5738 8.7051 122.8830 54.0587 42.5165 175.8325 117 V 4.4929 8.5648 121.0533 59.8773 34.8190 174.1957 118 V 4.8656 8.5679 124.4569 60.9347 34.4758 174.0728 119 V 4.8126 8.7079 127.6632 61.3942 33.7685 174.6306 120 C 5.0561 9.0408 125.8264 59.5044 29.6184 172.8382 121 A 4.6674 8.2919 120.6903 50.4486 21.7469 176.1049 122 P 4.3370 0.0000 0.0000 64.4385 31.9700 175.8533 123 D 4.6343 7.5781 116.5191 50.4863 43.4220 174.1404 124 P 4.5182 0.0000 0.0000 65.2304 31.3087 178.8555 125 R 3.8874 7.9526 116.9695 59.9126 30.0317 178.5650 126 T 4.0039 8.7866 115.8465 66.5057 68.3286 177.1200 127 S 4.1515 8.3215 117.6732 61.2170 62.8028 176.4197 128 L 4.0303 8.2182 123.2255 58.1398 41.6769 178.8173 129 A 4.0098 7.7657 119.0847 55.1519 18.5547 179.1294 130 A 4.0146 8.2390 119.0502 55.2483 18.3989 179.5871 131 A 3.8470 8.3256 119.4443 55.3134 18.2519 179.5917 132 A 2.5800 7.5441 117.7929 54.1931 18.3868 179.0681 133 L 4.1041 7.5247 116.0631 55.2649 41.9330 177.4821 134 G 3.7142 7.8416 107.3702 45.1306 0.0000 172.0547 135 P 4.5058 0.0000 0.0000 61.7698 32.8004 175.7250 136 H 4.4788 8.6331 114.9874 58.5728 29.5315 175.8644 137 A 5.2681 7.8764 117.5752 50.3821 23.0369 175.0764 138 V 4.7113 9.0007 119.7821 61.0555 34.6895 174.5646 139 A 5.4129 9.2648 130.2390 49.1488 20.3380 175.5306 140 V 4.0401 8.1517 121.6274 62.7275 32.7879 175.4685 141 E 5.0853 9.2118 126.0739 53.4749 31.8412 171.0765 142 P 4.6243 0.0000 0.0000 61.2707 31.8896 176.0147 143 P 4.3538 0.0000 0.0000 65.2510 31.6480 178.6047 144 E 3.9988 8.2740 117.0595 59.1944 29.6220 177.9621 145 L 4.2783 7.8322 116.9948 55.6714 42.2677 176.8885 146 I 3.8464 7.2293 120.1440 62.8661 37.2127 176.4025 147 G 4.0059 8.9493 112.6440 46.1806 0.0000 173.9564 148 T 4.1434 8.1134 109.5430 61.5117 69.4823 176.2831 149 G 3.9817 8.3853 109.7369 45.5134 0.0000 174.3431 150 R 4.5401 7.4876 119.1207 53.7901 28.8517 174.8817 151 A 4.2555 8.4474 124.0382 52.3092 19.2553 179.2938 152 V 3.7020 8.7771 122.5405 64.8317 31.4142 178.5348 153 S 4.2543 7.9964 112.7195 59.7418 63.4728 174.9434 154 R 4.0374 7.8600 119.9438 58.2170 30.4550 177.1430 155 Y 4.5636 7.4115 111.7928 58.6795 39.1958 175.7932 156 K 5.4386 8.4896 121.9637 53.0145 32.6493 175.6273 157 P 4.3186 0.0000 0.0000 66.0272 31.3342 177.3038 158 E 3.9352 8.2738 117.8807 59.3442 29.4232 178.7982 159 A 4.0449 8.0257 120.7262 55.1477 18.3395 179.8947 160 I 3.6367 7.5307 117.7239 64.4982 37.3220 178.4304 161 V 3.5684 7.8425 119.0937 66.1146 31.3499 177.6595 162 E 3.9224 8.5815 119.2538 59.5220 29.5077 178.8197 163 T 3.8435 7.8282 115.6279 66.6443 68.5666 176.5818 164 V 3.7036 8.2425 120.6260 66.1170 31.2957 178.3188 165 G 3.5969 8.1736 104.2714 47.6569 0.0000 175.4220 166 L 4.1590 8.4184 121.8823 57.5705 41.7388 179.7762 167 V 3.7078 8.1172 118.6794 66.0967 31.3280 178.1814 168 S 4.4381 8.0506 112.2584 60.7722 62.8806 175.6436 169 R 4.0673 7.5553 120.8894 57.8280 29.9667 176.6586 170 H 4.3279 7.7019 113.5159 55.9199 32.0229 174.5410 171 F 5.1475 8.3783 117.5241 53.2806 39.2394 173.5473 172 P 4.2482 0.0000 0.0000 65.7348 31.2498 178.6008 173 E 4.0753 8.2789 118.1202 58.8409 29.7005 176.6891 174 V 4.2219 7.9483 119.6651 62.7527 32.1391 176.2803 175 S 4.7371 8.9101 123.8794 57.7027 65.2282 173.0859 176 V 4.9413 8.2952 121.5007 61.2673 34.0337 174.4844 177 I 4.8904 8.7990 121.1848 59.5417 41.4608 173.5217 178 T 5.0312 8.1537 115.7404 61.3074 71.4703 172.0216 179 G 4.3787 8.9963 109.1804 46.5408 0.0000 173.1669 180 A 4.0985 8.1393 120.1630 53.6945 18.9095 179.7444 181 G 3.9630 8.8659 110.5974 45.7147 0.0000 172.8930 182 I 3.7063 7.7692 120.2683 62.0401 36.9189 175.1040 183 E 4.6295 9.8969 123.8729 55.8142 31.5389 175.9758 184 S 4.8941 7.9289 113.0271 55.2056 66.5641 174.7576 185 G 3.7512 9.3803 108.3306 48.3015 0.0000 175.8092 186 D 4.3743 7.9635 120.6392 57.3198 40.7212 178.5157 187 D 4.2975 8.0848 119.5474 57.1146 40.7545 178.8263 188 V 3.5323 7.7585 118.0592 66.0886 31.6123 177.6046 189 A 3.9588 8.1376 120.1346 55.1102 18.1286 179.3060 190 A 3.8659 8.2199 119.0199 55.2655 18.3341 179.4386 191 A 3.9305 8.1527 119.3764 55.5482 18.4713 179.8396 192 L 4.1977 7.9154 118.4903 57.6085 41.4930 180.0301 193 R 3.9981 8.1996 117.1642 59.0949 30.0612 178.3396 194 L 4.3200 7.7183 115.8611 55.0531 41.6852 177.6230 195 G 4.0975 7.8547 107.1084 45.4545 0.0000 174.5888 196 T 4.3715 7.8311 117.0308 63.5929 69.3329 175.1561 197 R 4.5859 9.7073 122.4516 54.4935 30.6204 176.4087 198 G 4.2295 6.9193 105.3059 46.8094 0.0000 171.4996 199 V 4.8735 8.1848 118.4384 61.1967 34.3711 173.7542 200 L 5.3696 9.1147 127.5003 53.1990 44.8627 175.2344 201 L 4.7034 8.9510 124.8530 55.0849 44.1971 174.5877 202 A 4.7580 8.6135 118.8684 51.2560 21.7010 178.2469 203 S 3.8511 8.0683 108.8296 61.6320 62.8862 176.7477 204 A 3.9122 7.9746 122.3998 55.4872 18.3367 179.1867 205 A 4.0512 7.8251 118.1504 55.3075 18.6710 179.8375 206 V 3.3977 7.8809 115.6852 65.2601 31.5805 177.3444 207 K 4.2387 7.9446 115.2124 54.9063 32.6756 176.5205 208 A 4.1392 7.0191 122.8737 51.9431 18.9095 178.6057 209 K 4.0942 8.5992 120.8675 58.6408 32.6288 176.9260 210 D 4.7682 7.6002 118.2546 50.4313 41.4249 173.5360 211 P 4.1707 0.0000 0.0000 65.4777 31.5187 176.7109 212 Y 4.1027 8.1434 117.0023 60.8297 38.6943 177.9854 213 A 3.7506 8.3263 121.3116 55.0171 18.5077 179.4400 214 K 3.8135 8.4122 118.4040 59.8183 32.2826 179.0314 215 I 3.6483 8.3766 120.5422 64.2166 36.9311 178.5846 216 V 3.3925 7.6382 119.2585 65.8067 31.0781 177.5979 217 E 3.8643 7.8305 117.7798 59.3903 29.5329 178.5789 218 L 4.0912 7.8152 117.5207 57.7170 41.9945 179.0067 219 A 4.1404 8.5216 120.8026 54.1440 18.3973 179.1824 220 K 3.7297 8.0937 118.8327 59.6881 32.1470 176.9391 221 P 4.6041 0.0000 0.0000 64.6256 30.9731 178.4727 222 L 4.0824 8.0574 118.1955 57.3171 41.5107 178.9609 223 S 4.3661 7.8541 113.6773 61.1260 63.4750 176.0331 224 E 4.0945 8.0401 121.7804 58.9758 29.1257 179.2200 225 L 4.0056 7.9076 121.9025 56.1090 42.0916 177.8162 *226 R 4.1530 8.0604 120.8414 55.9692 30.0397 177.8519 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 M 8.20 4.61 0.00 2.40 2.25 0.00 0.00 0.00 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.53 0.00 2 R 9.00 3.98 0.00 1.92 1.92 0.00 3.23 0.00 0.00 3.23 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.72 0.00 3 L 8.67 2.82 0.00 1.66 1.55 0.93 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.00 0.00 4 P 0.00 4.89 0.00 1.93 1.98 0.00 3.62 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.08 0.00 5 I 8.64 4.84 2.04 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 1.07 1.83 0.99 0.00 0.00 6 L 8.66 5.02 0.00 1.77 1.46 0.92 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 7 I 8.89 4.68 1.88 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.70 0.86 0.00 0.00 8 I 8.82 4.73 2.14 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 1.31 1.17 1.13 0.00 0.00 9 N 9.19 4.98 0.00 2.89 2.80 0.00 0.00 6.85 7.67 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 10 F 9.48 4.76 0.00 3.20 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 K 8.14 3.58 0.00 1.41 1.29 0.00 1.59 0.00 0.00 1.69 0.00 0.00 2.96 0.00 0.00 3.22 0.00 0.00 0.00 0.00 1.41 1.58 7.81 12 A 7.98 4.66 1.15 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 0.00 0.00 13 Y 7.48 4.37 0.00 3.15 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 14 G 8.95 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 15 E 8.35 3.97 0.00 1.84 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 2.22 2.33 0.00 16 A 8.09 4.41 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 17 A 8.08 4.46 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 18 G 8.57 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 19 K 8.65 4.02 0.00 1.86 1.89 0.00 1.59 0.00 0.00 1.83 0.00 0.00 3.13 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.54 1.61 7.81 20 R 7.99 3.93 0.00 2.19 2.05 0.00 3.35 0.00 0.00 3.15 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.64 0.00 21 A 7.93 4.25 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 22 V 7.82 3.62 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.98 0.00 0.00 23 E 8.24 3.95 0.00 2.23 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 2.33 2.45 0.00 24 L 8.43 3.87 0.00 1.49 1.42 0.78 -0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 25 A 8.46 4.26 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 K 8.49 3.95 0.00 2.05 1.89 0.00 1.69 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.48 1.60 7.81 27 A 8.22 4.08 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 0.00 0.00 28 A 8.16 4.00 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 29 E 8.52 3.88 0.00 2.16 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.37 0.00 30 R 8.34 3.95 0.00 2.26 2.08 0.00 3.04 0.00 0.00 3.01 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.81 0.00 31 A 8.29 4.06 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 32 A 8.27 4.02 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 R 8.04 3.93 0.00 1.83 2.03 0.00 3.19 0.00 0.00 3.24 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.82 0.00 34 E 8.59 4.16 0.00 2.28 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 0.00 2.55 2.49 0.00 35 L 8.05 4.54 0.00 1.60 1.69 0.89 0.76 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 36 G 8.16 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 V 7.63 4.31 2.07 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 0.83 0.00 0.00 0.92 0.00 0.00 38 N 8.50 4.61 0.00 2.89 2.91 0.00 0.00 7.00 7.97 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 39 I 8.08 4.81 1.86 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.87 0.91 0.00 0.00 40 V 9.01 4.51 1.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.18 0.00 0.00 0.59 0.00 0.00 41 V 8.12 4.68 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.56 0.00 0.00 1.04 0.00 0.00 42 A 8.63 5.60 1.19 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 43 P 0.00 4.62 0.00 2.08 1.84 0.00 3.76 0.00 0.00 3.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.84 0.00 44 N 8.76 4.51 0.00 2.96 3.23 0.00 0.00 5.89 7.90 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 45 H 8.89 4.14 0.00 3.21 3.39 0.00 5.64 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 46 L 7.95 4.11 0.00 1.83 1.76 0.94 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 47 E 8.40 4.56 0.00 2.02 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.51 0.00 48 L 7.75 4.07 0.00 1.77 1.69 0.97 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 49 G 8.05 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 50 L 7.88 3.94 0.00 1.65 1.92 0.94 0.96 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 51 V 8.24 3.76 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 1.07 0.00 0.00 1.07 0.00 0.00 52 S 8.20 4.14 0.00 4.14 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 53 Q 7.76 4.44 0.00 2.06 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.73 0.00 0.00 0.00 0.00 0.00 2.36 2.40 0.00 54 S 8.18 4.70 0.00 3.94 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 55 V 7.48 4.60 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 0.78 0.00 0.00 0.97 0.00 0.00 56 D 10.00 4.85 0.00 2.61 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 57 I 7.44 4.09 2.02 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 1.42 0.50 0.92 0.00 0.00 58 P 0.00 4.44 0.00 1.93 2.10 0.00 3.61 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.09 0.00 59 V 8.47 4.58 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 1.10 0.00 0.00 0.91 0.00 0.00 60 Y 8.98 5.37 0.00 2.81 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 A 8.98 4.67 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 62 Q 9.04 3.88 0.00 1.92 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.93 0.00 0.00 0.00 0.00 0.00 2.42 2.43 0.00 63 G 7.59 4.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 A 8.09 4.62 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 D 8.86 4.88 0.00 2.62 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 66 V 7.46 4.35 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 0.90 0.00 0.00 0.68 0.00 0.00 67 E 9.05 4.02 0.00 1.93 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 2.36 2.28 0.00 68 A 7.72 4.90 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 69 G 8.53 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 0.00 0.00 0.00 70 G 8.01 3.61 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 0.00 0.00 0.00 71 A 7.74 4.28 1.19 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 72 H 7.61 5.01 0.00 3.18 3.19 0.00 5.64 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 T 7.87 3.96 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 74 A 8.76 3.68 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 75 H 7.96 4.94 0.00 3.22 3.36 0.00 5.61 0.00 0.00 0.00 0.00 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 V 8.84 4.38 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 1.03 0.00 0.00 0.63 0.00 0.00 77 S 8.34 5.66 0.00 4.02 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 L 8.61 3.95 0.00 1.86 1.73 0.93 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 79 E 7.93 3.98 0.00 1.95 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 2.32 2.53 0.00 80 N 8.07 4.56 0.00 2.95 2.86 0.00 0.00 6.60 7.26 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 81 I 7.77 3.67 2.04 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 1.08 0.90 0.00 0.00 82 K 8.09 3.96 0.00 1.82 1.96 0.00 1.62 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.43 1.47 7.81 83 E 8.61 4.02 0.00 2.03 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 2.33 2.42 0.00 84 A 8.09 4.31 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 85 G 7.78 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 86 G 7.92 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 87 S 8.79 4.67 0.00 3.95 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 G 7.57 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 89 V 7.98 5.00 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 0.61 0.00 0.00 0.90 0.00 0.00 90 I 8.75 5.00 2.06 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.90 0.97 0.00 0.00 91 L 8.51 4.87 0.00 1.52 1.49 0.88 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 92 N 8.98 4.35 0.00 2.82 3.02 0.00 0.00 6.98 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 93 H 8.07 4.29 0.00 3.28 3.16 0.00 5.95 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 S 8.44 4.16 0.00 3.76 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 95 E 8.45 4.18 0.00 2.01 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 2.38 0.00 96 A 8.11 4.73 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 97 P 0.00 4.56 0.00 2.19 2.07 0.00 3.73 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 1.99 2.00 0.00 98 L 8.49 4.81 0.00 1.61 1.58 0.91 1.08 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 99 K 8.26 4.14 0.00 1.92 1.71 0.00 1.89 0.00 0.00 1.73 0.00 0.00 2.91 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.52 1.49 7.81 100 L 8.52 3.91 0.00 1.74 1.66 0.90 0.66 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 0.00 101 N 8.11 4.29 0.00 2.83 2.84 0.00 0.00 7.09 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 0.00 102 D 7.98 4.31 0.00 2.79 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 0.00 103 L 8.29 3.88 0.00 1.81 1.88 0.90 0.84 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 0.00 104 A 8.20 3.93 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 0.00 105 R 7.72 3.87 0.00 1.93 2.14 0.00 3.11 0.00 0.00 3.14 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.64 0.00 106 L 8.34 3.94 0.00 1.75 1.68 0.94 0.67 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 0.00 107 V 8.00 3.48 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 0.95 0.00 0.00 0.95 0.00 0.00 108 A 7.73 3.91 1.34 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 0.00 109 K 8.26 3.82 0.00 1.99 1.86 0.00 1.51 0.00 0.00 1.63 0.00 0.00 3.14 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.41 1.48 7.81 110 A 8.27 3.97 1.34 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 0.00 111 K 8.23 3.97 0.00 1.97 1.82 0.00 1.69 0.00 0.00 1.60 0.00 0.00 2.90 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.29 1.42 7.81 112 S 8.04 4.23 0.00 4.02 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 0.00 113 L 7.41 4.41 0.00 1.71 1.73 0.90 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 114 G 7.95 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 0.00 0.00 0.00 115 L 7.48 4.60 0.00 1.67 1.48 0.87 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 116 D 8.71 4.57 0.00 2.02 2.34 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 0.00 117 V 8.56 4.49 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 0.73 0.00 0.00 0.88 0.00 0.00 118 V 8.57 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 1.07 0.00 0.00 119 V 8.71 4.81 2.07 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 0.84 0.00 0.00 0.90 0.00 0.00 120 C 9.04 5.06 0.00 3.01 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 0.00 121 A 8.29 4.67 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 0.00 122 P 0.00 4.34 0.00 2.19 2.10 0.00 3.88 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 2.11 2.02 0.00 123 D 7.58 4.63 0.00 2.90 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 0.00 124 P 0.00 4.52 0.00 2.19 2.23 0.00 3.89 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.19 0.00 125 R 7.95 3.89 0.00 1.88 1.93 0.00 3.18 0.00 0.00 3.34 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.73 0.00 126 T 8.79 4.00 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 1.21 0.00 0.00 127 S 8.32 4.15 0.00 4.07 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 L 8.22 4.03 0.00 1.87 1.93 1.05 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 129 A 7.77 4.01 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 0.00 130 A 8.24 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 0.00 131 A 8.33 3.85 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 0.00 132 A 7.54 2.58 1.15 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 0.00 0.00 133 L 7.52 4.10 0.00 1.62 1.64 0.87 0.75 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 0.00 134 G 7.84 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 0.00 135 P 0.00 4.51 0.00 2.43 2.03 0.00 3.81 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 1.95 1.94 0.00 136 H 8.63 4.48 0.00 3.27 3.39 0.00 5.59 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 0.00 137 A 7.88 5.27 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 0.00 138 V 9.00 4.71 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 1.05 0.00 0.00 0.96 0.00 0.00 139 A 9.26 5.41 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 0.00 140 V 8.15 4.04 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 0.77 0.00 0.00 0.95 0.00 0.00 141 E 9.21 5.09 0.00 2.16 1.80 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 2.19 2.25 0.00 142 P 0.00 4.62 0.00 2.24 2.09 0.00 4.06 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.10 0.00 143 P 0.00 4.35 0.00 2.17 2.09 0.00 3.61 0.00 0.00 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.19 0.00 144 E 8.27 4.00 0.00 1.94 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 2.32 2.41 0.00 145 L 7.83 4.28 0.00 1.75 1.90 1.08 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 146 I 7.23 3.85 1.90 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.48 0.98 0.00 0.00 147 G 8.95 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 0.00 148 T 8.11 4.14 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 1.33 0.00 0.00 149 G 8.39 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 0.00 150 R 7.49 4.54 0.00 1.79 1.86 0.00 3.16 0.00 0.00 3.14 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 1.46 0.00 151 A 8.45 4.26 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 0.00 152 V 8.78 3.70 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 0.80 0.00 0.00 0.96 0.00 0.00 153 S 8.00 4.25 0.00 3.97 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 0.00 154 R 7.86 4.04 0.00 1.20 0.94 0.00 2.77 0.00 0.00 3.00 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.54 0.00 155 Y 7.41 4.56 0.00 3.03 3.03 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 K 8.49 5.44 0.00 1.80 1.69 0.00 1.73 0.00 0.00 1.82 0.00 0.00 2.95 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.36 1.37 7.81 157 P 0.00 4.32 0.00 2.29 2.27 0.00 3.77 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.04 0.00 158 E 8.27 3.94 0.00 2.09 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 0.00 2.41 2.45 0.00 159 A 8.03 4.04 1.34 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 0.00 160 I 7.53 3.64 2.04 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 1.54 0.60 0.97 0.00 0.00 161 V 7.84 3.57 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 1.08 0.00 0.00 1.00 0.00 0.00 162 E 8.58 3.92 0.00 2.18 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 2.32 2.36 0.00 163 T 7.83 3.84 4.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 164 V 8.24 3.70 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 1.00 0.00 0.00 165 G 8.17 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 0.00 0.00 0.00 166 L 8.42 4.16 0.00 1.86 1.77 0.99 0.86 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 0.00 167 V 8.12 3.71 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 0.99 0.00 0.00 1.05 0.00 0.00 168 S 8.05 4.44 0.00 4.07 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 0.00 169 R 7.56 4.07 0.00 1.87 2.03 0.00 3.12 0.00 0.00 3.15 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.50 0.00 170 H 7.70 4.33 0.00 2.38 1.49 0.00 5.70 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 0.00 171 F 8.38 5.15 0.00 3.10 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 0.00 172 P 0.00 4.25 0.00 2.19 2.22 0.00 3.85 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 2.02 2.00 0.00 173 E 8.28 4.08 0.00 2.13 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 0.00 2.44 2.41 0.00 174 V 7.95 4.22 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.00 0.00 1.00 0.00 0.00 175 S 8.91 4.74 0.00 4.00 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 0.00 176 V 8.30 4.94 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 1.15 0.00 0.00 0.97 0.00 0.00 177 I 8.80 4.89 1.93 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.86 0.96 0.00 0.00 178 T 8.15 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 0.00 179 G 9.00 4.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 180 A 8.14 4.10 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 0.00 181 G 8.87 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 0.00 182 I 7.77 3.71 1.90 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.87 0.92 0.00 0.00 183 E 9.90 4.63 0.00 2.00 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 2.39 2.21 0.00 184 S 7.93 4.89 0.00 4.05 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 185 G 9.38 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 186 D 7.96 4.37 0.00 2.66 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 0.00 187 D 8.08 4.30 0.00 2.79 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 0.00 188 V 7.76 3.53 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 1.00 0.00 0.00 189 A 8.14 3.96 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 0.00 190 A 8.22 3.87 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 0.00 191 A 8.15 3.93 1.41 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 0.00 192 L 7.92 4.20 0.00 1.83 1.73 0.92 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 193 R 8.20 4.00 0.00 1.90 1.99 0.00 3.15 0.00 0.00 3.21 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.94 0.00 194 L 7.72 4.32 0.00 1.77 1.70 0.90 0.85 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 0.00 195 G 7.85 4.10 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 0.00 196 T 7.83 4.37 4.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 197 R 9.71 4.59 0.00 1.81 1.91 0.00 3.46 0.00 0.00 3.19 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.70 0.00 198 G 6.92 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 0.00 0.00 0.00 199 V 8.18 4.87 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 0.91 0.00 0.00 0.94 0.00 0.00 200 L 9.11 5.37 0.00 1.77 1.62 1.03 0.51 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 0.00 201 L 8.95 4.70 0.00 1.80 1.73 0.95 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 202 A 8.61 4.76 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 0.00 0.00 0.00 0.00 0.00 203 S 8.07 3.85 0.00 3.88 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 0.00 204 A 7.97 3.91 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 0.00 205 A 7.83 4.05 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 0.00 206 V 7.88 3.40 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 0.61 0.00 0.00 0.97 0.00 0.00 207 K 7.94 4.24 0.00 1.67 1.67 0.00 1.46 0.00 0.00 1.53 0.00 0.00 3.09 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.24 0.97 7.81 208 A 7.02 4.14 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 0.00 209 K 8.60 4.09 0.00 1.74 1.87 0.00 1.68 0.00 0.00 1.62 0.00 0.00 2.90 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.42 1.40 7.81 210 D 7.60 4.77 0.00 2.63 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 0.00 211 P 0.00 4.17 0.00 2.21 2.08 0.00 3.68 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.12 0.00 212 Y 8.14 4.10 0.00 3.08 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 0.00 213 A 8.33 3.75 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 214 K 8.41 3.81 0.00 1.86 1.91 0.00 1.59 0.00 0.00 1.61 0.00 0.00 3.01 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.58 1.49 7.81 215 I 8.38 3.65 1.93 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.44 0.87 0.00 0.00 216 V 7.64 3.39 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 0.18 0.00 0.00 217 E 7.83 3.86 0.00 1.96 2.13 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 2.29 2.33 0.00 218 L 7.82 4.09 0.00 1.77 1.69 0.90 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 219 A 8.52 4.14 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 0.00 220 K 8.09 3.73 0.00 2.04 1.82 0.00 1.61 0.00 0.00 1.62 0.00 0.00 3.08 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.59 1.49 7.81 221 P 0.00 4.60 0.00 2.18 2.07 0.00 3.99 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 2.26 2.02 0.00 222 L 8.06 4.08 0.00 1.71 1.72 0.96 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 223 S 7.85 4.37 0.00 4.04 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 0.00 224 E 8.04 4.09 0.00 2.14 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 2.39 2.47 0.00 225 L 7.91 4.01 0.00 1.62 1.64 0.92 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 *226 R 8.06 4.15 0.00 1.62 1.73 0.00 3.28 0.00 0.00 3.26 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.69 0.00 * Residues marked with a * may have inaccurate shift predictions.