NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.5457 8.4045 118.8235 54.1875 34.3759 175.9390 2 S 4.2304 7.8864 117.3086 57.4237 63.3665 175.0552 3 L 4.2083 9.0931 124.0661 53.8826 42.9573 175.1726 4 P 4.3436 0.0000 0.0000 62.8268 31.8433 176.0754 5 M 4.4819 8.6895 123.3041 54.4745 34.4319 174.5659 6 L 5.0474 9.0683 122.1511 53.3421 45.0424 174.6798 7 Q 4.9893 9.0128 127.6593 54.1442 32.0100 174.2066 8 V 4.4947 8.3646 126.4501 60.6413 33.3501 174.8360 9 A 4.4444 8.2984 127.7405 51.1039 19.5485 177.6617 10 L 4.2374 8.9164 124.9808 53.1962 41.1521 177.1730 11 D 4.7386 7.7597 130.4518 53.1069 40.7422 175.8665 12 N 5.1418 7.3938 117.2299 51.7175 40.8832 176.8487 13 Q 4.1942 8.4248 119.6555 57.7784 29.7478 175.8525 14 T 4.7267 7.2812 107.3479 59.0974 73.2460 174.5746 15 M 3.6506 8.9902 122.5473 58.3946 31.9329 178.8386 16 D 4.3294 7.8669 118.8305 56.4839 39.3687 178.5245 17 S 4.0044 7.6623 112.7868 61.0399 62.3727 175.7977 18 A 3.9460 7.6403 123.2467 55.6567 18.0174 179.2929 19 Y 4.7492 7.8311 116.5084 60.7874 37.6320 178.6008 20 E 4.0212 7.9676 118.5373 59.4125 29.8309 179.3349 21 T 4.1450 7.4903 115.5426 66.7704 68.8507 177.3097 22 T 3.8702 8.2401 111.9876 64.6203 68.5156 176.5449 23 R 4.0624 8.2211 118.4090 58.8371 29.3218 178.5369 24 L 4.2934 7.8561 118.7819 56.4263 42.3523 177.4272 25 I 4.3497 7.4344 108.7940 60.0560 38.3415 176.7349 26 A 3.5865 7.8429 125.3800 55.3834 18.0230 178.6432 27 E 4.4931 7.9930 111.5680 56.3491 29.6326 176.3043 28 E 4.5390 8.2312 118.0834 56.1338 30.7594 175.7947 29 V 4.5306 7.2914 110.5974 59.5484 35.5648 174.7805 30 D 4.6107 8.7276 120.5887 55.8072 42.0049 177.6726 31 I 4.4598 7.4322 118.3122 59.3073 41.0566 174.7981 32 I 4.3250 8.4745 128.2026 59.7217 38.6292 174.2933 33 E 4.6812 8.8401 130.0034 55.0341 31.1332 175.5057 34 V 4.0395 9.0032 128.4790 62.0778 32.0322 175.6847 35 G 4.3568 8.5928 115.9630 45.4180 0.0000 173.2246 36 T 4.0034 8.7116 117.5987 66.8545 68.4062 176.8954 37 I 3.6789 7.6665 120.9898 64.2188 37.0539 178.0534 38 L 4.4990 7.5691 122.0613 57.4747 42.0131 178.5197 39 C 4.0650 8.2328 117.0077 62.8684 27.8568 176.2832 40 V 3.7156 7.8180 118.8357 65.5050 31.1276 178.1697 41 G 3.7446 7.8964 106.4144 46.5863 0.0000 174.7569 42 E 4.5797 8.3357 118.0238 55.1935 31.8037 177.0570 43 G 3.8218 8.2709 108.0079 44.7642 0.0000 174.0849 44 V 3.7875 8.0449 117.0087 63.2053 31.4386 177.8529 45 R 3.9290 8.0793 117.0476 59.3732 28.9604 178.2966 46 A 3.9450 8.1156 121.6918 54.9989 18.2509 179.7416 47 V 3.4653 7.5984 116.1341 66.1420 31.6810 178.1717 48 R 4.4168 7.8042 119.2129 59.1204 29.9579 178.0697 49 D 4.3642 8.4288 118.9062 57.3945 40.8598 178.8084 50 L 4.1504 8.0895 119.5752 57.6810 41.1873 179.4868 51 K 3.9913 8.4355 119.6678 59.2669 31.8696 178.7111 52 A 4.0044 7.8819 120.4466 55.1793 18.3577 179.3252 53 L 3.7067 7.5578 116.4312 56.7565 42.9301 177.4659 54 Y 4.9949 7.6031 114.9397 56.2775 38.2973 174.9588 55 P 4.5197 0.0000 0.0000 64.8996 32.2199 177.8171 56 H 4.4542 8.2088 113.1699 56.7533 29.1283 175.3528 57 K 4.3245 7.2273 119.7074 54.7294 33.4705 176.2733 58 I 3.7309 7.8922 122.5611 61.4570 38.1695 174.9490 59 V 4.6067 8.9927 127.7640 60.9070 33.9802 173.7467 60 L 5.0634 8.6117 129.9535 53.2825 44.5182 174.7122 61 A 4.6322 8.8088 129.0159 50.1378 20.0552 176.7549 62 D 4.8700 8.3763 127.1165 53.8347 38.1445 176.4521 63 A 4.0037 7.8617 122.8185 52.7333 19.8439 177.8308 64 K 3.7074 7.9537 114.4687 57.0175 30.2349 176.3370 65 I 3.6135 7.6291 119.0271 62.0317 37.7196 177.3358 66 A 4.4038 8.3187 127.5670 52.8950 20.3631 175.4633 67 D 4.3323 8.0744 112.3545 53.0702 42.0324 174.4860 68 A 3.7585 8.5511 119.3177 52.8571 16.2391 179.1834 69 G 3.6991 8.1020 109.7020 48.4947 0.0000 175.0368 70 K 4.0574 7.9828 120.4635 59.1321 32.1811 179.4812 71 I 3.7266 7.6372 119.4729 64.5134 37.3075 178.4339 72 L 4.0168 8.1808 120.2999 57.6111 41.3211 179.7010 73 S 4.0859 8.1177 114.3713 61.5576 62.8593 176.4852 74 R 3.9315 8.3612 122.7598 59.3031 29.5970 178.3162 75 M 4.0100 8.0717 118.4606 58.5918 31.9434 178.6080 76 C 3.9751 7.7391 116.2231 62.8366 28.2270 176.2551 77 F 3.9751 7.9848 119.6528 60.2944 38.1025 177.6392 78 E 4.0240 8.0876 117.4375 58.5742 29.6379 178.1074 79 A 4.3231 7.4325 119.5513 51.8025 18.4738 177.4814 80 N 4.4984 8.1017 114.0210 53.8527 36.3700 174.7095 81 A 4.0613 7.5059 120.4532 52.7817 19.3381 178.2676 82 D 4.8835 9.0246 121.3331 56.0231 42.4188 176.8453 83 W 5.8738 8.0153 116.4976 55.0540 33.4539 174.9284 84 V 5.0152 8.7773 115.2462 59.8494 35.6722 174.6649 85 T 4.9015 8.2075 112.8716 60.2933 71.5058 173.5940 86 V 4.7454 8.2456 123.4072 60.8579 34.5905 174.7775 87 I 4.0426 8.4752 128.6588 60.7860 38.5768 176.6662 88 C 3.9329 8.2578 122.8403 61.1592 29.5135 174.5178 89 C 4.4335 8.0213 112.1968 58.4164 29.8307 173.5945 90 A 4.1176 7.6445 124.2547 51.9024 18.7410 177.0054 91 D 4.4332 8.7206 120.2399 54.6572 41.8924 177.2655 92 I 3.8237 8.7487 125.3379 64.8218 37.7081 177.7143 93 N 4.4129 8.4692 116.4043 55.9821 38.2475 177.4688 94 T 3.8523 7.8921 117.4332 66.6709 68.6301 176.2055 95 A 3.9736 8.0058 121.8529 55.2827 18.5169 179.6623 96 K 4.0996 8.5015 117.3659 59.5020 31.9376 179.9059 97 G 3.6130 8.4140 106.3288 47.7191 0.0000 175.6709 98 A 4.4536 8.2467 124.7724 54.3655 18.2844 179.5324 99 L 3.9432 8.0497 118.9400 58.1938 42.0223 178.9003 100 D 4.3317 8.2088 119.0456 57.3624 40.6401 178.9693 101 V 3.6486 7.7051 118.5111 65.8348 31.5163 177.8102 102 A 2.7245 8.1630 120.9048 54.9228 18.3155 179.8332 103 K 3.9428 8.3119 117.1747 59.3766 31.8197 179.1084 104 E 3.8650 7.7854 118.8682 58.6573 29.5053 177.9520 105 F 4.4763 7.4765 114.8909 55.8788 39.5439 175.2536 106 N 4.2057 7.7899 114.4010 54.6733 36.8846 173.6862 107 G 4.7095 7.8894 107.4379 45.5863 0.0000 172.5290 108 D 4.8715 8.9020 118.1192 53.4019 45.4460 175.4636 109 V 5.0056 8.2203 120.9138 61.1058 34.2994 174.4227 110 Q 4.6730 8.6631 125.5922 53.9990 32.0523 174.6666 111 I 3.9990 7.7463 124.0642 60.5639 38.6183 174.4107 112 D 4.5177 8.7759 127.9793 52.6728 42.1601 176.8563 113 L 4.4077 7.8703 130.7258 54.1468 40.1007 177.4671 114 T 4.1098 7.3707 115.5715 63.3533 69.9817 177.4628 115 G 3.8460 8.7296 118.4266 45.3247 0.0000 172.7539 *116 Y 4.0614 8.3218 117.4268 56.7905 37.2528 171.0576 117 W 5.1168 7.6977 119.8916 54.2258 30.9258 173.4695 118 T 4.3260 8.3958 108.8667 59.0242 72.6262 174.9009 119 W 4.5198 8.5082 122.9470 60.0393 29.0792 179.4187 120 E 3.9972 8.2574 118.2201 61.3301 29.2487 182.7438 121 Q 3.7643 7.8841 119.2090 58.6310 28.6508 179.2188 122 A 3.4423 7.2259 121.0426 54.9526 18.4016 179.4604 123 Q 3.9771 8.0886 117.9940 59.3653 29.1179 178.4108 124 Q 4.0046 7.8994 119.1374 58.7934 28.6632 178.9926 125 W 4.4945 7.8868 119.8266 59.9232 29.1542 178.7314 126 R 3.8813 8.4852 118.0665 59.5637 29.2971 178.9574 127 D 4.4006 8.4125 117.5338 57.1420 40.8938 178.2866 128 A 4.2655 8.0826 119.9867 53.3139 18.4510 178.2986 129 G 3.9767 7.8637 105.4401 45.1403 0.0000 173.6566 130 I 3.9725 7.9936 121.3016 61.1551 37.6410 176.0415 131 G 4.2491 8.7408 110.1834 45.9634 0.0000 172.0430 132 Q 5.1535 7.8954 118.9367 54.2175 33.2510 174.3456 133 V 4.4739 8.4362 115.3604 59.3805 36.5423 174.9086 134 V 4.4429 8.1346 123.3494 61.2417 33.5925 174.4067 135 Y 4.3290 9.1407 131.8654 57.6287 39.3879 173.6164 136 H 5.4135 8.2162 124.3008 53.9051 31.1951 174.0560 137 R 4.1024 9.0304 124.9700 55.0389 31.1485 175.7915 138 S 4.1836 8.7031 121.4927 58.3586 63.2043 175.2614 139 V 3.6054 8.4404 127.1931 65.0987 31.0553 178.3526 140 D 4.3258 8.0132 118.8184 56.6997 40.8276 178.1257 141 A 3.9095 7.8966 121.4542 55.3893 18.1866 179.3589 142 Q 4.0965 8.5085 119.1813 58.7841 28.8468 178.5196 143 A 3.9823 7.7907 120.4437 54.9562 18.5306 178.9344 144 A 4.1972 7.6653 117.2380 52.7887 18.5028 178.1238 145 G 4.0875 7.4931 106.3631 45.1970 0.0000 174.0331 146 V 3.6538 8.1400 120.5627 62.1307 31.9385 175.3409 147 A 4.5740 8.1171 129.3614 49.5677 21.3564 176.0177 148 W 4.5230 8.6188 119.8423 57.2472 29.2412 176.1322 149 G 4.3391 9.3420 115.7063 43.8262 0.0000 173.5893 150 E 4.0125 8.9620 116.9575 61.3407 29.4130 175.1433 151 A 4.3124 8.1155 121.4687 55.0467 18.3880 179.2986 152 D 4.9410 8.2191 118.2523 57.2118 41.0783 178.9035 153 I 3.7439 7.6521 120.3560 64.6567 37.1211 178.5642 154 T 3.8952 8.1698 116.3210 66.6103 68.2404 176.4314 155 A 4.5140 8.3897 122.6507 55.5507 18.4459 179.6888 156 I 3.6683 7.9104 118.4140 64.5701 37.0689 178.8877 157 K 4.0643 8.2538 119.3167 59.3823 31.8563 179.4759 158 R 3.8961 8.2373 119.0870 59.3467 29.5187 178.5326 159 L 4.5372 8.7578 119.2366 58.1222 41.7450 179.3480 160 S 4.5894 8.5465 114.7318 61.1521 62.0865 176.0524 161 D 4.4415 8.3120 120.7818 57.4986 40.6311 178.2729 162 M 4.2649 7.9821 117.9873 56.2119 31.9900 177.1638 163 G 4.0376 7.5913 106.6772 44.8670 0.0000 173.6543 164 F 4.8085 7.8459 118.6194 56.7222 40.7116 175.1181 165 K 4.2111 8.9436 123.0894 56.2581 33.0925 175.9883 166 V 4.7027 8.3876 125.1947 61.5614 33.8733 174.2609 167 T 4.7177 8.7191 124.7582 61.9967 70.9104 173.6086 168 V 4.8533 8.0089 125.4204 61.3651 33.8212 174.3078 169 A 4.7808 9.0440 127.1354 51.8131 22.6829 174.3710 170 G 4.0149 9.9879 107.6786 46.6980 0.0000 174.1639 171 G 3.9769 8.6891 114.1283 45.6676 0.0000 171.4530 172 L 4.4310 7.6231 118.2464 54.9743 42.6212 176.1917 173 A 5.0510 9.2423 128.2286 49.7433 22.3229 176.6158 174 L 3.2164 8.4113 121.1168 58.1670 41.7205 179.1109 175 E 4.1415 7.9461 114.5971 58.4553 30.0422 177.9773 176 D 4.5615 8.3244 120.4225 56.6836 40.9132 178.2012 177 L 4.0759 7.7398 119.8093 57.5520 41.7851 177.6869 178 P 4.2368 0.0000 0.0000 65.2368 30.9675 178.4798 179 L 3.8683 7.5181 116.7716 56.7905 41.8007 177.7663 180 F 4.7348 7.9622 115.7458 56.6779 39.7038 175.6078 181 K 3.1902 7.3141 122.3984 57.8943 32.1502 177.0237 182 G 3.9512 8.4693 112.8702 45.3752 0.0000 172.9502 183 I 4.5740 7.5465 120.3566 58.8933 39.5598 175.0574 184 P 4.7506 0.0000 0.0000 61.6619 30.0951 176.6181 185 I 3.5043 7.4016 121.1738 62.7757 38.2764 177.0327 186 H 4.3714 8.9954 125.7011 58.7403 30.9304 175.2189 187 V 4.6621 7.1205 116.3618 61.2671 35.2982 173.1659 188 F 5.0423 8.9162 125.9399 55.8428 41.2559 174.5883 189 I 4.7788 8.4380 124.5157 59.9140 38.8638 175.1251 190 A 4.1195 8.8686 128.3811 51.6416 21.3587 175.1710 191 G 3.6619 9.0505 113.2705 46.9229 0.0000 175.4858 192 R 3.9485 8.8933 120.1601 59.1207 30.7279 178.2037 193 S 4.3277 8.1231 112.0943 60.5003 63.2878 175.7474 194 I 4.2006 7.5568 123.0129 63.7349 37.5274 177.8521 195 R 3.9659 8.1071 117.7146 58.9201 30.0176 177.9825 196 D 4.7336 7.9013 114.9850 53.1313 41.5288 176.7750 197 A 4.1903 7.0988 122.6871 51.6216 19.1237 177.7577 198 A 4.0348 8.7164 123.3086 54.7167 18.5989 178.4097 199 S 4.5094 7.7223 110.2221 55.2514 64.2345 172.0838 200 P 4.3599 0.0000 0.0000 65.4919 31.1277 178.6295 201 V 3.5629 7.6887 116.4528 66.1223 31.5408 177.6665 202 E 3.9641 8.2180 118.7032 58.8751 29.3920 178.5709 203 A 4.0033 8.3829 121.1146 55.1339 18.5158 179.3466 204 A 4.0801 8.2150 119.2993 55.6058 18.4489 180.1191 205 R 3.9417 8.2498 116.5077 59.3736 30.0000 179.3171 206 Q 3.9905 8.4585 118.2066 58.9611 28.6542 178.7859 207 F 3.9950 8.2593 118.7237 60.5776 38.9825 177.9070 208 K 4.0509 8.3708 118.0008 59.5599 31.9150 179.6690 209 R 3.9635 8.4999 118.7635 59.2895 29.9526 179.1207 210 S 4.1021 8.4226 113.2262 61.3655 62.3745 176.0584 211 I 4.1604 8.1514 122.4905 64.7519 36.7905 178.2919 212 A 4.1258 8.3106 121.4052 54.9606 17.6980 179.4196 213 E 3.9065 8.2588 117.8639 59.5607 29.6161 179.0543 214 L 3.7023 8.3520 118.0748 56.3626 41.7038 178.3830 215 W 4.6606 8.3752 115.8611 56.1323 30.1032 176.0380 216 G 4.2395 7.6638 112.9711 45.1411 0.0000 173.7822 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 8.40 4.55 0.00 2.05 1.91 0.00 0.00 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.11 0.00 2 S 7.89 4.23 0.00 3.70 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 3 L 9.09 4.21 0.00 1.63 1.65 0.98 1.20 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 4 P 0.00 4.34 0.00 1.62 1.33 0.00 3.24 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 1.01 0.00 5 M 8.69 4.48 0.00 1.98 1.87 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.43 0.00 6 L 9.07 5.05 0.00 1.69 1.43 0.62 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 7 Q 9.01 4.99 0.00 2.06 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.66 0.00 0.00 0.00 0.00 0.00 2.18 2.33 0.00 8 V 8.36 4.49 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 0.58 0.00 0.00 0.91 0.00 0.00 9 A 8.30 4.44 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 10 L 8.92 4.24 0.00 1.65 1.59 0.93 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 11 D 7.76 4.74 0.00 2.68 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 12 N 7.39 5.14 0.00 2.66 2.64 0.00 0.00 7.00 7.31 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 13 Q 8.42 4.19 0.00 2.08 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.78 6.79 0.00 0.00 0.00 0.00 0.00 2.41 2.31 0.00 14 T 7.28 4.73 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 1.17 0.00 0.00 15 M 8.99 3.65 0.00 1.43 1.96 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.70 0.00 16 D 7.87 4.33 0.00 2.90 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 17 S 7.66 4.00 0.00 3.92 3.99 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 18 A 7.64 3.95 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 19 Y 7.83 4.75 0.00 3.13 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 20 E 7.97 4.02 0.00 2.15 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 2.59 0.00 21 T 7.49 4.15 4.42 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 1.20 0.00 0.00 22 T 8.24 3.87 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 1.27 0.00 0.00 23 R 8.22 4.06 0.00 2.02 2.24 0.00 3.10 0.00 0.00 3.26 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.71 0.00 24 L 7.86 4.29 0.00 1.79 1.76 0.99 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 25 I 7.43 4.35 1.82 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 1.34 0.93 0.00 0.00 26 A 7.84 3.59 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 E 7.99 4.49 0.00 1.96 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 2.28 0.00 28 E 8.23 4.54 0.00 2.01 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.38 0.00 29 V 7.29 4.53 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 0.67 0.00 0.00 0.86 0.00 0.00 30 D 8.73 4.61 0.00 2.57 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 31 I 7.43 4.46 1.74 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 0.79 0.60 0.69 0.00 0.00 32 I 8.47 4.33 1.76 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 0.91 0.62 0.85 0.00 0.00 33 E 8.84 4.68 0.00 2.16 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.22 0.00 34 V 9.00 4.04 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 0.89 0.00 0.00 0.90 0.00 0.00 35 G 8.59 4.36 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 0.00 36 T 8.71 4.00 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 1.17 0.00 0.00 37 I 7.67 3.68 1.84 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 1.50 0.71 0.90 0.00 0.00 38 L 7.57 4.50 0.00 1.90 1.74 0.90 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 39 C 8.23 4.07 0.00 3.11 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 V 7.82 3.72 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 0.78 0.00 0.00 0.90 0.00 0.00 41 G 7.90 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 E 8.34 4.58 0.00 1.98 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 2.17 2.33 0.00 43 G 8.27 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 44 V 8.04 3.79 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 0.80 0.00 0.00 0.89 0.00 0.00 45 R 8.08 3.93 0.00 2.05 2.24 0.00 2.96 0.00 0.00 3.33 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.70 0.00 46 A 8.12 3.94 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 47 V 7.60 3.47 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 0.99 0.00 0.00 0.85 0.00 0.00 48 R 7.80 4.42 0.00 1.90 2.03 0.00 3.27 0.00 0.00 3.30 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.58 0.00 49 D 8.43 4.36 0.00 2.88 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 50 L 8.09 4.15 0.00 1.88 1.87 1.01 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 51 K 8.44 3.99 0.00 1.92 1.80 0.00 1.52 0.00 0.00 1.63 0.00 0.00 3.04 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.56 1.50 7.81 52 A 7.88 4.00 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 53 L 7.56 3.71 0.00 1.02 0.13 0.38 0.39 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 54 Y 7.60 4.99 0.00 2.93 2.64 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 55 P 0.00 4.52 0.00 2.19 2.25 0.00 3.50 0.00 0.00 4.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.92 0.00 56 H 8.21 4.45 0.00 3.30 3.47 0.00 5.51 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 K 7.23 4.32 0.00 1.77 1.60 0.00 1.58 0.00 0.00 1.57 0.00 0.00 2.88 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.10 1.31 7.81 58 I 7.89 3.73 1.37 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.47 -0.38 0.00 0.00 59 V 8.99 4.61 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 0.96 0.00 0.00 0.95 0.00 0.00 60 L 8.61 5.06 0.00 1.76 1.47 1.25 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 61 A 8.81 4.63 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 62 D 8.38 4.87 0.00 2.65 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 63 A 7.86 4.00 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 64 K 7.95 3.71 0.00 1.82 1.79 0.00 1.65 0.00 0.00 1.60 0.00 0.00 2.99 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.29 1.44 7.81 65 I 7.63 3.61 1.82 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.64 0.93 0.00 0.00 66 A 8.32 4.40 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 67 D 8.07 4.33 0.00 2.72 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 68 A 8.55 3.76 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 69 G 8.10 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 70 K 7.98 4.06 0.00 1.84 1.91 0.00 1.70 0.00 0.00 1.84 0.00 0.00 2.98 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.57 1.56 7.81 71 I 7.64 3.73 1.88 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 1.66 0.65 0.92 0.00 0.00 72 L 8.18 4.02 0.00 1.80 1.68 0.94 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 73 S 8.12 4.09 0.00 4.35 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 0.00 74 R 8.36 3.93 0.00 2.12 2.17 0.00 3.18 0.00 0.00 3.29 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.86 0.00 75 M 8.07 4.01 0.00 2.07 2.21 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.81 2.57 0.00 76 C 7.74 3.98 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 77 F 7.98 3.98 0.00 2.21 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 E 8.09 4.02 0.00 1.95 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.47 0.00 79 A 7.43 4.32 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 80 N 8.10 4.50 0.00 2.91 3.08 0.00 0.00 6.86 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 81 A 7.51 4.06 0.93 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 82 D 9.02 4.88 0.00 2.50 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 W 8.02 5.87 0.00 3.13 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 84 V 8.78 5.02 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 0.01 0.00 0.00 1.00 0.00 0.00 85 T 8.21 4.90 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 1.18 0.00 0.00 86 V 8.25 4.75 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 0.83 0.00 0.00 0.88 0.00 0.00 87 I 8.48 4.04 1.93 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 1.00 0.90 0.00 0.00 88 C 8.26 3.93 0.00 3.29 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 C 8.02 4.43 0.00 3.16 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 90 A 7.64 4.12 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 91 D 8.72 4.43 0.00 2.80 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 I 8.75 3.82 1.95 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.40 0.96 0.00 0.00 93 N 8.47 4.41 0.00 2.96 2.87 0.00 0.00 6.97 6.55 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 94 T 7.89 3.85 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 1.22 0.00 0.00 95 A 8.01 3.97 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 96 K 8.50 4.10 0.00 1.97 1.91 0.00 1.88 0.00 0.00 1.68 0.00 0.00 3.00 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.51 1.64 7.81 97 G 8.41 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 98 A 8.25 4.45 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 L 8.05 3.94 0.00 1.94 1.84 0.91 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 100 D 8.21 4.33 0.00 2.96 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 0.00 101 V 7.71 3.65 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 1.23 0.00 0.00 1.02 0.00 0.00 102 A 8.16 2.72 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 0.00 103 K 8.31 3.94 0.00 1.90 1.84 0.00 1.78 0.00 0.00 1.56 0.00 0.00 2.90 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.52 7.81 104 E 7.79 3.86 0.00 2.03 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 0.00 1.97 2.22 0.00 105 F 7.48 4.48 0.00 2.47 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 N 7.79 4.21 0.00 2.90 2.91 0.00 0.00 6.65 6.98 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 0.00 107 G 7.89 4.71 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 0.00 108 D 8.90 4.87 0.00 2.87 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 V 8.22 5.01 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 0.80 0.00 0.00 1.02 0.00 0.00 110 Q 8.66 4.67 0.00 1.82 1.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.74 0.00 0.00 0.00 0.00 0.00 1.82 2.08 0.00 111 I 7.75 4.00 0.76 0.00 0.00 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 -0.36 -0.56 0.00 0.00 112 D 8.78 4.52 0.00 2.59 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 0.00 0.00 0.00 0.00 113 L 7.87 4.41 0.00 1.21 0.88 0.38 0.01 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 0.00 114 T 7.37 4.11 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 115 G 8.73 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 0.00 0.00 0.00 *116 Y 8.32 4.06 0.00 2.34 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 0.00 0.00 0.00 117 W 7.70 5.12 0.00 3.69 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 0.00 118 T 8.40 4.33 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 1.16 0.00 0.00 119 W 8.51 4.52 0.00 3.46 3.33 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 0.00 120 E 8.26 4.00 0.00 1.97 1.96 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 2.32 1.98 0.00 121 Q 7.88 3.76 0.00 2.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.78 0.00 0.00 0.00 0.00 0.00 2.30 2.28 0.00 122 A 7.23 3.44 1.60 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 0.00 123 Q 8.09 3.98 0.00 2.27 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.74 0.00 0.00 0.00 0.00 0.00 2.38 2.67 0.00 124 Q 7.90 4.00 0.00 2.02 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.58 0.00 0.00 0.00 0.00 0.00 2.35 2.48 0.00 125 W 7.89 4.49 0.00 3.92 3.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 R 8.49 3.88 0.00 1.97 1.88 0.00 2.76 0.00 0.00 2.25 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.48 0.00 127 D 8.41 4.40 0.00 2.64 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 0.00 128 A 8.08 4.27 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 G 7.86 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 0.00 130 I 7.99 3.97 2.28 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.92 0.89 0.00 0.00 131 G 8.74 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 0.00 0.00 0.00 0.00 132 Q 7.90 5.15 0.00 1.66 1.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.77 6.76 0.00 0.00 0.00 0.00 0.00 2.04 2.05 0.00 133 V 8.44 4.47 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 -0.51 0.00 0.00 0.60 0.00 0.00 134 V 8.13 4.44 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 0.79 0.00 0.00 135 Y 9.14 4.33 0.00 3.18 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 0.00 136 H 8.22 5.41 0.00 3.04 3.10 0.00 5.94 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 R 9.03 4.10 0.00 1.06 1.32 0.00 2.89 0.00 0.00 2.25 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.27 0.00 138 S 8.70 4.18 0.00 3.83 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 V 8.44 3.61 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 0.75 0.00 0.00 0.98 0.00 0.00 140 D 8.01 4.33 0.00 2.68 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 0.00 141 A 7.90 3.91 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 0.00 142 Q 8.51 4.10 0.00 2.10 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.75 0.00 0.00 0.00 0.00 0.00 2.34 2.19 0.00 143 A 7.79 3.98 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 0.00 144 A 7.67 4.20 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 0.00 145 G 7.49 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 146 V 8.14 3.65 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 0.83 0.00 0.00 0.95 0.00 0.00 147 A 8.12 4.57 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 0.00 148 W 8.62 4.52 0.00 3.38 3.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 G 9.34 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 0.00 0.00 0.00 0.00 150 E 8.96 4.01 0.00 1.98 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 2.32 1.96 0.00 151 A 8.12 4.31 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 D 8.22 4.94 0.00 3.25 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 0.00 153 I 7.65 3.74 2.03 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.04 0.93 0.00 0.00 154 T 8.17 3.90 4.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 155 A 8.39 4.51 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 0.00 0.00 0.00 0.00 0.00 156 I 7.91 3.67 1.90 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 -0.12 0.93 0.00 0.00 157 K 8.25 4.06 0.00 2.02 1.91 0.00 1.70 0.00 0.00 1.61 0.00 0.00 2.93 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.53 1.72 7.81 158 R 8.24 3.90 0.00 1.96 2.17 0.00 2.48 0.00 0.00 2.25 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 1.40 0.00 159 L 8.76 4.54 0.00 2.14 2.01 1.29 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 0.00 0.00 0.00 0.00 0.00 0.00 160 S 8.55 4.59 0.00 4.00 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 0.00 161 D 8.31 4.44 0.00 2.86 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 0.00 162 M 7.98 4.26 0.00 1.96 2.41 0.00 0.00 0.00 0.00 0.00 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3.04 2.65 0.00 163 G 7.59 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 0.00 164 F 7.85 4.81 0.00 3.29 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 0.00 165 K 8.94 4.21 0.00 1.61 1.43 0.00 1.38 0.00 0.00 1.06 0.00 0.00 2.68 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.33 1.29 7.81 166 V 8.39 4.70 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 1.07 0.00 0.00 1.06 0.00 0.00 167 T 8.72 4.72 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 1.14 0.00 0.00 168 V 8.01 4.85 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.28 0.00 0.00 0.39 0.00 0.00 169 A 9.04 4.78 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 170 G 9.99 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 0.00 171 G 8.69 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 0.00 172 L 7.62 4.43 0.00 1.86 1.82 0.97 0.96 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 0.00 173 A 9.24 5.05 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 0.00 174 L 8.41 3.22 0.00 1.19 1.45 0.28 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 175 E 7.95 4.14 0.00 2.15 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.44 0.00 176 D 8.32 4.56 0.00 2.97 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177 L 7.74 4.08 0.00 1.73 1.84 0.87 -0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 178 P 0.00 4.24 0.00 2.09 2.03 0.00 3.71 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 2.07 2.13 0.00 179 L 7.52 3.87 0.00 0.67 1.19 0.88 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 180 F 7.96 4.73 0.00 3.88 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 181 K 7.31 3.19 0.00 1.52 1.52 0.00 1.61 0.00 0.00 1.53 0.00 0.00 2.84 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.09 0.94 7.81 182 G 8.47 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 0.00 183 I 7.55 4.57 2.25 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.89 1.02 0.00 0.00 184 P 0.00 4.75 0.00 2.22 2.18 0.00 3.87 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.04 0.00 185 I 7.40 3.50 1.11 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.11 -0.21 0.00 0.00 186 H 9.00 4.37 0.00 3.10 3.31 0.00 5.58 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 187 V 7.12 4.66 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 0.95 0.00 0.00 0.82 0.00 0.00 188 F 8.92 5.04 0.00 2.93 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 0.00 189 I 8.44 4.78 1.86 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.47 1.00 0.00 0.00 190 A 8.87 4.12 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 191 G 9.05 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 0.00 192 R 8.89 3.95 0.00 1.91 2.04 0.00 3.16 0.00 0.00 3.40 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.72 0.00 193 S 8.12 4.33 0.00 4.28 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 0.00 194 I 7.56 4.20 1.84 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.39 0.91 0.00 0.00 195 R 8.11 3.97 0.00 1.76 2.00 0.00 3.13 0.00 0.00 3.37 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.84 0.00 196 D 7.90 4.73 0.00 2.83 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 0.00 197 A 7.10 4.19 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 0.00 198 A 8.72 4.03 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 0.00 199 S 7.72 4.51 0.00 3.85 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 0.00 200 P 0.00 4.36 0.00 2.20 2.19 0.00 3.67 0.00 0.00 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.26 0.00 201 V 7.69 3.56 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.99 0.00 0.00 202 E 8.22 3.96 0.00 2.16 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 2.51 0.00 203 A 8.38 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 0.00 204 A 8.21 4.08 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 205 R 8.25 3.94 0.00 2.04 2.02 0.00 3.15 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 1.71 1.84 0.00 206 Q 8.46 3.99 0.00 2.19 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.79 0.00 0.00 0.00 0.00 0.00 2.35 2.65 0.00 207 F 8.26 4.00 0.00 3.31 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 0.00 208 K 8.37 4.05 0.00 1.97 1.90 0.00 1.71 0.00 0.00 1.69 0.00 0.00 2.95 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.51 1.66 7.81 209 R 8.50 3.96 0.00 1.96 1.99 0.00 3.13 0.00 0.00 3.10 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.85 0.00 210 S 8.42 4.10 0.00 3.82 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 0.00 211 I 8.15 4.16 2.21 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.61 1.05 0.00 0.00 212 A 8.31 4.13 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 0.00 213 E 8.26 3.91 0.00 2.26 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 2.37 0.00 214 L 8.35 3.70 0.00 1.62 0.82 0.99 0.57 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 0.00 215 W 8.38 4.66 0.00 3.64 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 216 G 7.66 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.