NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 9 S 4.4891 8.1885 117.1127 58.2375 63.4898 175.0694 10 A 4.2342 7.4620 124.2145 51.5804 17.9759 178.5840 11 N 4.6388 8.4828 121.1826 58.2488 39.8151 174.9275 12 H 4.2251 8.0565 112.6469 58.3212 28.6330 175.6757 13 L 3.8319 7.6764 121.7095 54.0799 41.3635 176.2182 14 P 4.4887 0.0000 0.0000 64.3547 31.7316 176.9548 15 F 5.3216 7.4962 114.6379 55.8085 39.1443 174.2022 16 F 5.5245 7.1194 121.7366 56.3897 41.2100 174.3122 17 F 4.4330 7.2246 124.5819 55.4657 41.1647 175.5175 18 G 3.9093 7.1431 106.2662 42.6117 0.0000 175.3948 19 N 4.5701 9.5878 130.2559 52.4509 37.9990 173.0921 20 I 4.4332 7.9663 125.5053 59.3102 40.8340 175.7570 21 T 4.2486 7.8549 115.8666 60.1251 70.1543 175.4119 22 R 3.7295 8.2214 123.3742 59.7995 29.8940 177.9750 23 E 3.9326 7.8926 117.4278 59.6738 29.1544 178.9198 24 E 4.0668 8.3729 118.3398 59.6147 29.4950 178.4773 25 A 4.0882 8.1106 120.9030 54.8620 18.1117 179.1445 26 E 3.9531 8.7604 116.9651 59.8984 29.5907 179.6798 27 D 4.3289 8.2127 118.8104 57.3613 40.5244 178.0401 28 Y 3.8545 7.5878 116.3858 61.2341 37.7830 179.1944 29 L 4.2269 7.9152 119.2456 58.0726 41.7443 180.0689 30 V 3.7132 7.5293 111.3969 64.3557 31.3973 178.2636 31 Q 4.3970 8.5343 113.9058 57.4452 28.3601 177.1946 32 G 4.3289 8.6899 106.1407 44.5606 0.0000 172.9989 33 G 3.3991 9.4668 112.9604 44.4770 0.0000 174.4765 34 M 3.2905 8.3981 118.4340 55.9285 31.6898 176.2432 35 S 4.2905 7.7512 112.3962 57.4176 63.6237 173.2167 36 D 4.6357 8.6689 124.4741 56.3073 41.0552 177.4155 37 G 4.0506 9.5439 111.5705 44.6462 0.0000 172.4287 38 L 5.3151 8.0764 122.7670 54.1280 43.6382 175.1094 39 Y 5.3724 7.9766 122.4146 56.4709 41.9821 172.9066 40 L 5.2213 9.3184 118.4604 54.9096 44.4487 173.6552 41 L 5.4540 9.7212 123.9031 53.5510 44.5768 175.3661 42 R 5.1000 9.0205 121.1293 54.3456 33.6049 173.9030 43 Q 4.3051 8.4424 121.7206 56.1470 29.5239 175.8475 44 S 4.3298 8.4972 120.5342 57.8919 63.5263 173.6138 45 R 4.5742 7.9431 122.6048 55.7618 30.6923 176.5414 46 N 5.1802 7.8849 112.1745 52.4626 39.4230 173.0983 47 Y 5.3221 7.6978 116.2985 56.2159 40.5996 174.8439 48 L 3.7808 10.1447 125.7098 56.9958 42.2403 177.7982 49 G 3.9163 8.7579 109.0963 46.2304 0.0000 173.8416 50 G 4.2704 7.5619 111.0464 44.4878 0.0000 172.7328 51 F 5.1050 9.6340 117.9014 56.3418 44.5518 173.3581 52 A 5.0741 9.8082 120.8477 50.3167 21.9243 174.7909 53 L 5.3688 10.0742 124.6854 53.1736 45.0378 175.1839 54 S 5.1736 8.9899 120.3734 56.7837 66.0806 173.3734 55 V 5.2488 9.0414 116.4607 59.4304 35.8296 174.5297 56 A 4.6302 10.1491 127.8478 51.9396 19.5881 176.4247 57 H 4.8021 9.2130 120.8863 56.9532 33.1330 173.5320 58 G 3.6586 9.5379 117.3319 46.6613 0.0000 176.1151 59 R 3.7132 8.2833 117.5620 56.8860 29.6784 177.0132 60 K 4.3154 8.3538 117.2720 55.3658 33.4183 174.8729 61 A 4.9728 8.0583 121.0710 50.5473 21.6719 175.7283 62 H 4.6219 8.7647 117.5537 54.2853 31.8284 172.4983 63 H 5.3107 8.5408 120.8002 54.3097 30.0557 173.8784 64 Y 4.7525 9.9860 121.3705 56.3460 41.1275 174.5091 65 T 4.8063 8.7449 118.7305 60.7935 68.7131 174.0278 66 I 4.3476 9.7301 132.1026 60.3722 37.9922 175.0790 67 E 4.4272 8.7875 127.1936 55.6089 31.4527 175.9709 68 R 4.7573 8.5673 123.6274 55.0975 30.7651 175.9770 69 E 4.1268 9.5549 128.4487 55.9356 30.1437 178.1495 70 L 3.6304 8.6667 122.9876 58.2703 41.7280 178.4548 71 N 4.2830 7.9550 113.6016 54.5089 38.4120 175.8191 72 G 3.7736 9.0457 108.3482 45.0013 0.0000 173.5400 73 T 4.2128 7.1240 109.6803 60.6150 71.4860 173.2263 74 Y 5.3549 7.9720 119.4909 56.6471 41.5123 174.9643 75 A 4.6573 8.8317 119.8732 51.1872 23.2156 176.6979 76 I 3.7826 8.5060 123.9409 61.3377 37.7868 175.3891 77 A 4.0603 8.6741 127.0239 54.3646 18.3901 177.7935 78 G 3.9687 9.5201 110.9766 44.9975 0.0000 172.6048 79 G 4.1891 7.4350 106.6775 42.7378 0.0000 172.2054 80 R 3.8441 8.3494 119.0760 56.7390 30.3050 175.1449 81 T 4.6341 8.0326 112.1081 60.1897 70.8356 173.6009 82 H 4.8224 9.0179 121.6949 53.5336 31.7816 175.3566 83 A 3.9662 8.6869 124.2689 54.8251 18.5989 178.0971 84 S 5.0606 7.7819 108.9394 54.8008 66.5868 172.9503 85 P 3.8241 0.0000 0.0000 66.1789 30.3873 178.1886 86 A 3.9343 7.2015 119.8410 55.1360 18.2146 179.3400 87 D 4.2566 8.2292 117.0939 57.7314 40.9183 178.7892 88 L 3.5138 7.6328 120.3497 58.2833 42.3075 178.7644 89 C 3.9912 7.8528 115.9290 63.3243 27.9277 175.5842 90 H 4.2272 7.8379 116.1460 59.4122 28.4467 176.8075 91 Y 4.2422 8.7716 121.2966 60.8897 38.2602 176.7864 92 H 5.0129 8.7451 117.0861 56.6939 28.7215 177.0057 93 S 4.4063 8.1001 114.8694 59.9496 62.3990 174.0668 94 Q 4.4747 7.6262 117.6374 55.3056 30.8176 174.9857 95 E 4.3572 7.3646 118.7786 53.8364 31.6435 175.1129 96 S 3.9753 8.4000 122.2135 59.1339 63.2712 173.2303 97 D 4.1966 9.2982 119.7258 55.2424 39.2924 174.4182 98 G 4.0932 8.3841 112.4541 45.6676 0.0000 172.0242 99 L 3.7433 8.3334 120.7805 54.9592 41.7340 178.6307 100 V 3.5395 7.4477 118.4153 64.4264 31.7245 175.3620 101 C 4.6083 7.3769 111.9540 57.5588 32.3276 173.0222 102 L 4.2985 7.9667 119.1395 54.7939 42.0251 176.7839 103 L 4.4138 7.6636 122.9426 54.0685 39.1739 176.4894 104 K 4.0818 8.6480 120.8856 56.4635 32.0885 176.1873 105 K 4.4527 7.9505 120.2753 54.4086 34.5995 174.5421 106 P 3.3074 0.0000 0.0000 61.5730 33.3246 174.8415 107 F 4.6337 8.9276 123.1059 56.5246 41.0480 174.4836 108 N 5.2215 8.7548 123.8164 52.5672 39.8217 174.6452 109 R 4.7617 9.7107 123.6712 56.5877 30.5326 174.2421 110 P 4.3665 0.0000 0.0000 62.1079 32.2562 175.7850 111 Q 4.0251 8.7435 119.5769 58.5121 29.0156 175.8988 112 G 4.3454 9.4518 114.6169 45.7281 0.0000 173.7402 113 V 3.6139 6.8081 117.9515 62.9627 31.9427 174.6422 114 Q 4.7842 8.2618 122.7290 52.9774 32.3827 172.9188 115 P 4.5290 0.0000 0.0000 62.4201 32.2571 176.6528 116 K 4.2487 8.5884 121.8466 56.8614 33.5260 175.6870 117 T 4.6075 8.1744 118.6750 61.6993 70.1342 172.8362 *152 P 4.5138 0.0000 0.0000 61.9773 33.7346 177.0950 153 Q 4.4140 7.7560 117.1439 57.7363 30.8929 177.1021 154 L 3.8727 8.0046 117.5139 58.4496 41.6686 178.9321 155 E 4.0014 8.2230 117.0924 59.8540 29.0555 179.4352 156 K 3.9375 8.4364 119.4222 59.8131 32.2430 177.3508 157 L 4.2028 8.8099 122.2739 56.6364 41.7496 177.9793 158 I 3.5863 7.6906 122.0590 64.9708 37.3464 177.6079 159 A 3.5574 7.6806 121.0836 54.7053 18.3213 179.0836 160 T 4.0718 7.4096 108.2636 63.6805 69.7966 174.2747 161 T 4.7389 7.5442 109.8646 59.1729 68.5355 172.5777 162 A 4.4817 8.0167 130.3271 53.6236 21.9079 178.2393 163 H 3.6635 8.5337 111.1532 58.4916 28.5147 177.0773 164 E 4.0336 7.9197 118.5686 59.0113 29.2285 177.6675 165 K 4.2928 7.9317 116.3518 56.1888 32.5970 175.5920 166 M 4.2651 8.2379 119.5507 54.2825 32.8031 175.2022 167 P 4.2553 0.0000 0.0000 65.5981 31.6895 177.3828 168 W 4.1517 7.9652 112.7432 57.1802 28.5328 174.8184 169 F 5.4825 8.4830 123.5656 57.1425 40.2858 175.7034 170 H 4.3971 8.8828 127.7325 57.0212 28.9623 175.9094 171 G 3.3331 6.0142 113.5076 45.0902 0.0000 171.2616 172 K 4.7342 8.1276 128.5123 55.1148 33.4012 176.1784 173 I 4.7059 7.7394 123.3829 59.8753 41.2949 174.5975 174 S 4.3201 10.1331 121.6448 58.6991 63.9523 175.4371 175 R 3.6861 8.5631 119.9964 58.3125 29.7059 178.1833 176 E 4.2425 7.9192 117.7009 59.2767 30.2083 177.8096 177 E 4.0979 9.6869 118.7961 59.7496 29.3508 179.5454 178 S 4.2755 7.9724 114.2754 61.5643 63.1898 176.4293 179 E 3.8765 7.8050 120.7540 57.0305 29.6677 179.8724 180 Q 3.5974 9.2835 112.0071 60.2267 28.6744 180.5450 181 I 3.1339 5.4200 126.5232 63.9685 39.5632 175.3523 182 V 3.8381 8.4218 120.7773 64.5292 31.7026 178.0972 183 L 4.1834 8.6085 118.9458 55.6080 41.8011 177.6220 184 I 3.8890 7.1119 119.0927 61.6963 38.0690 177.6466 185 G 3.8459 8.4276 110.8123 44.9602 0.0000 172.6243 186 S 4.1019 8.4735 113.8886 58.6766 62.5562 175.3885 187 K 4.3745 8.6435 126.3268 57.0868 32.8075 176.5185 188 T 3.7860 7.5119 114.1877 63.1524 67.5278 173.2364 189 N 4.6006 8.5440 125.5717 54.5770 39.3713 175.5961 190 G 3.9826 9.4940 109.5635 45.0905 0.0000 173.3934 191 K 4.9247 7.5675 121.6142 56.7429 33.2335 175.7065 192 F 5.6096 9.3870 121.2899 55.9678 42.2534 172.5690 193 L 4.7039 8.5274 116.7524 55.4869 43.8378 173.2025 194 I 5.7069 9.6701 114.8537 58.2733 40.6186 174.4678 195 R 5.2492 8.8900 120.6548 54.3691 31.9599 173.9697 196 A 4.8216 8.5748 122.9413 49.8401 20.5791 177.2743 197 R 4.7409 8.8704 125.2631 55.9503 29.2751 179.2465 198 D 4.6970 8.7066 125.2527 55.6672 43.0319 175.4673 199 N 4.5847 8.0490 116.2564 52.6171 36.7520 174.9728 200 N 3.9713 8.4338 121.5448 55.7709 38.8944 176.1914 201 G 4.0156 8.0880 105.3739 45.0853 0.0000 172.2771 202 S 4.9758 9.6067 115.6189 56.7508 65.0195 172.7527 203 Y 5.3413 8.6459 122.6512 56.4929 41.3861 174.3436 204 A 5.1820 9.3269 120.2313 50.8206 23.4548 174.8853 205 L 5.0325 9.7049 122.9444 53.5893 44.6507 175.0405 206 C 6.0938 9.5163 123.5947 56.9713 31.6105 173.1301 207 L 5.3952 8.3722 122.2301 54.4072 44.3831 174.2692 208 L 4.8865 9.0746 122.7161 54.1759 44.0294 174.8505 209 H 4.8378 9.4362 126.5513 54.3126 32.5916 172.9521 210 E 3.8665 10.2485 129.1992 57.4703 26.9493 176.4973 211 G 3.9306 8.0425 103.9671 45.5686 0.0000 172.8368 212 K 4.5264 7.6670 121.5345 54.3395 34.0443 174.9174 213 V 4.5639 8.1164 124.8902 60.7967 32.9429 175.0833 214 L 4.6146 9.1928 124.3530 53.0706 44.8863 174.9169 215 H 5.4532 8.5727 120.0596 54.3431 30.9904 173.2995 216 Y 4.9669 9.1830 121.6257 55.9458 40.5989 175.2711 217 R 4.5050 8.9117 125.0698 56.4112 30.4949 175.0083 218 I 4.9385 8.5709 125.8256 59.7037 41.0094 174.1848 219 D 4.9770 8.5111 123.4468 51.9015 43.3273 174.2624 220 K 4.8893 8.1320 123.0399 54.9645 32.9112 176.0271 221 D 4.6811 9.0935 130.9620 52.8664 40.4645 177.7808 222 K 3.9067 8.7293 120.0728 58.3405 31.3273 175.0442 223 T 4.1426 7.9795 112.3196 64.1580 68.6839 175.2056 224 G 3.9025 8.8650 110.0418 45.6493 0.0000 173.0073 225 K 4.6961 8.7094 119.5622 54.1751 34.7919 175.7363 226 L 5.3459 8.3898 124.6628 53.8212 43.0863 175.9662 227 S 5.0723 8.2540 112.5606 57.4991 65.7987 175.7252 228 I 4.3079 8.2007 127.4475 60.0966 38.2821 173.6763 229 P 4.2828 0.0000 0.0000 64.7356 31.4360 176.3814 230 E 3.8661 9.2507 120.9969 56.3854 26.8772 173.5918 231 G 4.1891 8.3110 110.0413 43.2185 0.0000 173.6019 232 K 3.7292 8.3545 120.1221 54.6295 31.9451 173.7027 233 K 4.8367 7.8300 118.2808 54.8427 34.9961 175.8031 234 F 5.7420 8.8296 119.7504 54.6454 42.9465 175.8674 235 D 4.5179 10.4203 123.8741 56.7122 41.0782 176.3218 236 T 4.7941 7.9150 107.6630 59.8061 72.1424 172.9701 237 L 4.0250 8.3818 119.1840 56.8314 42.7547 178.8361 238 W 4.7290 8.5077 116.2664 59.1645 27.7972 177.3587 239 Q 3.6729 7.8654 117.4777 57.7658 29.1763 177.0680 240 L 2.0000 6.6171 122.0787 57.4731 41.7889 178.3741 241 V 3.2754 7.9693 118.3101 64.7134 30.8592 177.7980 242 E 3.4783 7.2967 122.1405 59.4201 30.3838 178.6130 243 H 4.3158 7.8093 118.7223 58.7875 29.9468 176.5015 244 Y 4.8636 8.3690 120.2915 59.3305 37.6957 177.2937 245 S 4.8289 7.8939 115.1778 58.2531 64.7487 174.2346 246 Y 4.6021 7.8029 121.9207 59.5445 43.0888 175.1237 247 K 4.1529 7.8146 119.5573 54.4916 35.6217 175.4999 248 A 3.8621 9.0434 129.8537 55.3768 18.1704 178.5435 249 D 4.2576 9.1730 111.1621 55.3825 39.8161 173.3007 250 G 3.7435 8.3730 106.8621 45.3175 0.0000 175.4140 251 L 4.6662 7.4497 119.8772 53.4739 42.2215 178.0876 252 L 3.7844 8.6326 120.3998 57.2942 41.7112 176.9719 253 R 4.4104 7.0077 113.0515 55.3309 32.2823 174.2222 254 V 3.9821 8.0087 117.8355 60.3736 32.5963 176.0492 255 L 3.6090 7.6668 122.8288 56.4026 41.6372 175.4713 256 T 4.5007 8.8468 108.4869 61.1496 70.1334 173.9383 257 V 4.7349 8.3227 111.8456 58.0987 35.2193 173.7460 258 P 3.8823 0.0000 0.0000 62.1102 31.7892 175.6141 259 C 3.9565 9.2318 126.5379 59.6168 31.8324 173.5810 260 Q 4.0905 8.9419 129.0252 56.7022 29.4483 175.8302 261 K 4.6475 8.0474 124.3109 52.2636 34.4721 176.4424 262 I 3.9131 8.2438 119.8787 62.0012 36.9544 176.2161 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 9 S 8.19 4.49 0.00 3.67 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 10 A 7.46 4.23 0.49 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 11 N 8.48 4.64 0.00 2.64 2.98 0.00 0.00 6.85 8.21 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 12 H 8.06 4.23 0.00 3.17 3.45 0.00 5.74 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 L 7.68 3.83 0.00 1.16 0.66 0.43 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 14 P 0.00 4.49 0.00 2.45 2.38 0.00 3.70 0.00 0.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.16 0.00 15 F 7.50 5.32 0.00 3.17 3.27 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 16 F 7.12 5.52 0.00 2.38 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 17 F 7.22 4.43 0.00 2.61 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 G 7.14 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 N 9.59 4.57 0.00 2.58 2.65 0.00 0.00 6.93 8.60 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 20 I 7.97 4.43 1.90 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 1.06 0.57 0.84 0.00 0.00 21 T 7.85 4.25 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 1.11 0.00 0.00 22 R 8.22 3.73 0.00 1.68 1.82 0.00 3.16 0.00 0.00 3.31 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.58 0.00 23 E 7.89 3.93 0.00 2.14 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 2.38 2.39 0.00 24 E 8.37 4.07 0.00 2.05 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 2.43 2.41 0.00 25 A 8.11 4.09 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 26 E 8.76 3.95 0.00 2.13 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 2.41 2.75 0.00 27 D 8.21 4.33 0.00 2.72 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 28 Y 7.59 3.85 0.00 2.90 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 L 7.92 4.23 0.00 2.01 1.80 0.99 0.97 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 30 V 7.53 3.71 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 0.94 0.00 0.00 0.97 0.00 0.00 31 Q 8.53 4.40 0.00 2.13 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.74 0.00 0.00 0.00 0.00 0.00 2.23 2.67 0.00 32 G 8.69 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 G 9.47 3.40 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 34 M 8.40 3.29 0.00 2.10 2.13 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.57 0.00 35 S 7.75 4.29 0.00 4.01 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 D 8.67 4.64 0.00 2.69 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 37 G 9.54 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 L 8.08 5.32 0.00 2.17 1.64 1.12 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 39 Y 7.98 5.37 0.00 3.27 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 40 L 9.32 5.22 0.00 2.15 2.06 1.19 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 41 L 9.72 5.45 0.00 1.75 1.57 0.81 0.99 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 42 R 9.02 5.10 0.00 1.90 2.00 0.00 2.79 0.00 0.00 3.08 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.63 0.00 43 Q 8.44 4.31 0.00 2.15 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.73 6.97 0.00 0.00 0.00 0.00 0.00 2.26 2.14 0.00 44 S 8.50 4.33 0.00 3.99 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 45 R 7.94 4.57 0.00 1.63 1.71 0.00 3.11 0.00 0.00 3.05 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.37 0.00 46 N 7.88 5.18 0.00 2.63 2.51 0.00 0.00 5.91 7.57 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 47 Y 7.70 5.32 0.00 2.85 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 48 L 10.14 3.78 0.00 1.67 1.70 1.03 0.46 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 49 G 8.76 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 0.00 0.00 0.00 50 G 7.56 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 F 9.63 5.11 0.00 2.68 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 A 9.81 5.07 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 L 10.07 5.37 0.00 1.80 1.67 0.89 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 54 S 8.99 5.17 0.00 4.00 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 55 V 9.04 5.25 2.25 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 0.93 0.00 0.00 1.11 0.00 0.00 56 A 10.15 4.63 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 57 H 9.21 4.80 0.00 3.17 3.27 0.00 5.99 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 G 9.54 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 59 R 8.28 3.71 0.00 1.97 2.07 0.00 3.20 0.00 0.00 3.22 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.62 0.00 60 K 8.35 4.32 0.00 1.73 1.67 0.00 1.62 0.00 0.00 1.64 0.00 0.00 2.96 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.41 1.60 7.81 61 A 8.06 4.97 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 62 H 8.76 4.62 0.00 3.21 3.03 0.00 5.59 0.00 0.00 0.00 0.00 6.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 H 8.54 5.31 0.00 2.91 3.13 0.00 5.64 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 Y 9.99 4.75 0.00 3.05 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 65 T 8.74 4.81 4.22 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 1.31 0.00 0.00 66 I 9.73 4.35 2.06 0.00 0.00 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 1.23 0.79 0.98 0.00 0.00 67 E 8.79 4.43 0.00 1.99 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 2.61 2.43 0.00 68 R 8.57 4.76 0.00 2.18 2.07 0.00 3.20 0.00 0.00 2.96 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.72 0.00 69 E 9.55 4.13 0.00 1.97 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 2.38 2.39 0.00 70 L 8.67 3.63 0.00 1.57 1.74 0.89 1.02 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 71 N 7.96 4.28 0.00 2.63 2.82 0.00 0.00 7.06 7.65 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 72 G 9.05 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 T 7.12 4.21 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 1.11 0.00 0.00 74 Y 7.97 5.35 0.00 2.89 2.88 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 75 A 8.83 4.66 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 76 I 8.51 3.78 1.84 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.95 0.99 0.00 0.00 77 A 8.67 4.06 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 78 G 9.52 3.97 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 0.00 0.00 0.00 79 G 7.43 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 80 R 8.35 3.84 0.00 1.62 1.54 0.00 2.51 0.00 0.00 2.81 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 1.45 0.00 81 T 8.03 4.63 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 82 H 9.02 4.82 0.00 3.16 3.17 0.00 5.82 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 A 8.69 3.97 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 84 S 7.78 5.06 0.00 4.00 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 85 P 0.00 3.82 0.00 1.47 1.13 0.00 3.42 0.00 0.00 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.57 0.00 86 A 7.20 3.93 1.17 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 0.00 0.00 87 D 8.23 4.26 0.00 2.85 2.76 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 88 L 7.63 3.51 0.00 1.49 1.73 0.80 0.75 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 89 C 7.85 3.99 0.00 3.18 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 90 H 7.84 4.23 0.00 3.30 3.43 0.00 5.65 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 Y 8.77 4.24 0.00 2.96 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 92 H 8.75 5.01 0.00 3.40 3.26 0.00 5.87 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 S 8.10 4.41 0.00 4.07 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 0.00 94 Q 7.63 4.47 0.00 1.85 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.37 0.00 0.00 0.00 0.00 0.00 2.30 2.28 0.00 95 E 7.36 4.36 0.00 1.32 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.03 0.00 96 S 8.40 3.98 0.00 3.84 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 D 9.30 4.20 0.00 2.88 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 G 8.38 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 99 L 8.33 3.74 0.00 1.98 1.76 0.80 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 100 V 7.45 3.54 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 0.71 0.00 0.00 0.91 0.00 0.00 101 C 7.38 4.61 0.00 2.99 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 L 7.97 4.30 0.00 1.71 1.63 0.88 0.51 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 0.00 103 L 7.66 4.41 0.00 1.58 1.77 -0.08 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 104 K 8.65 4.08 0.00 1.66 1.71 0.00 1.75 0.00 0.00 1.64 0.00 0.00 2.90 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.49 1.48 7.81 105 K 7.95 4.45 0.00 1.70 1.52 0.00 1.49 0.00 0.00 1.61 0.00 0.00 2.80 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.22 1.28 7.81 106 P 0.00 3.31 0.00 1.51 1.01 0.00 3.53 0.00 0.00 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.60 0.00 107 F 8.93 4.63 0.00 3.14 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 0.00 108 N 8.75 5.22 0.00 2.69 2.86 0.00 0.00 7.09 7.66 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 0.00 109 R 9.71 4.76 0.00 2.00 2.08 0.00 3.44 0.00 0.00 3.33 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.04 0.00 110 P 0.00 4.37 0.00 2.39 2.19 0.00 3.89 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 2.54 2.67 0.00 111 Q 8.74 4.03 0.00 2.08 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.54 0.00 0.00 0.00 0.00 0.00 2.42 2.37 0.00 112 G 9.45 4.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 V 6.81 3.61 2.33 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 0.85 0.00 0.00 1.05 0.00 0.00 114 Q 8.26 4.78 0.00 2.05 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.72 0.00 0.00 0.00 0.00 0.00 2.41 2.27 0.00 115 P 0.00 4.53 0.00 1.92 1.74 0.00 3.51 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 2.00 2.12 0.00 116 K 8.59 4.25 0.00 1.64 1.77 0.00 1.79 0.00 0.00 1.76 0.00 0.00 2.78 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.49 1.42 7.81 117 T 8.17 4.61 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 *152 P 0.00 4.51 0.00 2.06 2.13 0.00 3.64 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 2.09 0.00 153 Q 7.76 4.41 0.00 2.01 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.26 6.70 0.00 0.00 0.00 0.00 0.00 2.31 2.27 0.00 154 L 8.00 3.87 0.00 1.69 1.70 0.91 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 155 E 8.22 4.00 0.00 2.04 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 2.45 2.44 0.00 156 K 8.44 3.94 0.00 1.89 2.01 0.00 1.53 0.00 0.00 1.57 0.00 0.00 3.06 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.45 1.52 7.81 157 L 8.81 4.20 0.00 1.89 1.47 0.92 0.80 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 0.00 158 I 7.69 3.59 1.71 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.44 0.69 0.00 0.00 159 A 7.68 3.56 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 0.00 160 T 7.41 4.07 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 1.28 0.00 0.00 161 T 7.54 4.74 4.37 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 1.29 0.00 0.00 162 A 8.02 4.48 1.06 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 0.00 0.00 163 H 8.53 3.66 0.00 2.20 3.42 0.00 5.50 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 164 E 7.92 4.03 0.00 1.94 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 0.00 2.07 2.26 0.00 165 K 7.93 4.29 0.00 1.65 1.86 0.00 1.77 0.00 0.00 1.69 0.00 0.00 3.02 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.34 1.35 7.81 166 M 8.24 4.27 0.00 1.02 0.71 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3.01 2.88 0.00 167 P 0.00 4.26 0.00 2.17 2.19 0.00 3.76 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.16 0.00 168 W 7.97 4.15 0.00 3.50 2.88 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 0.00 169 F 8.48 5.48 0.00 1.74 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 0.00 170 H 8.88 4.40 0.00 3.00 3.10 0.00 5.77 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 171 G 6.01 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 0.00 0.00 0.00 172 K 8.13 4.73 0.00 1.70 1.65 0.00 1.78 0.00 0.00 1.77 0.00 0.00 3.34 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.31 1.48 7.81 173 I 7.74 4.71 1.85 0.00 0.00 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 1.26 0.35 0.97 0.00 0.00 174 S 10.13 4.32 0.00 3.87 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 0.00 175 R 8.56 3.69 0.00 1.80 1.92 0.00 3.00 0.00 0.00 3.12 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.34 0.00 176 E 7.92 4.24 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 2.34 2.44 0.00 177 E 9.69 4.10 0.00 2.00 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 2.34 2.35 0.00 178 S 7.97 4.28 0.00 3.97 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 0.00 179 E 7.81 3.88 0.00 2.21 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 2.59 2.59 0.00 180 Q 9.28 3.60 0.00 2.31 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.45 0.00 0.00 0.00 0.00 0.00 2.40 2.41 0.00 181 I 5.42 3.13 2.06 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.04 0.95 0.00 0.00 182 V 8.42 3.84 2.27 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 0.91 0.00 0.00 0.94 0.00 0.00 183 L 8.61 4.18 0.00 1.71 1.77 0.92 0.88 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 0.00 184 I 7.11 3.89 1.87 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 1.48 0.74 0.91 0.00 0.00 185 G 8.43 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 0.00 186 S 8.47 4.10 0.00 3.88 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 0.00 187 K 8.64 4.37 0.00 1.89 1.88 0.00 1.56 0.00 0.00 1.63 0.00 0.00 3.02 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.39 1.48 7.81 188 T 7.51 3.79 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 1.31 0.00 0.00 189 N 8.54 4.60 0.00 2.76 2.75 0.00 0.00 7.18 7.65 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 0.00 190 G 9.49 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 0.00 191 K 7.57 4.92 0.00 2.24 1.76 0.00 1.63 0.00 0.00 1.73 0.00 0.00 2.96 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.46 1.59 7.81 192 F 9.39 5.61 0.00 3.25 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 0.00 193 L 8.53 4.70 0.00 1.72 1.63 0.48 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 194 I 9.67 5.71 2.36 0.00 0.00 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 1.81 2.65 1.29 0.00 0.00 195 R 8.89 5.25 0.00 1.91 2.08 0.00 3.01 0.00 0.00 3.49 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.75 0.00 196 A 8.57 4.82 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 197 R 8.87 4.74 0.00 2.03 1.10 0.00 3.24 0.00 0.00 3.40 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.68 0.00 198 D 8.71 4.70 0.00 2.58 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 0.00 199 N 8.05 4.58 0.00 2.80 2.80 0.00 0.00 7.13 6.92 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 0.00 200 N 8.43 3.97 0.00 2.67 2.88 0.00 0.00 7.07 7.65 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 0.00 201 G 8.09 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 202 S 9.61 4.98 0.00 3.95 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 0.00 203 Y 8.65 5.34 0.00 2.96 3.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 204 A 9.33 5.18 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 L 9.70 5.03 0.00 1.78 1.80 1.11 1.24 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 0.00 206 C 9.52 6.09 0.00 2.98 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 0.00 207 L 8.37 5.40 0.00 1.86 1.84 0.98 0.22 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 0.00 208 L 9.07 4.89 0.00 1.78 1.61 0.89 1.02 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 0.00 209 H 9.44 4.84 0.00 3.17 3.09 0.00 5.99 0.00 0.00 0.00 0.00 6.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 210 E 10.25 3.87 0.00 1.97 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 2.17 0.00 211 G 8.04 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 0.00 212 K 7.67 4.53 0.00 1.78 1.71 0.00 1.61 0.00 0.00 1.69 0.00 0.00 2.94 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.32 1.33 7.81 213 V 8.12 4.56 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 0.74 0.00 0.00 0.90 0.00 0.00 214 L 9.19 4.61 0.00 1.39 1.22 0.55 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 215 H 8.57 5.45 0.00 3.01 3.23 0.00 5.64 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 216 Y 9.18 4.97 0.00 2.84 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 0.00 217 R 8.91 4.50 0.00 2.00 1.89 0.00 3.18 0.00 0.00 3.40 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.75 0.00 218 I 8.57 4.94 2.13 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 1.39 0.97 1.00 0.00 0.00 219 D 8.51 4.98 0.00 2.70 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 0.00 220 K 8.13 4.89 0.00 1.97 1.92 0.00 1.89 0.00 0.00 1.82 0.00 0.00 2.85 0.00 0.00 3.24 0.00 0.00 0.00 0.00 1.45 1.41 7.81 221 D 9.09 4.68 0.00 2.90 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 0.00 222 K 8.73 3.91 0.00 1.79 1.81 0.00 1.80 0.00 0.00 1.70 0.00 0.00 2.90 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.37 1.07 7.81 223 T 7.98 4.14 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 1.19 0.00 0.00 224 G 8.86 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 0.00 225 K 8.71 4.70 0.00 1.82 1.78 0.00 1.65 0.00 0.00 1.76 0.00 0.00 2.69 0.00 0.00 2.41 0.00 0.00 0.00 0.00 1.62 1.44 7.81 226 L 8.39 5.35 0.00 1.69 1.61 1.04 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 227 S 8.25 5.07 0.00 4.07 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 0.00 228 I 8.20 4.31 1.87 0.00 0.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.19 0.87 0.00 0.00 229 P 0.00 4.28 0.00 2.08 2.08 0.00 3.88 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.20 0.00 230 E 9.25 3.87 0.00 2.15 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 2.20 2.25 0.00 231 G 8.31 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 0.00 232 K 8.35 3.73 0.00 1.78 1.65 0.00 1.75 0.00 0.00 1.70 0.00 0.00 2.90 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.37 1.07 7.81 233 K 7.83 4.84 0.00 1.65 1.73 0.00 1.69 0.00 0.00 1.74 0.00 0.00 3.03 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.30 1.34 7.81 234 F 8.83 5.74 0.00 3.08 3.26 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 0.00 235 D 10.42 4.52 0.00 2.68 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 236 T 7.91 4.79 4.41 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 1.40 0.00 0.00 237 L 8.38 4.03 0.00 1.89 1.73 0.32 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 238 W 8.51 4.73 0.00 3.90 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 0.00 239 Q 7.87 3.67 0.00 1.98 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.88 0.00 0.00 0.00 0.00 0.00 2.43 2.66 0.00 240 L 6.62 2.00 0.00 0.47 1.20 0.96 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 241 V 7.97 3.28 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 0.30 0.00 0.00 0.20 0.00 0.00 242 E 7.30 3.48 0.00 2.02 1.62 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 2.10 2.10 0.00 243 H 7.81 4.32 0.00 3.30 3.35 0.00 5.65 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 244 Y 8.37 4.86 0.00 3.00 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 245 S 7.89 4.83 0.00 3.68 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 0.00 246 Y 7.80 4.60 0.00 2.82 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 247 K 7.81 4.15 0.00 1.24 1.60 0.00 1.93 0.00 0.00 2.01 0.00 0.00 3.14 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.55 1.38 7.81 248 A 9.04 3.86 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 0.00 249 D 9.17 4.26 0.00 3.07 3.43 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 0.00 250 G 8.37 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 0.00 251 L 7.45 4.67 0.00 1.73 1.60 0.38 -0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 252 L 8.63 3.78 0.00 1.55 1.52 0.87 0.83 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 0.00 253 R 7.01 4.41 0.00 1.68 1.87 0.00 3.15 0.00 0.00 3.27 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.49 0.00 254 V 8.01 3.98 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 0.68 0.00 0.00 0.83 0.00 0.00 255 L 7.67 3.61 0.00 0.87 0.13 0.55 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 256 T 8.85 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 1.25 0.00 0.00 257 V 8.32 4.73 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 0.87 0.00 0.00 1.03 0.00 0.00 258 P 0.00 3.88 0.00 2.07 2.09 0.00 3.89 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 2.04 2.11 0.00 259 C 9.23 3.96 0.00 2.81 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 0.00 260 Q 8.94 4.09 0.00 2.04 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.88 6.56 0.00 0.00 0.00 0.00 0.00 2.34 2.41 0.00 261 K 8.05 4.65 0.00 1.79 1.54 0.00 1.87 0.00 0.00 1.70 0.00 0.00 2.90 0.00 0.00 2.64 0.00 0.00 0.00 0.00 1.26 0.99 7.81 262 I 8.24 3.91 1.83 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 1.25 0.91 0.89 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.