NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 V 4.2245 7.9127 120.3987 62.7331 32.9666 173.6753 17 V 4.2088 8.6943 127.4801 61.8326 32.7836 174.4079 18 G 3.8510 8.5226 114.2585 46.8270 0.0000 172.6687 19 G 4.3585 7.8511 108.0850 44.5529 0.0000 172.7132 20 T 4.9045 8.4952 113.2233 59.9707 71.7033 174.0616 21 R 4.5796 8.4911 123.3665 56.0224 30.6012 176.7161 22 A 4.4195 8.5599 125.7266 51.4195 19.5452 177.3639 23 A 4.1083 9.1549 124.3066 51.2280 19.3658 177.2567 24 Q 4.1955 8.3644 122.0470 57.6114 29.4056 177.0346 25 G 3.9514 8.8516 113.8410 45.3646 0.0000 174.0264 26 E 3.8081 7.8966 120.1870 58.7554 30.0487 177.3421 27 F 4.5333 7.1108 117.1342 54.5847 38.9013 173.8007 28 P 4.3678 0.0000 0.0000 64.2054 31.8943 178.2243 29 F 4.7122 6.7654 113.1980 57.6303 38.5829 175.1632 30 M 4.8937 7.2518 122.0897 55.7142 32.4754 176.2812 31 V 4.8093 8.9272 114.8612 59.7547 36.7210 174.2715 32 R 4.5554 8.5108 124.2077 54.8835 31.6800 174.8741 33 L 5.2073 8.7032 126.3184 52.7304 43.8091 177.6579 34 S 4.1293 8.6866 118.1128 61.1149 63.2696 175.0994 35 M 4.2218 8.0741 116.6179 55.7502 31.7370 176.3555 *41 G 4.3458 7.5731 105.8733 46.7528 0.0000 172.3831 42 C 5.4541 8.3171 115.7808 55.3609 45.9899 174.6455 43 G 4.5010 8.9614 107.9835 45.1559 0.0000 172.2666 44 G 4.4036 8.4129 104.8244 45.6728 0.0000 172.3056 45 A 5.4942 8.7130 121.1728 49.8056 22.8644 176.0745 46 L 4.4443 8.9533 121.0893 54.5415 41.3800 177.4643 47 Y 3.9453 9.1567 127.0123 59.7053 39.3411 175.4205 48 A 4.8296 7.6645 120.1088 50.0436 22.6948 176.4422 49 Q 4.1180 8.7882 118.2760 58.3892 29.0180 178.2892 50 D 5.0316 8.1359 115.7896 52.6132 40.0535 174.8563 51 I 5.0134 7.9371 120.6269 60.4045 41.0018 174.3027 52 V 4.7181 9.1110 128.5273 61.5927 33.3325 174.2455 53 L 4.8906 8.9750 130.6758 54.4537 43.6517 175.2338 54 T 5.3105 9.1298 120.3495 60.7613 71.3156 172.1437 55 A 4.6579 8.5188 122.1680 51.0446 20.4182 178.5924 56 A 3.5861 8.1914 123.8095 55.2126 18.4142 179.2848 57 H 4.4981 8.1366 109.0603 57.0361 28.7246 175.5424 58 C 4.4192 7.5280 117.0988 58.1137 40.5093 173.6208 59 V 4.5808 7.1689 111.7587 59.2365 34.4174 175.6915 60 S 4.3352 8.6049 115.3682 58.5738 63.6349 174.1962 60A G 3.8542 7.1445 107.2592 45.6932 0.0000 171.6582 60B S 4.5321 8.4745 115.0964 57.8512 63.8832 173.6698 60C G 4.2680 8.1089 108.5998 42.7555 0.0000 172.8382 60D N 4.6963 8.1696 118.0460 53.4147 38.9461 175.0333 61 N 4.5478 8.6844 119.6229 53.5563 41.8503 174.0134 62 T 5.2437 8.8875 114.9452 60.8018 69.1135 174.8345 63 S 4.5121 8.5680 116.0961 58.9981 63.9947 173.7632 64 I 4.3914 7.5015 123.0893 60.3816 39.0795 174.6343 65 T 5.0332 8.9361 123.1404 61.6818 71.3105 172.9763 66 A 5.1649 9.0388 127.9962 50.4341 21.8992 175.2504 67 T 4.7875 9.0218 119.9535 61.8650 71.0674 173.9893 68 G 4.5492 9.1185 113.8016 45.0353 0.0000 173.3832 69 G 4.2410 9.6574 106.8255 45.5421 0.0000 174.0672 70 V 4.8592 7.2401 110.7486 59.8658 35.8968 175.5023 71 V 4.3409 8.8340 115.8901 62.9762 33.0004 175.2842 72 D 5.1652 8.2203 120.1906 52.8847 40.8816 176.5914 73 L 3.9163 8.7889 127.8337 57.5335 42.5050 179.3442 71 Q 4.5609 9.1240 116.4901 56.4762 29.5004 174.9842 72 S 4.9952 8.1903 115.4905 56.9847 63.5816 174.8914 73 S 4.0463 8.9389 121.7337 60.7335 63.9050 176.3442 *79 S 4.3944 7.9143 115.6364 57.6977 64.4515 173.6987 80 A 4.2963 7.7061 122.2227 52.0563 19.2933 177.1464 81 V 4.2512 8.5452 120.5461 61.1304 33.9873 174.5005 82 K 5.0151 8.6762 127.8064 54.7386 33.8407 175.9504 83 V 4.4617 8.7166 125.3694 61.0239 34.6744 175.0621 84 R 4.8805 8.5012 126.0536 55.5971 32.0380 176.1684 85 S 4.9761 8.9607 117.3408 58.6712 64.4493 174.5903 86 T 4.5992 8.9419 109.1652 62.4299 71.3897 173.8269 87 K 4.9465 7.6908 118.3336 55.7271 35.9613 174.7756 88 V 4.8178 8.7613 121.2022 61.0471 35.0977 174.1602 89 L 4.7896 9.1048 129.1602 53.3493 44.2968 174.7444 90 Q 4.3216 8.7576 128.2912 54.3220 30.5495 175.1443 91 A 2.5800 7.1484 126.4713 51.3005 19.1185 175.5247 92 P 4.2303 0.0000 0.0000 64.3345 31.7923 177.0297 93 G 3.9003 8.8703 110.5534 45.1765 0.0000 172.8837 94 Y 4.0653 7.6134 121.9507 58.2103 39.0599 176.9997 95 N 4.3389 7.5448 122.2236 53.0907 38.3406 175.1148 96 G 3.4378 5.8475 105.5619 46.6730 0.0000 174.4022 *98 T 4.6715 6.9386 114.6439 63.2405 69.3227 172.3194 *100 G 4.5904 7.2801 108.5082 47.0291 0.0000 170.4611 101 K 3.0080 8.4730 115.3656 57.3288 30.5572 176.0007 102 D 4.6582 7.9334 116.9942 52.6779 39.0387 174.8556 103 W 5.5370 7.0109 117.7493 54.9156 32.6588 174.9685 104 A 4.9246 9.0382 121.0664 51.0712 22.7984 175.1175 105 L 5.3255 9.1365 119.6276 52.9833 45.6341 175.8569 106 I 4.9457 8.6730 123.2632 59.3399 40.4356 174.5952 107 K 4.6994 9.1829 129.7293 56.0033 33.4757 175.6002 108 L 5.1037 8.8439 126.9537 53.0301 43.7322 177.5387 109 A 4.1037 8.8138 124.0591 54.6674 18.8188 177.9953 110 Q 4.5681 7.4917 109.7461 53.4198 33.0196 173.0581 111 P 4.6361 0.0000 0.0000 62.5829 32.3395 175.7313 112 I 4.2638 8.2211 122.0942 60.0428 38.3561 176.8398 113 N 4.6234 8.3651 126.9435 52.4083 37.2082 173.4318 *118 Q 4.7164 7.4398 118.5147 54.5396 30.5743 173.7594 119 P 4.3975 0.0000 0.0000 63.2162 31.8985 176.3303 120 T 4.5342 8.1545 110.9411 60.2486 70.8356 173.3672 121 L 4.3451 8.0684 123.9211 52.6662 43.7164 175.9718 122 K 4.1660 8.5275 128.3563 56.4422 33.4378 175.4214 123 I 4.7113 8.1550 119.5595 59.1465 39.8666 175.0322 124 A 4.3997 8.8411 127.0476 52.4018 19.2312 178.2706 125 T 4.2145 8.7254 111.0785 61.9515 70.1927 174.0259 *128 T 4.8891 7.7456 111.1447 62.3565 69.9299 173.3560 129 T 4.3275 7.9823 108.1872 61.3166 69.0720 176.3341 130 A 3.7643 7.3960 126.6246 55.0102 18.2974 178.4200 131 Y 4.7240 7.5001 110.6959 58.1246 38.8827 176.1998 132 N 4.7854 7.7898 119.3069 51.2854 37.5427 173.3380 133 Q 3.5730 7.7934 114.6370 56.3755 31.7677 175.1573 134 G 3.6307 8.0777 104.7479 44.9976 0.0000 171.2637 135 T 4.3550 8.0729 116.0648 62.1105 70.0312 175.0052 136 F 5.1142 8.5280 125.4970 56.6011 42.0019 174.6596 137 T 4.7564 8.3982 116.1562 61.8504 71.7764 174.0475 138 V 4.5901 8.2737 117.5378 59.7861 36.1687 174.2738 139 A 4.9010 7.6618 121.4431 51.0602 22.0907 175.7103 140 G 3.7859 7.9582 107.0669 45.9482 0.0000 173.4615 141 W 4.9923 8.3720 116.3480 56.4342 30.6019 176.8891 142 G 4.2383 8.6777 108.8993 45.1811 0.0000 173.7714 143 A 4.6445 9.0579 122.2620 51.3728 18.8739 177.5349 144 N 5.4316 8.5835 116.3179 51.2989 38.0613 174.6816 145 R 4.4460 7.2490 112.1218 55.6231 31.4003 173.6680 146 E 4.0939 8.4153 119.8613 56.9462 29.8204 178.1948 *148 G 3.9421 8.0619 110.8396 44.8383 0.0000 172.6531 149 G 4.0741 7.9297 107.8134 45.5004 0.0000 173.5795 150 S 4.7939 8.3897 114.6477 57.0934 65.5043 173.7497 151 Q 4.3024 8.5568 118.7997 56.2510 29.8927 175.2489 152 Q 4.8040 8.9462 120.7579 54.7330 29.8785 176.3329 153 R 4.0273 8.8588 123.6217 58.7428 30.8947 175.9840 154 Y 5.2743 7.8470 115.2841 55.5993 40.4307 175.8185 155 L 2.9827 8.7688 125.5740 55.3833 43.1966 175.5892 156 L 5.3631 8.4595 125.7734 52.8285 44.9914 175.5028 157 K 5.2127 9.1647 120.0405 55.6405 36.5209 174.7147 158 A 4.8635 8.6127 120.9527 51.2158 23.2149 174.7282 159 N 5.2415 8.7101 116.8712 51.7006 40.6347 175.0261 160 V 4.2941 8.5261 116.7825 58.7660 35.3182 173.7408 161 P 4.5200 0.0000 0.0000 61.7986 32.6495 175.6460 162 F 4.6255 8.2622 125.6443 58.5400 40.0671 174.5100 163 V 4.1396 7.3589 124.9034 60.4008 33.6899 175.6911 164 S 4.0440 8.1795 121.8768 57.9613 63.9025 174.6008 165 D 4.3095 8.8613 120.3880 57.4212 40.9146 178.3737 166 A 3.9376 7.9976 120.4702 55.2798 18.2310 179.2659 167 A 3.8939 8.0062 119.1802 55.4759 18.4074 179.0739 168 C 4.2304 8.3249 117.0669 59.7586 41.7919 175.7871 169 R 3.9058 8.6844 120.8677 59.0534 29.4205 178.5263 170 S 4.2054 7.9836 113.2436 60.6024 62.9280 175.7901 171 A 3.9896 7.0168 123.5105 54.0721 19.4452 178.1097 172 Y 4.8687 8.0114 113.2108 57.6753 39.3720 177.3463 173 G 3.8201 9.0085 110.3176 46.5484 0.0000 176.1601 174 N 4.5891 8.8954 119.5396 55.3437 38.7140 175.9838 175 E 3.9826 8.0039 117.3980 58.6699 29.7257 177.1838 176 L 4.5511 7.9868 121.5043 54.5339 42.7144 176.2591 177 V 4.0319 9.8058 127.1698 61.0925 31.0464 174.8709 177A A 4.2404 8.5742 130.3244 54.0895 18.4665 177.0321 178 N 4.5506 9.0087 117.0538 53.5852 36.5264 174.4047 179 E 4.8776 8.4009 116.4314 55.8885 32.2297 175.3833 180 E 5.3692 8.3252 117.8697 54.5803 33.8113 174.5933 181 I 4.8037 9.1852 123.1715 59.5520 41.7884 173.5494 182 C 5.7234 8.6637 123.9429 55.7330 40.7928 172.2965 183 A 4.9318 8.7905 120.3600 51.7806 22.6267 176.6570 184 G 3.6704 7.3330 106.2561 44.5104 0.0000 173.3914 185 Y 4.4605 8.2213 119.0180 55.3637 38.3552 174.3985 185A P 4.3481 0.0000 0.0000 65.3289 31.9931 178.9538 185B D 4.2699 8.2892 116.9778 56.8679 41.2517 176.7408 185C T 4.5096 7.7402 104.2020 59.9739 70.6573 175.9470 186 G 3.7290 9.0404 111.1532 48.3952 0.0000 174.0590 187 G 4.1170 9.3051 106.3837 44.6943 0.0000 172.6956 188 V 4.9698 7.1848 117.9973 61.3652 34.2062 174.2382 189 D 4.6539 8.8068 125.9629 54.0903 45.4896 174.5682 190 T 4.7951 8.5901 111.8803 61.3238 70.8577 173.8889 191 C 4.6868 9.5133 121.2954 54.9849 45.1429 171.9443 192 Q 4.0822 8.7089 121.0213 58.7778 28.2849 177.2174 193 G 4.6308 8.9527 112.5345 46.0776 0.0000 173.6407 194 D 4.7064 8.5653 119.0547 55.0390 41.8295 176.8229 195 S 4.5176 7.9622 115.7631 60.4652 63.2813 175.0535 196 G 4.4183 8.6066 111.8707 46.5022 0.0000 174.0301 197 G 3.9888 7.9318 106.9658 45.6365 0.0000 171.2768 198 P 5.2643 0.0000 0.0000 62.2044 33.1770 174.7929 199 M 4.6779 8.9342 122.4709 53.7950 34.4889 174.6163 200 F 5.4869 8.0205 120.4493 55.8470 42.5128 172.9031 201 R 5.3208 8.7877 114.2640 55.2156 33.0928 174.2772 202 K 4.5029 8.8866 119.4771 56.6229 32.5071 177.5062 203 D 3.8863 8.4526 124.4539 51.9062 41.6903 176.4417 204 N 4.6485 8.3946 115.7938 54.4370 37.4924 175.1055 204A A 4.5818 8.3166 121.9463 51.5728 19.5116 175.5334 205 D 4.2452 7.5664 115.0785 56.9763 40.3414 173.2661 206 E 4.6226 7.7523 114.6662 53.5727 33.7080 176.2342 207 W 5.0310 8.5732 123.0499 57.2729 30.2061 175.3928 208 I 4.6987 9.0307 123.2037 59.2937 41.4904 173.6439 209 Q 4.6216 9.3170 131.1135 56.0004 29.6692 176.1622 210 V 4.1787 8.7844 119.7156 61.6577 34.0806 175.6284 211 G 5.0698 7.6326 106.2332 45.8288 0.0000 171.5008 212 I 5.2184 8.3591 119.6230 58.8507 41.1045 175.3157 213 V 3.6093 9.0218 127.5458 64.2468 31.8186 174.3936 214 S 4.8201 8.4936 120.2326 57.6130 64.3340 173.6436 215 W 4.7013 6.9954 114.0356 55.9082 31.7304 172.2789 216 G 4.0179 8.3203 106.3377 46.4489 0.0000 172.0854 217 Y 4.8291 8.5716 122.3861 56.2448 38.7664 174.5789 214 G 4.3101 8.5136 113.3326 44.4130 0.0000 173.9436 215 C 4.5913 7.0654 111.3356 56.6082 30.1304 170.7789 216 A 4.3779 8.2303 121.3377 53.8489 20.9540 174.9854 217 R 4.6191 8.6816 122.5861 54.3448 31.8664 174.9789 223 P 4.3129 0.0000 0.0000 64.2071 31.7616 177.1208 223A G 3.6725 9.0511 110.7475 45.6646 0.0000 173.6728 224 Y 4.4134 7.2393 116.1393 54.9960 38.4585 173.0243 225 P 4.6311 0.0000 0.0000 61.9895 33.1630 176.5758 226 G 3.7681 8.7895 107.7716 46.1081 0.0000 172.7564 227 V 4.6266 7.6460 121.8552 60.8310 33.6071 174.3481 228 Y 4.9685 8.9922 124.2667 56.0815 42.4134 174.9769 229 T 4.3836 9.0978 119.7881 63.7645 69.8429 173.9543 230 E 4.5613 9.5440 128.2445 55.1157 28.7569 176.8586 231 V 3.8333 8.5615 127.2648 65.7885 31.9100 178.4228 232 S 4.5027 8.0863 115.0255 61.3692 62.5629 176.3471 233 T 3.7906 7.5565 117.7676 65.3246 68.3835 175.6770 234 F 4.6878 7.4557 116.6126 56.8785 39.6021 177.0657 235 A 3.8947 7.8706 122.6734 55.3768 18.1674 180.0190 236 S 4.0026 7.9769 111.8035 61.5040 63.0827 176.3810 237 A 3.9903 7.8326 123.9233 54.8286 18.1968 179.4806 238 I 2.7243 7.6122 118.4206 64.1167 36.9348 178.5365 239 A 4.2249 7.8576 122.9963 54.7564 17.9857 179.9222 240 S 4.0670 7.8732 112.3638 61.6974 63.3415 176.4165 241 A 4.1857 8.2082 123.3275 55.2030 18.2096 179.5863 242 A 4.0173 8.1863 119.3035 55.2379 18.1862 180.0540 243 R 4.0452 7.7294 116.1185 58.9759 30.1870 178.3233 244 T 4.2781 7.5347 106.9771 62.2667 69.2943 174.7329 245 L 4.3040 7.6155 127.0814 55.0696 41.9034 176.0802 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 16 V 7.91 4.22 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 1.07 0.00 0.00 0.95 0.00 0.00 17 V 8.69 4.21 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 0.95 0.00 0.00 0.99 0.00 0.00 18 G 8.52 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 19 G 7.85 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 20 T 8.50 4.90 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 1.23 0.00 0.00 21 R 8.49 4.58 0.00 1.67 1.79 0.00 2.92 0.00 0.00 2.99 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.58 0.00 22 A 8.56 4.42 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 23 A 9.15 4.11 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 Q 8.36 4.20 0.00 2.02 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.55 0.00 0.00 0.00 0.00 0.00 2.36 2.43 0.00 25 G 8.85 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 26 E 7.90 3.81 0.00 1.67 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 1.47 1.75 0.00 27 F 7.11 4.53 0.00 2.68 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 0.00 0.00 0.00 0.00 28 P 0.00 4.37 0.00 2.30 2.15 0.00 3.66 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.98 0.00 29 F 6.77 4.71 0.00 3.25 3.51 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 30 M 7.25 4.89 0.00 2.09 2.13 0.00 0.00 0.00 0.00 0.00 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.34 0.00 31 V 8.93 4.81 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 1.00 0.00 0.00 1.02 0.00 0.00 32 R 8.51 4.56 0.00 0.67 1.09 0.00 3.24 0.00 0.00 2.88 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 1.31 0.00 33 L 8.70 5.21 0.00 1.59 1.51 0.93 0.78 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 34 S 8.69 4.13 0.00 3.84 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 35 M 8.07 4.22 0.00 2.16 2.31 0.00 0.00 0.00 0.00 0.00 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.84 2.46 0.00 *41 G 7.57 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 42 C 8.32 5.45 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 43 G 8.96 4.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.41 4.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 A 8.71 5.49 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 46 L 8.95 4.44 0.00 1.74 1.84 0.99 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 47 Y 9.16 3.95 0.00 3.00 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 A 7.66 4.83 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 49 Q 8.79 4.12 0.00 2.14 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.74 6.87 0.00 0.00 0.00 0.00 0.00 2.47 2.37 0.00 50 D 8.14 5.03 0.00 2.96 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 51 I 7.94 5.01 2.09 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 1.07 0.98 0.00 0.00 52 V 9.11 4.72 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.98 0.00 0.00 53 L 8.98 4.89 0.00 1.82 1.60 0.98 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 54 T 9.13 5.31 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 55 A 8.52 4.66 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 56 A 8.19 3.59 0.15 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 57 H 8.14 4.50 0.00 3.32 3.50 0.00 5.56 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 C 7.53 4.42 0.00 3.07 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 59 V 7.17 4.58 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 0.66 0.00 0.00 0.83 0.00 0.00 60 S 8.60 4.34 0.00 3.96 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 60A G 7.14 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 60B S 8.47 4.53 0.00 3.83 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60C G 8.11 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 60D N 8.17 4.70 0.00 2.72 2.76 0.00 0.00 6.60 8.00 0.00 0.00 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 N 8.68 4.55 0.00 2.61 2.64 0.00 0.00 7.02 8.41 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 62 T 8.89 5.24 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 1.24 0.00 0.00 63 S 8.57 4.51 0.00 3.96 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 64 I 7.50 4.39 1.86 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 1.21 0.73 0.89 0.00 0.00 65 T 8.94 5.03 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 1.16 0.00 0.00 66 A 9.04 5.16 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 67 T 9.02 4.79 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 1.06 0.00 0.00 68 G 9.12 4.55 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 0.00 0.00 0.00 69 G 9.66 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 70 V 7.24 4.86 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 0.80 0.00 0.00 1.04 0.00 0.00 71 V 8.83 4.34 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 1.11 0.00 0.00 1.06 0.00 0.00 72 D 8.22 5.17 0.00 3.00 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 73 L 8.79 3.92 0.00 1.47 1.48 0.44 -0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 71 Q 9.12 4.56 0.00 1.95 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.86 0.00 0.00 0.00 0.00 0.00 2.36 2.01 0.00 72 S 8.19 5.00 0.00 4.17 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 73 S 8.94 4.05 0.00 3.74 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 *79 S 7.91 4.39 0.00 3.93 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 80 A 7.71 4.30 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 81 V 8.55 4.25 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 0.90 0.00 0.00 0.93 0.00 0.00 82 K 8.68 5.02 0.00 1.62 1.67 0.00 1.70 0.00 0.00 1.58 0.00 0.00 2.78 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.28 1.35 7.81 83 V 8.72 4.46 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 1.09 0.00 0.00 0.93 0.00 0.00 84 R 8.50 4.88 0.00 1.80 1.81 0.00 3.16 0.00 0.00 3.38 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.61 0.00 85 S 8.96 4.98 0.00 3.88 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 86 T 8.94 4.60 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 1.22 0.00 0.00 87 K 7.69 4.95 0.00 1.81 1.90 0.00 1.45 0.00 0.00 1.76 0.00 0.00 2.82 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.41 1.43 7.81 88 V 8.76 4.82 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 1.01 0.00 0.00 0.91 0.00 0.00 89 L 9.10 4.79 0.00 1.69 1.54 0.99 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 90 Q 8.76 4.32 0.00 1.90 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.48 0.00 0.00 0.00 0.00 0.00 1.93 1.90 0.00 91 A 7.15 2.58 0.05 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 92 P 0.00 4.23 0.00 2.08 2.02 0.00 3.73 0.00 0.00 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.07 0.00 93 G 8.87 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 94 Y 7.61 4.07 0.00 2.87 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 N 7.54 4.34 0.00 2.61 2.60 0.00 0.00 6.30 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 G 5.85 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *98 T 6.94 4.67 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 *100 G 7.28 4.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.47 3.01 0.00 1.93 1.70 0.00 1.75 0.00 0.00 1.74 0.00 0.00 2.98 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.67 1.60 7.81 102 D 7.93 4.66 0.00 2.85 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 0.00 103 W 7.01 5.54 0.00 3.29 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 A 9.04 4.92 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 L 9.14 5.33 0.00 1.61 1.56 0.90 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 106 I 8.67 4.95 1.89 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 1.10 0.66 0.91 0.00 0.00 107 K 9.18 4.70 0.00 1.88 1.68 0.00 1.72 0.00 0.00 1.68 0.00 0.00 2.97 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.44 1.48 7.81 108 L 8.84 5.10 0.00 1.70 1.60 0.95 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 109 A 8.81 4.10 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 0.00 110 Q 7.49 4.57 0.00 2.06 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.86 0.00 0.00 0.00 0.00 0.00 2.29 2.28 0.00 111 P 0.00 4.64 0.00 2.35 2.06 0.00 3.76 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 1.99 1.99 0.00 112 I 8.22 4.26 1.91 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 1.20 0.90 0.94 0.00 0.00 113 N 8.37 4.62 0.00 2.81 2.73 0.00 0.00 7.15 6.69 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 *118 Q 7.44 4.72 0.00 2.16 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.60 6.75 0.00 0.00 0.00 0.00 0.00 2.29 2.33 0.00 119 P 0.00 4.40 0.00 2.33 2.07 0.00 3.63 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 2.18 2.13 0.00 120 T 8.15 4.53 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 1.19 0.00 0.00 121 L 8.07 4.35 0.00 0.64 1.25 0.18 -0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 122 K 8.53 4.17 0.00 1.79 1.57 0.00 1.73 0.00 0.00 1.82 0.00 0.00 2.84 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.47 1.39 7.81 123 I 8.15 4.71 1.90 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.83 1.05 0.00 0.00 124 A 8.84 4.40 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 0.00 125 T 8.73 4.21 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 1.23 0.00 0.00 *128 T 7.75 4.89 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 129 T 7.98 4.33 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 1.18 0.00 0.00 130 A 7.40 3.76 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 Y 7.50 4.72 0.00 3.03 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 0.00 132 N 7.79 4.79 0.00 2.76 2.76 0.00 0.00 6.73 7.02 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 0.00 133 Q 7.79 3.57 0.00 1.81 1.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.59 0.00 0.00 0.00 0.00 0.00 2.06 2.19 0.00 134 G 8.08 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 T 8.07 4.35 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 1.15 0.00 0.00 136 F 8.53 5.11 0.00 2.88 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 0.00 137 T 8.40 4.76 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 0.63 0.00 0.00 138 V 8.27 4.59 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 0.55 0.00 0.00 0.96 0.00 0.00 139 A 7.66 4.90 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 0.00 140 G 7.96 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 W 8.37 4.99 0.00 3.30 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 G 8.68 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 0.00 143 A 9.06 4.64 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 0.00 144 N 8.58 5.43 0.00 2.86 2.96 0.00 0.00 6.25 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 0.00 145 R 7.25 4.45 0.00 1.96 2.02 0.00 2.98 0.00 0.00 3.35 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.57 0.00 146 E 8.42 4.09 0.00 2.03 1.89 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 2.36 2.29 0.00 *148 G 8.06 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 0.00 0.00 0.00 149 G 7.93 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 0.00 0.00 0.00 150 S 8.39 4.79 0.00 3.93 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 0.00 151 Q 8.56 4.30 0.00 2.03 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.94 0.00 0.00 0.00 0.00 0.00 2.48 2.36 0.00 152 Q 8.95 4.80 0.00 2.15 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.67 6.99 0.00 0.00 0.00 0.00 0.00 2.55 2.51 0.00 153 R 8.86 4.03 0.00 1.67 1.67 0.00 2.98 0.00 0.00 2.74 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 1.32 0.00 154 Y 7.85 5.27 0.00 2.93 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 0.00 155 L 8.77 2.98 0.00 1.06 1.34 -0.62 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 156 L 8.46 5.36 0.00 1.56 1.50 0.95 0.60 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 0.00 157 K 9.16 5.21 0.00 1.83 2.05 0.00 1.62 0.00 0.00 1.97 0.00 0.00 3.04 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.54 1.44 7.81 158 A 8.61 4.86 1.24 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 0.00 159 N 8.71 5.24 0.00 2.65 2.76 0.00 0.00 6.73 7.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 160 V 8.53 4.29 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 0.87 0.00 0.00 161 P 0.00 4.52 0.00 1.74 1.76 0.00 2.75 0.00 0.00 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.84 0.00 162 F 8.26 4.63 0.00 2.47 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 0.00 163 V 7.36 4.14 1.76 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 0.70 0.00 0.00 0.75 0.00 0.00 164 S 8.18 4.04 0.00 4.07 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 0.00 165 D 8.86 4.31 0.00 2.82 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 0.00 166 A 8.00 3.94 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 0.00 167 A 8.01 3.89 1.24 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 0.00 168 C 8.32 4.23 0.00 3.12 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 0.00 169 R 8.68 3.91 0.00 2.08 2.07 0.00 3.19 0.00 0.00 3.27 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.89 0.00 170 S 7.98 4.21 0.00 4.01 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 0.00 171 A 7.02 3.99 0.62 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 0.00 172 Y 8.01 4.87 0.00 3.26 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 0.00 173 G 9.01 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 0.00 174 N 8.90 4.59 0.00 2.75 2.92 0.00 0.00 6.77 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 0.00 175 E 8.00 3.98 0.00 2.24 1.74 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 2.28 2.47 0.00 176 L 7.99 4.55 0.00 1.92 1.89 1.11 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 177 V 9.81 4.03 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 1.01 0.00 0.00 1.11 0.00 0.00 177A A 8.57 4.24 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 0.00 178 N 9.01 4.55 0.00 2.92 2.96 0.00 0.00 7.07 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 0.00 179 E 8.40 4.88 0.00 2.23 2.35 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 2.35 2.37 0.00 180 E 8.33 5.37 0.00 1.94 1.89 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 2.44 2.52 0.00 181 I 9.19 4.80 2.03 0.00 0.00 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 1.55 1.87 1.04 0.00 0.00 182 C 8.66 5.72 0.00 2.96 3.05 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 0.00 183 A 8.79 4.93 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 0.00 184 G 7.33 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 0.00 0.00 0.00 185 Y 8.22 4.46 0.00 3.22 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 185A P 0.00 4.35 0.00 2.12 2.02 0.00 3.58 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.99 0.00 185B D 8.29 4.27 0.00 2.65 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 185C T 7.74 4.51 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 186 G 9.04 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 187 G 9.31 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 188 V 7.18 4.97 2.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 1.00 0.00 0.00 189 D 8.81 4.65 0.00 2.88 2.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 190 T 8.59 4.80 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 1.35 0.00 0.00 191 C 9.51 4.69 0.00 2.92 3.13 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 0.00 192 Q 8.71 4.08 0.00 2.14 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.65 0.00 0.00 0.00 0.00 0.00 2.47 2.43 0.00 193 G 8.95 4.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 194 D 8.57 4.71 0.00 2.88 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 0.00 195 S 7.96 4.52 0.00 3.94 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 196 G 8.61 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 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 7.57 4.25 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 0.00 206 E 7.75 4.62 0.00 2.11 1.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.42 0.00 207 W 8.57 5.03 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 0.00 208 I 9.03 4.70 1.69 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 1.14 1.56 0.70 0.00 0.00 209 Q 9.32 4.62 0.00 2.02 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.37 0.00 0.00 0.00 0.00 0.00 2.33 2.49 0.00 210 V 8.78 4.18 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 0.90 0.00 0.00 0.23 0.00 0.00 211 G 7.63 5.07 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 0.00 0.00 0.00 212 I 8.36 5.22 1.99 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 1.31 0.76 1.00 0.00 0.00 213 V 9.02 3.61 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 0.85 0.00 0.00 1.23 0.00 0.00 214 S 8.49 4.82 0.00 4.08 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 0.00 215 W 7.00 4.70 0.00 3.40 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 0.00 216 G 8.32 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 0.00 217 Y 8.57 4.83 0.00 3.22 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 0.00 214 G 8.51 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 0.00 0.00 0.00 0.00 215 C 7.07 4.59 0.00 3.04 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 216 A 8.23 4.38 1.24 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 0.00 217 R 8.68 4.62 0.00 2.05 1.63 0.00 2.21 0.00 0.00 3.17 7.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.56 0.00 223 P 0.00 4.31 0.00 2.07 2.20 0.00 3.78 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.22 0.00 223A G 9.05 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 0.00 0.00 0.00 224 Y 7.24 4.41 0.00 3.06 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 0.00 225 P 0.00 4.63 0.00 2.10 2.05 0.00 3.58 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.93 0.00 226 G 8.79 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 0.00 227 V 7.65 4.63 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 0.00 0.00 -0.47 0.00 0.00 228 Y 8.99 4.97 0.00 2.94 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 229 T 9.10 4.38 4.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 230 E 9.54 4.56 0.00 2.11 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.29 0.00 231 V 8.56 3.83 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 0.96 0.00 0.00 1.05 0.00 0.00 232 S 8.09 4.50 0.00 4.04 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 0.00 233 T 7.56 3.79 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.53 0.00 0.00 234 F 7.46 4.69 0.00 2.93 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 235 A 7.87 3.89 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 0.00 236 S 7.98 4.00 0.00 4.05 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 237 A 7.83 3.99 1.47 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 0.00 0.00 238 I 7.61 2.72 1.55 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.20 -0.36 0.29 0.00 0.00 239 A 7.86 4.22 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 0.00 240 S 7.87 4.07 0.00 4.02 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 0.00 241 A 8.21 4.19 1.55 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 0.00 0.00 242 A 8.19 4.02 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 0.00 243 R 7.73 4.05 0.00 1.92 2.04 0.00 3.19 0.00 0.00 3.30 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.97 0.00 244 T 7.53 4.28 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 245 L 7.62 4.30 0.00 1.85 1.63 1.02 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.