NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 E 4.2549 8.4444 121.4744 55.6235 30.8390 174.3396 2 V 4.1601 8.1454 121.6361 61.0658 32.0612 173.3705 3 Q 4.6861 10.1139 126.1396 55.8321 33.3297 172.0689 4 L 5.2235 8.3445 118.6398 52.9622 45.0215 175.5662 5 L 4.8506 9.0172 124.5137 53.1305 43.8781 175.6462 6 E 5.2273 9.1963 123.9135 55.2552 31.8111 175.1795 7 S 4.5105 8.8373 116.1320 57.9218 67.4736 173.6865 8 G 3.7084 8.4331 106.7901 44.7379 0.0000 172.8454 9 G 3.6947 7.7694 106.3022 44.1539 0.0000 170.9481 10 G 3.7943 8.0555 102.0222 43.9209 0.0000 172.5355 11 L 4.9846 8.1393 123.2073 54.3740 43.8852 177.8277 12 V 4.3564 8.0051 120.7205 60.5917 35.0888 172.9330 13 K 4.9919 8.5072 123.8208 55.0026 33.4342 174.8380 14 P 4.5992 0.0000 0.0000 64.0713 31.9420 177.0267 15 G 3.9696 9.5735 111.4591 45.3980 0.0000 173.8337 16 G 4.3002 7.8235 107.0649 45.8023 0.0000 172.6032 17 S 5.7930 8.2672 113.6426 55.7935 67.3836 173.3690 18 L 4.7468 7.9743 122.3859 53.5663 45.7795 174.3140 19 R 4.7637 8.3359 124.8932 54.5255 32.2834 174.7885 20 L 4.4949 8.6521 126.9499 54.0861 43.7098 176.0317 21 S 5.2931 8.8570 116.8405 57.1365 67.3784 172.3738 22 C 5.3769 8.9765 121.3385 55.0650 45.3549 172.3388 23 A 5.2093 9.2123 127.7290 50.0119 21.2720 175.0055 24 A 4.8170 8.4883 125.2139 51.0418 20.1281 177.0088 25 S 4.3485 9.1184 116.1135 57.7472 66.3652 175.1209 26 G 3.9805 10.8075 111.5058 44.9931 0.0000 172.0434 27 F 4.7728 7.0376 112.6218 56.3947 40.3580 172.9461 28 T 4.5531 8.4265 110.4500 59.3671 70.4498 174.5445 29 L 4.0866 8.9246 129.4501 58.0255 42.2383 178.8131 30 I 3.7722 7.8509 117.3561 63.7871 37.9758 176.3314 31 N 4.3970 8.2612 116.8831 54.7375 38.6889 174.7192 32 Y 4.7741 7.7148 114.3913 55.7655 40.8684 174.9411 33 R 4.4668 8.4941 122.7091 56.4168 31.5145 175.0922 34 M 5.1231 8.8595 125.5366 54.0419 35.2294 174.5554 35 N 5.6073 8.8104 117.5815 51.7881 44.2062 173.2204 36 W 5.2124 9.2191 119.8335 55.0224 32.6704 175.1755 37 V 5.0428 9.2586 123.4186 61.1451 34.6673 174.3412 38 R 4.9031 9.2633 122.9962 54.5511 33.3737 174.5298 39 Q 4.8634 9.0997 121.0796 54.1583 32.0982 173.7652 40 A 4.3978 8.6941 129.1616 50.9827 19.9129 174.7818 41 P 4.2126 0.0000 0.0000 64.6437 31.7114 177.1295 42 G 3.9640 9.1783 110.8399 45.2685 0.0000 172.2432 43 K 4.6684 7.8151 118.2638 53.9363 35.6412 175.2366 44 G 3.9496 8.2741 107.8486 45.5826 0.0000 171.7218 45 L 5.0605 8.2675 118.4389 53.2227 43.7948 176.2812 46 E 4.7446 9.2353 123.4308 53.9502 32.6889 174.5256 47 W 4.5883 9.3378 135.0000 58.0984 31.3089 174.7061 48 V 3.9111 7.8285 125.3445 63.9015 33.4164 175.0496 49 S 4.5393 6.5945 112.0264 57.2173 65.7642 173.3806 50 S 5.3712 8.9851 118.7642 56.7989 67.0236 172.5868 51 I 4.9685 8.7902 121.6852 59.1619 41.2006 174.9743 52 S 4.6109 8.9881 124.4479 58.0410 64.0147 175.1717 52A S 4.0847 8.9105 115.5468 61.6622 61.9644 175.4729 53 S 4.2860 8.0011 110.9995 58.6282 63.1593 174.5587 54 S 3.9227 8.1248 116.2939 59.5839 60.7823 171.9217 55 S 4.3558 7.8282 118.2011 60.5163 63.2103 173.8261 56 Y 4.5598 7.6953 122.7791 56.1678 39.5997 174.7804 57 I 4.6792 7.9881 126.5920 59.7937 41.1941 174.4136 58 H 4.8256 8.2292 124.1062 55.1579 33.5220 171.7413 59 Y 5.1195 8.7615 121.3298 55.9000 41.7873 174.9706 60 A 4.4683 8.3433 123.5361 51.5411 19.3641 178.5661 61 D 4.5224 9.1903 121.1805 57.5575 41.1685 179.5394 62 S 3.9326 8.1067 112.2850 60.3629 63.2620 175.0783 63 V 3.7498 7.8587 112.7886 60.2112 32.8247 175.6453 64 K 3.6571 7.0648 119.2210 58.3886 32.1733 176.9910 65 G 3.9811 9.0170 111.9372 44.9145 0.0000 173.9001 66 R 4.6262 8.1058 116.3224 55.6720 33.3857 175.3550 67 F 5.3813 8.1032 115.9249 55.8875 42.0291 175.6405 68 T 4.6386 8.8950 118.4528 61.8987 71.6032 173.3089 69 I 4.6360 9.3322 127.9245 61.0606 39.2917 174.6513 70 S 4.8203 8.9409 120.1166 57.8872 66.3100 172.8236 71 R 5.1232 8.4117 122.1239 55.5439 33.2399 174.3930 72 D 4.7027 9.2872 124.1739 51.6978 42.1554 175.2934 73 N 4.3220 8.8473 121.7248 55.9361 38.6863 176.2959 74 A 4.1025 8.1277 120.2447 54.3910 18.3892 178.2940 75 E 4.4628 8.0315 114.3345 54.8905 30.5532 175.2161 76 N 4.1205 8.5090 117.4084 54.8375 38.2828 173.3662 77 S 5.0587 7.7571 109.8268 56.2356 67.4585 173.2592 78 L 4.9855 8.6268 124.3625 53.5050 45.5708 174.7738 79 Y 5.4800 9.1050 120.9305 56.2787 42.8833 174.1286 80 L 4.5456 8.4467 123.6822 53.2920 45.2644 174.8579 81 Q 4.6436 8.8354 128.8208 54.9582 30.6037 173.9606 82 M 4.0816 8.7737 127.7850 53.7285 33.4777 175.2930 82A N 5.6994 9.0055 120.7458 49.9415 42.6657 174.2686 82B S 4.0103 8.3788 113.2911 58.4527 60.8154 172.9911 82C L 4.4802 7.7908 119.7242 54.7995 42.5592 177.1366 83 R 4.9166 9.2868 117.0472 53.7484 32.8759 176.0986 84 A 4.0002 8.8328 121.0975 55.7271 18.1580 179.8374 85 E 4.0850 8.1924 112.7265 58.8312 29.5526 177.5051 86 D 4.7781 8.5590 117.8102 55.1777 41.3513 176.6211 87 T 4.3794 8.1041 117.6799 64.0714 68.9476 173.6067 88 A 4.3005 8.7077 127.1225 51.4580 23.8315 174.7824 89 V 4.2767 8.1476 119.9111 62.7649 33.0647 174.3188 90 Y 4.9075 9.1964 126.0280 56.6166 40.1218 174.1004 91 Y 5.4164 9.7656 123.8220 56.3907 40.7648 172.6352 92 C 4.0625 8.8049 118.5123 54.4365 43.1824 172.5688 93 V 4.3192 7.9611 121.4059 60.8758 34.7182 174.0025 94 R 4.4317 8.3868 128.4642 55.4200 31.3687 174.8327 95 E 4.8007 8.7247 127.6370 55.1881 30.6902 176.2040 96 G 4.0686 9.0121 113.9672 45.6959 0.0000 171.9977 97 P 4.5128 0.0000 0.0000 65.3251 31.5524 178.2622 98 R 4.1726 8.3912 115.7801 56.4847 29.6087 175.7021 99 A 4.6577 7.6490 122.0416 50.6772 20.2807 176.7668 100 T 4.6939 8.7081 119.3845 63.0319 73.9463 177.1841 100A G 3.7287 8.6456 112.4598 47.2506 0.0000 173.7422 100B Y 3.9142 9.0104 118.0416 57.1856 38.2281 175.3714 100C S 4.3863 8.1133 116.3616 57.4441 63.9629 173.6128 100D M 3.8969 8.3823 119.5372 55.6172 32.0101 176.6524 100E A 4.3056 8.1514 124.0947 52.1492 19.3185 175.4259 100F D 4.9854 8.6558 119.2160 52.1542 44.8191 175.5104 100G V 3.6471 8.0097 113.1021 60.8352 33.4128 176.2535 100H F 5.3488 8.3800 121.4381 57.1442 37.6455 175.1741 101 D 4.7980 8.7503 123.8391 54.0226 40.8575 176.9797 102 I 4.7273 7.4694 119.8603 59.1721 40.8594 174.2904 103 W 4.9726 9.0210 126.1173 54.5564 31.8407 175.8540 104 G 4.0438 9.0072 111.5883 45.8772 0.0000 173.7514 105 Q 4.3270 8.8248 117.9846 56.9283 29.1387 177.9781 106 G 4.1108 9.4067 103.9195 45.4876 0.0000 172.9565 107 T 4.6194 7.8870 115.6841 61.6047 72.7945 172.7435 108 M 4.6217 8.7028 126.6725 55.2602 33.8292 174.6462 109 V 4.7152 9.2769 126.4380 61.3779 34.7508 174.1876 110 T 4.7739 8.7349 124.2706 61.7498 71.3976 173.3135 111 V 4.5491 8.4782 128.1837 62.3519 32.1315 175.1792 112 S 4.8643 8.9535 121.5256 57.6277 65.8730 175.4563 113 S 4.4037 8.9207 118.5795 59.2703 63.6599 174.3255 114 A 4.2686 7.8792 125.1813 51.5114 18.9443 177.4916 115 S 4.5118 8.3095 115.9296 57.8996 64.2437 173.8909 116 T 4.5579 8.2030 115.9748 62.2071 68.2911 173.5579 117 K 4.6340 9.5918 127.8038 54.8423 35.5430 175.6962 118 G 4.3588 8.8888 114.8765 44.9153 0.0000 171.5227 119 P 4.8754 0.0000 0.0000 62.7347 32.5375 175.4444 120 S 4.4283 8.3564 116.7311 57.0830 64.4251 174.0670 121 V 4.0681 7.9668 124.7016 61.5042 31.9221 174.4645 122 F 5.2628 8.1353 126.7452 55.0040 40.8133 174.4441 123 P 4.5580 0.0000 0.0000 63.0560 32.3587 176.1498 124 L 4.7128 8.5288 121.3182 52.4883 42.8836 175.4768 125 A 4.0280 8.6753 125.6608 51.7523 18.8569 176.6755 126 P 5.3633 0.0000 0.0000 62.3747 29.8318 176.2999 127 S 5.2383 8.2746 123.7985 57.3980 64.7825 175.8888 128 S 4.3409 8.3556 113.2416 59.5996 62.9786 174.6212 129 K 4.3815 7.9341 121.9005 56.9033 32.2275 176.6265 130 S 4.9952 7.4475 113.0086 58.2305 64.2482 174.1638 131 T 4.9960 7.8996 117.2737 60.9567 69.4636 172.9563 132 S 4.8571 8.5279 121.2962 56.9631 64.9858 174.5619 133 G 3.8537 8.6287 118.6932 47.1493 0.0000 174.2459 134 G 4.7342 9.1033 110.3672 45.3233 0.0000 171.8895 126 T 5.2933 8.7661 116.1888 60.8747 67.5318 173.6999 127 A 5.0883 8.2046 131.8985 51.5980 20.0825 179.0888 128 A 4.1909 8.2856 121.3417 53.7996 18.2786 177.8212 129 L 4.4015 7.8041 123.3005 55.8033 41.5275 177.6265 130 G 4.4852 7.4675 106.1086 45.0305 0.0000 174.4638 131 C 5.1960 8.0696 122.2737 57.3567 27.6636 172.8563 132 L 4.7271 8.3779 127.3962 53.7631 43.5858 177.5619 133 V 4.0137 8.3287 129.0932 64.2493 30.6403 175.6459 134 K 5.0942 9.0633 121.9672 56.4233 33.8235 173.5896 146 D 4.4529 8.6932 125.1933 55.7885 38.0121 172.4816 147 Y 5.2429 6.9221 117.0766 55.6010 42.5574 175.9368 148 F 5.1569 9.2687 120.8977 57.1229 43.4417 172.1500 149 P 3.5334 0.0000 0.0000 61.6879 33.9501 175.2428 150 E 4.3022 8.2834 118.8497 55.8934 30.3329 173.7513 151 P 4.8957 0.0000 0.0000 61.1320 33.8779 174.1365 152 V 4.5953 7.9434 116.7770 61.3577 34.3604 174.7712 153 T 4.7008 8.7461 117.1493 59.9226 71.8012 173.2661 154 V 5.1578 8.2034 122.3472 60.0578 35.3620 174.3317 *156 S 5.0023 8.3603 119.6524 58.2910 64.9569 172.1130 157 W 4.8612 8.4633 119.6832 54.4018 32.2102 176.1043 *162 N 4.8668 8.1804 120.3283 54.4951 39.3191 174.5306 163 S 3.8035 9.6210 106.7070 59.8854 61.6477 173.4839 164 G 4.0621 8.3693 108.1383 45.9301 0.0000 174.9122 165 A 3.6781 7.2204 120.4212 56.0958 18.7811 176.8979 166 L 4.1711 7.8945 120.3777 54.9622 42.7899 176.4955 167 T 4.4362 8.4537 114.5351 63.1707 70.6887 175.0539 168 S 3.9247 8.0290 117.2750 59.8137 63.4204 174.6333 169 G 3.6098 8.6332 112.0351 45.8908 0.0000 172.3489 *171 V 4.1458 7.4674 118.0216 62.8216 32.6419 174.4130 172 H 4.6311 9.0591 124.3553 54.4089 31.7789 172.6544 173 T 4.7466 8.3002 121.0014 61.9364 69.3267 175.1980 174 F 4.4521 9.1790 126.3728 56.2001 39.9192 174.2144 175 P 4.3608 0.0000 0.0000 62.7500 31.7986 176.4022 176 A 4.5902 8.5541 123.1028 52.4142 19.4137 177.1255 177 V 4.5509 9.1887 113.5698 59.1778 35.2321 174.9946 178 L 3.9222 8.5549 126.9931 54.9932 42.6041 176.6833 179 Q 4.3278 8.7631 126.1679 55.0237 29.8023 177.4809 180 S 3.9602 8.6419 116.0992 61.6689 62.8963 176.6582 *182 S 4.3093 7.4117 111.6698 57.1214 64.2858 174.6244 183 G 3.6868 7.9725 109.2964 45.4311 0.0000 173.2905 184 L 4.5480 6.9521 119.1525 53.4120 44.5339 175.3380 185 Y 4.8462 8.4288 118.4724 57.2763 40.2016 175.1008 186 S 5.7124 8.7324 116.2136 57.5070 67.9597 173.1160 187 L 5.0033 8.6664 123.8163 54.0996 44.9844 174.4384 188 S 5.8321 9.0617 120.2354 56.7728 66.3497 172.5285 189 S 5.4226 8.9023 115.7386 56.8719 64.7327 173.3057 190 V 5.3768 9.1770 119.5840 59.7956 35.9137 174.8766 191 V 4.7530 7.6207 120.8684 60.3426 34.1004 174.3728 192 T 5.2877 8.0650 114.3429 61.4927 69.7996 174.4759 193 V 4.4731 7.7698 116.3353 58.6155 36.4345 173.1597 194 P 5.1110 0.0000 0.0000 63.8793 31.6282 177.2261 195 S 4.1079 9.0818 121.4989 61.8537 62.5183 176.7002 196 S 4.2058 8.1561 115.5159 61.9217 62.6934 176.6139 197 S 4.8149 8.2658 118.6509 58.8842 62.7503 175.8076 198 L 3.8966 7.3690 123.0618 57.2087 41.3898 178.0492 199 G 4.1785 7.9041 103.8590 45.1401 0.0000 173.0343 200 T 4.2841 8.6120 111.3455 61.5044 70.6036 173.9227 *203 Q 4.5080 7.9714 121.9352 55.8945 29.9051 173.5854 *205 T 4.1467 8.0873 111.9156 61.6662 69.7846 172.5637 206 Y 5.2413 8.4771 122.5743 56.3879 40.4418 175.1104 207 I 5.0049 9.3331 125.2860 59.6479 41.0215 172.4941 208 C 3.9943 8.2256 122.0913 53.9231 37.8778 172.6755 209 N 4.9389 8.9841 121.7124 52.3032 39.1107 173.8950 210 V 4.4907 8.3526 125.0297 61.1376 33.8999 174.1810 211 N 5.2122 8.9960 125.7383 52.2761 42.0735 172.3211 212 H 4.8129 9.0986 127.3968 54.0613 30.9308 174.2633 213 K 3.8832 8.4746 125.2704 58.7390 32.2827 177.9137 214 P 3.8214 0.0000 0.0000 64.8600 31.2386 177.0949 215 S 4.5792 7.7689 109.7891 56.8696 63.4316 173.2565 216 N 4.0726 8.3272 118.2894 55.4434 37.7100 173.9870 217 T 4.6333 8.0438 113.6223 61.7379 71.2816 175.0772 218 K 4.8979 8.6013 124.9292 54.6480 35.2173 175.7350 219 V 4.3858 8.9728 125.0527 60.8730 35.0411 174.2837 220 D 5.4672 8.0479 123.3641 51.2087 40.5594 174.6469 221 K 4.1248 7.8307 122.4161 56.0999 34.3647 176.1617 222 K 4.4295 8.6634 127.1142 55.8201 33.5880 175.8958 *225 V 4.5017 8.3918 124.4072 62.7305 32.1900 174.3990 226 E 4.8520 8.5153 123.8144 53.5904 32.7119 173.5335 227 P 4.4423 0.0000 0.0000 63.3909 31.3872 176.1980 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 E 8.44 4.25 0.00 1.94 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 2.20 2.38 0.00 2 V 8.15 4.16 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 0.69 0.00 0.00 0.99 0.00 0.00 3 Q 10.11 4.69 0.00 2.11 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.52 0.00 0.00 0.00 0.00 0.00 2.24 2.32 0.00 4 L 8.34 5.22 0.00 1.59 1.54 0.88 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 5 L 9.02 4.85 0.00 1.54 1.57 0.91 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 6 E 9.20 5.23 0.00 1.90 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 2.33 2.42 0.00 7 S 8.84 4.51 0.00 3.85 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 8 G 8.43 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 G 7.77 3.69 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 0.00 10 G 8.06 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 11 L 8.14 4.98 0.00 1.58 1.53 1.03 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 12 V 8.01 4.36 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 0.59 0.00 0.00 0.87 0.00 0.00 13 K 8.51 4.99 0.00 1.74 1.78 0.00 1.95 0.00 0.00 1.79 0.00 0.00 2.88 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.55 1.32 7.81 14 P 0.00 4.60 0.00 2.05 2.00 0.00 3.71 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 2.11 0.00 15 G 9.57 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 16 G 7.82 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 S 8.27 5.79 0.00 3.66 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 L 7.97 4.75 0.00 1.49 1.12 0.81 0.54 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 19 R 8.34 4.76 0.00 1.70 1.69 0.00 3.43 0.00 0.00 3.35 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.47 0.00 20 L 8.65 4.49 0.00 0.87 1.34 0.26 0.39 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 21 S 8.86 5.29 0.00 3.80 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 22 C 8.98 5.38 0.00 2.84 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 23 A 9.21 5.21 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 A 8.49 4.82 0.38 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 25 S 9.12 4.35 0.00 3.80 3.87 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 26 G 10.81 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 27 F 7.04 4.77 0.00 3.19 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 28 T 8.43 4.55 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 1.21 0.00 0.00 29 L 8.92 4.09 0.00 1.77 1.73 0.82 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 30 I 7.85 3.77 1.89 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 1.42 0.81 0.98 0.00 0.00 31 N 8.26 4.40 0.00 2.27 2.24 0.00 0.00 6.85 6.77 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 32 Y 7.71 4.77 0.00 3.02 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 33 R 8.49 4.47 0.00 1.97 1.89 0.00 3.45 0.00 0.00 3.47 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.94 0.00 34 M 8.86 5.12 0.00 1.85 1.92 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.70 0.00 35 N 8.81 5.61 0.00 2.21 2.78 0.00 0.00 6.98 7.69 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 36 W 9.22 5.21 0.00 3.24 3.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 V 9.26 5.04 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 1.39 0.00 0.00 0.61 0.00 0.00 38 R 9.26 4.90 0.00 0.90 1.33 0.00 2.59 0.00 0.00 3.03 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.37 0.00 39 Q 9.10 4.86 0.00 2.30 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 7.02 0.00 0.00 0.00 0.00 0.00 2.32 2.61 0.00 40 A 8.69 4.40 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 P 0.00 4.21 0.00 2.10 2.07 0.00 3.74 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.12 0.00 42 G 9.18 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 K 7.82 4.67 0.00 1.85 1.77 0.00 1.75 0.00 0.00 1.74 0.00 0.00 2.83 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.70 1.51 7.81 44 G 8.27 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 45 L 8.27 5.06 0.00 1.68 1.81 0.95 0.83 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 46 E 9.24 4.74 0.00 2.05 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.33 0.00 47 W 9.34 4.59 0.00 3.53 3.29 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 48 V 7.83 3.91 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 1.05 0.00 0.00 49 S 6.59 4.54 0.00 3.89 3.68 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 50 S 8.99 5.37 0.00 4.11 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 51 I 8.79 4.97 1.85 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.41 0.96 0.00 0.00 52 S 8.99 4.61 0.00 3.93 4.15 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 52A S 8.91 4.08 0.00 3.88 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 53 S 8.00 4.29 0.00 4.06 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 54 S 8.12 3.92 0.00 4.08 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 55 S 7.83 4.36 0.00 3.91 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 56 Y 7.70 4.56 0.00 1.43 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 I 7.99 4.68 1.79 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 1.12 0.77 0.60 0.00 0.00 58 H 8.23 4.83 0.00 2.84 3.24 0.00 5.54 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 Y 8.76 5.12 0.00 2.86 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 60 A 8.34 4.47 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 61 D 9.19 4.52 0.00 2.80 2.79 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 62 S 8.11 3.93 0.00 3.89 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 63 V 7.86 3.75 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 0.79 0.00 0.00 64 K 7.06 3.66 0.00 1.91 1.75 0.00 1.71 0.00 0.00 1.73 0.00 0.00 3.07 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.52 1.51 7.81 65 G 9.02 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 66 R 8.11 4.63 0.00 1.80 2.27 0.00 3.30 0.00 0.00 3.15 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.52 0.00 67 F 8.10 5.38 0.00 2.61 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 68 T 8.90 4.64 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 1.27 0.00 0.00 69 I 9.33 4.64 2.02 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.25 0.81 0.00 0.00 70 S 8.94 4.82 0.00 4.02 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 71 R 8.41 5.12 0.00 1.90 1.81 0.00 3.28 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 1.62 1.67 0.00 72 D 9.29 4.70 0.00 2.95 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 N 8.85 4.32 0.00 2.80 2.87 0.00 0.00 6.88 7.93 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 74 A 8.13 4.10 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 75 E 8.03 4.46 0.00 2.00 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 2.27 2.69 0.00 76 N 8.51 4.12 0.00 2.82 2.67 0.00 0.00 6.95 7.18 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 77 S 7.76 5.06 0.00 3.75 3.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 L 8.63 4.99 0.00 1.56 1.27 1.09 0.28 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 79 Y 9.10 5.48 0.00 3.03 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 80 L 8.45 4.55 0.00 0.27 0.13 0.85 0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 81 Q 8.84 4.64 0.00 2.06 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.59 6.56 0.00 0.00 0.00 0.00 0.00 2.30 2.19 0.00 82 M 8.77 4.08 0.00 1.26 1.45 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.81 0.00 82A N 9.01 5.70 0.00 2.55 2.63 0.00 0.00 7.19 7.76 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 82B S 8.38 4.01 0.00 3.95 3.87 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 82C L 7.79 4.48 0.00 1.72 1.61 0.80 0.75 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 83 R 9.29 4.92 0.00 2.20 2.01 0.00 2.82 0.00 0.00 3.19 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.69 0.00 84 A 8.83 4.00 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 85 E 8.19 4.09 0.00 1.98 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 2.43 0.00 86 D 8.56 4.78 0.00 2.91 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 87 T 8.10 4.38 4.39 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 1.31 0.00 0.00 88 A 8.71 4.30 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 89 V 8.15 4.28 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 0.34 0.00 0.00 0.87 0.00 0.00 90 Y 9.20 4.91 0.00 2.94 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 91 Y 9.77 5.42 0.00 3.06 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 92 C 8.80 4.06 0.00 1.92 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 V 7.96 4.32 1.04 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 -0.55 0.00 0.00 -0.21 0.00 0.00 94 R 8.39 4.43 0.00 1.65 1.50 0.00 2.21 0.00 0.00 2.25 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 1.29 0.00 95 E 8.72 4.80 0.00 2.29 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 2.36 2.37 0.00 96 G 9.01 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 97 P 0.00 4.51 0.00 2.23 2.42 0.00 3.83 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.05 0.00 98 R 8.39 4.17 0.00 1.97 1.98 0.00 3.10 0.00 0.00 3.21 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.57 0.00 99 A 7.65 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 0.00 100 T 8.71 4.69 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 1.20 0.00 0.00 100A G 8.65 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 100B Y 9.01 3.91 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 100C S 8.11 4.39 0.00 3.89 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 100D M 8.38 3.90 0.00 1.97 2.02 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 2.57 2.46 0.00 100E A 8.15 4.31 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 100F D 8.66 4.99 0.00 2.60 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100G V 8.01 3.65 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 0.58 0.00 0.00 0.91 0.00 0.00 100H F 8.38 5.35 0.00 3.05 2.41 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 0.00 101 D 8.75 4.80 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 0.00 102 I 7.47 4.73 1.60 0.00 0.00 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 1.04 0.49 0.86 0.00 0.00 103 W 9.02 4.97 0.00 2.99 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 G 9.01 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 0.00 105 Q 8.82 4.33 0.00 2.11 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.41 0.00 0.00 0.00 0.00 0.00 2.41 2.48 0.00 106 G 9.41 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 0.00 0.00 0.00 107 T 7.89 4.62 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 108 M 8.70 4.62 0.00 2.10 1.89 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.52 0.00 109 V 9.28 4.72 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 0.69 0.00 0.00 110 T 8.73 4.77 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 1.18 0.00 0.00 111 V 8.48 4.55 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.00 0.00 0.99 0.00 0.00 112 S 8.95 4.86 0.00 4.19 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 0.00 113 S 8.92 4.40 0.00 4.02 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 0.00 114 A 7.88 4.27 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 0.00 115 S 8.31 4.51 0.00 4.04 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 0.00 116 T 8.20 4.56 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 117 K 9.59 4.63 0.00 1.87 1.72 0.00 1.72 0.00 0.00 1.83 0.00 0.00 2.85 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.40 1.44 7.81 118 G 8.89 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 0.00 119 P 0.00 4.88 0.00 1.97 1.93 0.00 3.70 0.00 0.00 3.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.71 0.00 120 S 8.36 4.43 0.00 3.23 3.16 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 0.00 121 V 7.97 4.07 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 0.69 0.00 0.00 0.77 0.00 0.00 122 F 8.14 5.26 0.00 3.03 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 0.00 123 P 0.00 4.56 0.00 2.18 2.16 0.00 3.95 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 2.08 2.10 0.00 124 L 8.53 4.71 0.00 1.80 1.73 1.03 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 125 A 8.68 4.03 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 P 0.00 5.36 0.00 2.15 2.23 0.00 4.05 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 1.89 0.00 127 S 8.27 5.24 0.00 4.07 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 S 8.36 4.34 0.00 4.01 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 0.00 129 K 7.93 4.38 0.00 1.82 1.81 0.00 1.58 0.00 0.00 1.65 0.00 0.00 2.88 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.41 1.41 7.81 130 S 7.45 5.00 0.00 3.85 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 T 7.90 5.00 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 1.21 0.00 0.00 132 S 8.53 4.86 0.00 3.80 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 0.00 133 G 8.63 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 0.00 134 G 9.10 4.73 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 0.00 126 T 8.77 5.29 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 1.21 0.00 0.00 127 A 8.20 5.09 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 A 8.29 4.19 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 L 7.80 4.40 0.00 1.60 1.68 0.92 1.18 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 0.00 130 G 7.47 4.49 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 0.00 131 C 8.07 5.20 0.00 2.80 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 0.00 132 L 8.38 4.73 0.00 1.53 1.49 0.92 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 133 V 8.33 4.01 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 0.67 0.00 0.00 0.93 0.00 0.00 134 K 9.06 5.09 0.00 1.56 1.63 0.00 0.61 0.00 0.00 1.83 0.00 0.00 2.13 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.40 1.16 7.81 146 D 8.69 4.45 0.00 2.97 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 0.00 147 Y 6.92 5.24 0.00 2.87 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 F 9.27 5.16 0.00 3.19 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 0.00 149 P 0.00 3.53 0.00 1.62 0.92 0.00 3.74 0.00 0.00 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.71 0.00 150 E 8.28 4.30 0.00 1.75 1.77 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 1.55 1.47 0.00 151 P 0.00 4.90 0.00 2.12 2.02 0.00 3.64 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.88 0.00 152 V 7.94 4.60 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.62 0.00 0.00 0.20 0.00 0.00 153 T 8.75 4.70 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 0.00 154 V 8.20 5.16 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 0.99 0.00 0.00 0.85 0.00 0.00 *156 S 8.36 5.00 0.00 3.97 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 0.00 157 W 8.46 4.86 0.00 3.49 3.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *162 N 8.18 4.87 0.00 3.00 2.94 0.00 0.00 7.25 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 0.00 163 S 9.62 3.80 0.00 4.01 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 0.00 164 G 8.37 4.06 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 0.00 165 A 7.22 3.68 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 0.00 166 L 7.89 4.17 0.00 1.76 1.82 0.96 0.85 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 0.00 167 T 8.45 4.44 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 1.33 0.00 0.00 168 S 8.03 3.92 0.00 3.85 3.83 0.00 0.00 0.00 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0.00 0.00 0.00 0.78 0.00 0.00 1.01 0.00 0.00 178 L 8.55 3.92 0.00 1.53 1.52 0.28 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 179 Q 8.76 4.33 0.00 2.09 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.57 6.55 0.00 0.00 0.00 0.00 0.00 2.35 2.29 0.00 180 S 8.64 3.96 0.00 3.84 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *182 S 7.41 4.31 0.00 3.94 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 0.00 183 G 7.97 3.69 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 0.00 184 L 6.95 4.55 0.00 1.65 1.54 0.92 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 185 Y 8.43 4.85 0.00 1.75 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 186 S 8.73 5.71 0.00 3.79 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 0.00 187 L 8.67 5.00 0.00 1.87 1.76 1.01 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 188 S 9.06 5.83 0.00 4.07 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 0.00 189 S 8.90 5.42 0.00 4.02 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 0.00 190 V 9.18 5.38 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 1.12 0.00 0.00 191 V 7.62 4.75 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 -0.63 0.00 0.00 0.52 0.00 0.00 192 T 8.06 5.29 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 0.00 193 V 7.77 4.47 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 0.11 0.00 0.00 0.68 0.00 0.00 194 P 0.00 5.11 0.00 2.10 2.03 0.00 3.65 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 2.15 2.15 0.00 195 S 9.08 4.11 0.00 3.86 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 0.00 196 S 8.16 4.21 0.00 4.03 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 0.00 197 S 8.27 4.81 0.00 4.16 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 0.00 198 L 7.37 3.90 0.00 1.73 1.88 0.95 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 199 G 7.90 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 200 T 8.61 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 1.21 0.00 0.00 *203 Q 7.97 4.51 0.00 1.99 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.07 6.71 0.00 0.00 0.00 0.00 0.00 2.09 2.13 0.00 *205 T 8.09 4.15 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 1.16 0.00 0.00 206 Y 8.48 5.24 0.00 2.98 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 0.00 207 I 9.33 5.00 1.93 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.68 0.98 0.00 0.00 208 C 8.23 3.99 0.00 1.46 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 209 N 8.98 4.94 0.00 2.58 2.72 0.00 0.00 6.21 8.27 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 0.00 210 V 8.35 4.49 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 0.75 0.00 0.00 0.73 0.00 0.00 211 N 9.00 5.21 0.00 2.75 2.53 0.00 0.00 6.32 7.59 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 0.00 212 H 9.10 4.81 0.00 3.00 3.06 0.00 5.66 0.00 0.00 0.00 0.00 6.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 213 K 8.47 3.88 0.00 1.76 1.77 0.00 1.69 0.00 0.00 1.77 0.00 0.00 2.89 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.47 1.40 7.81 214 P 0.00 3.82 0.00 1.83 2.02 0.00 3.14 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.96 0.00 215 S 7.77 4.58 0.00 4.01 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 0.00 216 N 8.33 4.07 0.00 2.72 2.83 0.00 0.00 6.96 6.47 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 0.00 217 T 8.04 4.63 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 1.16 0.00 0.00 218 K 8.60 4.90 0.00 1.54 1.64 0.00 1.65 0.00 0.00 1.59 0.00 0.00 3.00 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.46 1.36 7.81 219 V 8.97 4.39 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 0.91 0.00 0.00 0.86 0.00 0.00 220 D 8.05 5.47 0.00 2.48 2.49 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 0.00 221 K 7.83 4.12 0.00 1.83 1.62 0.00 1.65 0.00 0.00 1.90 0.00 0.00 2.98 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.54 1.55 7.81 222 K 8.66 4.43 0.00 1.89 2.00 0.00 1.64 0.00 0.00 1.78 0.00 0.00 2.79 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.59 1.41 7.81 *225 V 8.39 4.50 2.47 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 1.30 0.00 0.00 1.21 0.00 0.00 226 E 8.52 4.85 0.00 2.10 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 0.00 2.43 2.37 0.00 227 P 0.00 4.44 0.00 2.09 2.08 0.00 3.76 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.21 0.00 * Residues marked with a * may have inaccurate shift predictions.