NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 Q 4.2160 8.4445 119.1127 54.0761 28.6875 174.7575 4 L 3.9028 8.4218 123.7255 53.3560 41.2530 173.7363 5 T 4.0553 8.8656 120.0125 60.5094 68.9481 174.1362 6 E 3.8532 8.9832 126.8976 59.9581 28.8569 178.9249 7 E 3.9602 8.2554 120.2949 58.8705 29.3867 178.1988 8 Q 3.9877 7.8995 116.0239 57.3783 29.1412 176.8535 9 I 3.9166 8.5548 120.5065 64.1251 38.1332 177.3222 10 A 4.0155 8.0245 120.9343 55.6738 17.8285 179.4750 11 E 4.0787 8.0205 116.5159 59.6478 29.6901 179.1167 12 F 4.8069 8.8563 116.9206 59.1585 38.9783 177.3155 13 K 4.4522 7.9989 118.1249 58.7013 32.6924 178.2808 14 E 4.2608 8.5874 117.2518 58.5505 29.2253 178.2465 15 A 4.6949 7.8933 120.3896 53.5893 20.0825 178.3506 16 F 3.6679 8.0988 119.1364 61.6795 39.3636 177.6802 17 S 4.0605 9.0634 114.8960 61.4480 62.5807 176.1733 18 L 4.0676 7.3816 121.4595 57.1914 41.7024 177.4697 19 F 4.4904 7.4095 114.4831 57.3035 39.5585 175.8877 20 D 4.4079 8.0656 124.3759 51.8132 39.4234 176.2294 21 K 3.7244 8.1477 124.7608 59.0967 33.1802 177.6146 22 D 4.5397 8.5602 118.3016 58.8941 38.8319 178.6259 23 G 3.8329 7.4325 101.1596 47.7242 0.0000 175.6709 24 D 4.3028 8.3199 120.1876 53.2700 39.4670 175.7231 25 G 4.0738 7.1364 107.9298 45.0594 0.0000 172.7772 26 T 5.3778 8.1873 109.8573 59.7053 72.6034 173.0229 27 I 4.8337 8.6769 115.0151 59.1106 41.2649 175.3873 28 T 4.5974 9.9156 115.6300 61.5775 69.7210 175.6269 29 T 3.8074 8.3752 117.6086 66.6951 68.3954 176.6852 30 K 3.7954 8.0560 119.6849 59.7757 32.1310 178.6634 31 E 3.8505 7.9629 118.3542 59.5462 29.4216 179.0729 32 L 3.8865 8.0278 120.4202 58.2416 42.0100 179.2921 33 G 3.5581 7.9046 105.3558 48.2274 0.0000 175.8695 34 T 3.7397 7.7024 118.4297 66.0780 68.1880 177.0074 35 V 2.8120 7.6644 119.6498 66.2661 31.6859 177.6185 36 M 4.0566 7.9063 118.5658 57.8869 31.8487 178.4833 37 R 4.7273 8.4084 119.4345 59.0875 30.2291 179.1863 38 S 4.1962 7.5148 112.3953 61.3157 62.9340 175.8111 39 L 4.3362 7.9393 120.0126 54.0363 42.7706 175.8631 40 G 3.5750 8.7243 108.7232 44.0626 0.0000 172.6715 41 Q 4.5437 7.3883 121.6593 56.7887 32.7766 173.6635 42 N 5.1194 8.4067 114.7114 50.8558 38.1323 172.2522 43 P 4.2615 0.0000 0.0000 63.6420 32.2780 177.2983 44 T 3.9400 8.1667 109.9671 61.9778 68.9484 174.9497 45 E 4.0273 8.8421 121.1422 57.9866 29.3584 177.5129 46 A 4.5608 8.4303 121.4245 52.5362 21.4850 177.9927 47 E 4.0823 9.5948 116.2516 58.1026 29.9034 178.0914 48 L 4.1778 7.8350 118.9596 57.2075 42.5219 177.5534 49 Q 4.4143 7.6829 116.0922 57.1474 29.0020 177.4003 50 D 4.3471 7.4656 118.9370 57.6315 41.0824 178.2837 51 M 4.2160 7.9328 118.6267 58.3529 31.9915 178.5726 52 I 3.8458 7.6581 118.3205 64.0412 38.1908 177.0956 53 N 4.3714 8.8155 117.1903 55.6835 38.8330 175.5136 54 E 4.2330 7.6577 117.5481 57.3500 30.8382 176.2039 55 V 4.5575 7.6506 111.1642 61.3164 32.0686 178.1361 56 D 4.6948 7.7411 120.8594 53.9847 38.9584 176.9545 57 A 4.7458 7.8879 121.0365 51.5079 20.7228 175.4845 58 D 5.1550 7.7211 119.8955 53.8467 44.1155 177.7502 59 G 3.7598 8.6857 107.2347 46.8439 0.0000 172.4677 60 N 4.4468 8.2361 119.7756 50.7800 35.2470 172.3924 61 G 3.3885 7.3247 112.2708 44.8066 0.0000 170.6117 62 T 5.4460 7.6592 109.6878 59.2131 71.9390 172.9816 63 I 4.7859 8.2187 116.6466 59.3977 41.1572 175.2386 64 D 5.1244 8.4283 124.6246 52.8070 41.7211 175.3001 65 F 3.1138 8.9054 115.5222 60.2954 39.2440 175.8710 66 P 4.5683 0.0000 0.0000 65.2747 31.3808 177.3010 67 E 4.3226 9.2995 117.3563 57.6467 30.4430 178.1486 68 F 4.3752 8.6507 121.2834 60.5735 39.3939 177.1849 69 L 4.0249 8.0162 118.4537 58.5790 42.0546 177.9547 70 T 4.1161 7.8618 115.6215 65.4077 67.0006 177.0412 71 M 3.7074 8.0496 120.3367 58.1620 33.9438 177.0651 72 M 4.5609 7.4664 120.2973 54.1209 28.2431 174.3110 73 A 4.6641 7.6064 124.2773 52.8235 25.5372 179.2274 74 R 4.3593 7.4354 113.6611 58.4331 30.4877 177.7601 75 K 4.3310 7.9235 116.4173 56.5780 33.5982 176.0016 76 M 4.5212 9.2210 116.9668 55.5820 33.7776 176.8489 77 K 4.1144 8.0346 116.4309 57.6734 31.6185 175.2730 78 D 4.6812 7.3367 113.6244 55.6238 43.6904 175.2899 79 T 3.9288 7.7058 113.5478 63.3310 67.4784 174.1771 80 D 4.8195 8.3903 126.8533 53.3785 42.9338 177.5383 81 S 4.5034 8.0089 116.7818 60.9631 62.7795 174.9428 82 E 3.9348 8.3603 122.3361 60.0389 29.4248 177.7671 83 E 3.9654 7.9095 119.2522 58.8149 29.6104 178.2952 84 E 3.9499 8.1328 117.5694 60.0385 29.8786 179.7325 85 I 4.0413 7.7423 118.7348 64.4770 37.1824 178.1477 86 R 4.3855 8.6343 119.4331 58.5288 29.6659 178.3542 87 E 4.0426 8.5573 118.2493 59.1770 29.8772 178.1382 88 A 4.3451 8.3052 120.4323 55.5991 18.3652 178.7776 89 F 3.7472 8.5814 118.2142 61.9865 39.2478 177.4882 90 R 3.9852 8.0862 116.0353 59.1383 29.9276 179.0994 91 V 3.6548 7.8378 117.8387 66.0432 31.7265 177.7640 92 F 4.0512 8.0872 115.6379 59.8631 40.2321 176.4885 93 D 4.5123 7.3486 117.3056 53.7979 36.7917 175.5728 94 K 4.0076 7.8037 123.6217 59.6242 32.9385 178.7442 95 D 4.3853 7.9337 116.9675 56.1973 39.3424 177.3592 96 G 4.2364 7.8845 108.3461 45.6279 0.0000 173.5609 97 N 4.7050 8.7291 115.5974 51.7332 37.5830 176.3399 98 G 4.0923 8.4358 105.5695 46.4668 0.0000 173.2454 99 Y 5.0477 7.7651 116.1041 56.1115 42.0237 175.4096 100 I 4.4795 9.6375 125.1317 59.7609 38.7559 175.3380 101 S 4.7040 10.3014 123.8232 57.4104 64.4530 175.5152 102 A 4.1869 8.8284 123.0504 55.2818 18.0311 179.7269 103 A 3.9422 8.0746 119.2188 55.6805 18.4894 179.5836 104 E 4.0010 8.0159 114.1668 59.0010 29.6972 178.7231 105 L 4.0759 8.3763 122.0092 58.2937 42.0644 179.0090 106 R 3.8786 7.9366 117.8836 59.9132 29.9478 177.7561 107 H 4.1142 8.0889 116.6285 59.0681 29.7896 176.2050 108 V 3.8722 7.7820 118.9909 64.7460 32.0245 177.6324 109 M 4.1877 8.2355 118.5655 57.8546 31.5216 178.0901 110 T 4.7763 7.7460 109.9496 62.7327 69.8493 176.2437 111 N 4.5744 7.8310 119.8048 55.4234 38.4344 176.3322 112 L 4.1728 7.5649 117.6830 54.9757 41.3745 177.8006 113 G 3.8537 8.0848 107.0517 45.1358 0.0000 173.3809 114 E 4.3063 7.9215 121.3322 54.2726 30.0744 175.2300 115 K 4.3230 8.6042 126.8902 55.9806 31.8116 176.2626 116 L 4.6571 8.1541 124.0071 52.9113 43.8895 176.3913 117 T 4.1458 8.2517 116.9454 61.3594 67.6439 174.9512 118 D 4.4548 8.8397 128.6371 56.6682 41.1943 177.4500 119 E 4.3518 8.4958 118.5522 59.3441 30.2113 177.5829 120 E 4.2992 7.7995 116.2961 57.4167 29.4933 179.0240 121 V 3.6926 7.5532 119.1443 65.9277 31.8176 177.1418 122 D 4.4535 8.2232 116.8923 58.2076 40.8509 178.0397 123 Q 3.9851 7.8904 118.8735 59.5237 28.9036 177.7129 124 M 3.8722 8.5560 118.2464 58.9685 31.7897 179.3656 125 I 3.6094 8.0218 119.1968 64.5382 37.5464 178.0505 126 R 3.8080 8.0872 119.9077 59.3525 29.8943 178.0488 127 E 4.0641 8.1543 118.0189 58.3029 29.6853 177.8772 128 A 4.3692 7.2999 119.2517 53.2334 19.5768 177.1921 129 D 4.6642 7.5410 117.3972 54.3308 41.7653 175.8777 130 I 4.2539 10.0236 127.9906 61.8027 38.4696 176.2043 131 D 4.7396 8.3927 117.2649 52.6570 39.4233 177.2798 132 G 4.0381 8.4509 109.3654 46.0576 0.0000 174.7239 133 D 4.3342 8.0281 116.3438 53.8608 38.9612 177.6694 134 G 4.0471 8.8433 107.7095 46.1490 0.0000 173.1235 135 Q 4.8007 7.7446 114.9511 54.3578 32.1295 174.7874 136 V 4.9912 8.7261 111.8649 58.7345 34.9151 175.0089 137 N 5.2589 8.7646 120.8482 50.9656 40.5496 174.7198 138 Y 3.4336 7.9799 119.3128 61.4765 38.3706 177.4633 139 E 3.5680 8.2658 117.6953 60.3662 29.6385 179.1815 140 E 4.0226 9.4043 118.0000 59.1347 29.8963 179.1140 141 F 4.4817 8.4734 122.7742 61.1965 38.9278 177.2078 142 V 3.2595 8.1286 118.3875 66.1525 31.1972 177.4614 143 Q 3.8780 7.7503 117.4077 59.0016 28.3024 178.4453 144 M 3.7824 7.9060 119.1967 58.7355 32.5672 177.9094 145 M 3.8626 7.7999 116.7206 56.8998 32.0201 176.9467 146 T 3.7542 5.7900 107.8129 64.6854 69.5361 174.1111 147 A 3.8235 7.4586 128.3772 51.5531 18.0631 177.2512 148 K 4.1009 8.4436 121.4784 57.4495 32.3038 176.6584 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 3 Q 8.44 4.22 0.00 2.09 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.76 0.00 0.00 0.00 0.00 0.00 2.18 1.93 0.00 4 L 8.42 3.90 0.00 1.73 1.55 0.92 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 5 T 8.87 4.06 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 1.25 0.00 0.00 6 E 8.98 3.85 0.00 2.19 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 2.35 2.38 0.00 7 E 8.26 3.96 0.00 2.03 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.40 0.00 8 Q 7.90 3.99 0.00 1.95 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.54 0.00 0.00 0.00 0.00 0.00 1.82 2.06 0.00 9 I 8.55 3.92 1.97 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.82 0.90 0.00 0.00 10 A 8.02 4.02 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 11 E 8.02 4.08 0.00 2.27 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 0.00 2.41 2.66 0.00 12 F 8.86 4.81 0.00 3.18 3.49 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 13 K 8.00 4.45 0.00 1.97 2.00 0.00 1.80 0.00 0.00 1.92 0.00 0.00 3.06 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.54 1.74 7.81 14 E 8.59 4.26 0.00 2.18 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 2.43 2.56 0.00 15 A 7.89 4.69 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 16 F 8.10 3.67 0.00 3.29 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 17 S 9.06 4.06 0.00 4.16 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 18 L 7.38 4.07 0.00 1.87 1.96 0.90 0.50 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 19 F 7.41 4.49 0.00 2.82 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 D 8.07 4.41 0.00 2.35 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 K 8.15 3.72 0.00 1.70 1.80 0.00 1.82 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.41 1.51 7.81 22 D 8.56 4.54 0.00 2.84 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 23 G 7.43 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 D 8.32 4.30 0.00 2.76 2.59 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 25 G 7.14 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 26 T 8.19 5.38 4.29 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 1.18 0.00 0.00 27 I 8.68 4.83 1.61 0.00 0.00 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.59 -0.10 0.00 0.00 28 T 9.92 4.60 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 29 T 8.38 3.81 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 1.20 0.00 0.00 30 K 8.06 3.80 0.00 1.80 1.86 0.00 1.56 0.00 0.00 1.79 0.00 0.00 3.00 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.52 1.60 7.81 31 E 7.96 3.85 0.00 2.09 1.84 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 2.39 2.28 0.00 32 L 8.03 3.89 0.00 1.79 1.87 1.03 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 33 G 7.90 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 T 7.70 3.74 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 35 V 7.66 2.81 1.86 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 0.53 0.00 0.00 0.55 0.00 0.00 36 M 7.91 4.06 0.00 2.03 2.15 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.78 0.00 37 R 8.41 4.73 0.00 1.75 1.95 0.00 3.07 0.00 0.00 3.27 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.74 0.00 38 S 7.51 4.20 0.00 3.96 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 39 L 7.94 4.34 0.00 1.75 1.64 0.63 1.03 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 40 G 8.72 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 Q 7.39 4.54 0.00 2.03 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.88 6.86 0.00 0.00 0.00 0.00 0.00 2.17 2.13 0.00 42 N 8.41 5.12 0.00 2.75 2.74 0.00 0.00 6.04 7.75 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 43 P 0.00 4.26 0.00 2.18 2.11 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 1.97 1.97 0.00 44 T 8.17 3.94 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 1.28 0.00 0.00 45 E 8.84 4.03 0.00 1.97 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 2.30 2.31 0.00 46 A 8.43 4.56 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 47 E 9.59 4.08 0.00 2.01 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 2.30 2.24 0.00 48 L 7.84 4.18 0.00 1.76 1.67 0.92 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 49 Q 7.68 4.41 0.00 2.19 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.58 0.00 0.00 0.00 0.00 0.00 2.31 2.42 0.00 50 D 7.47 4.35 0.00 2.74 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 51 M 7.93 4.22 0.00 2.08 2.14 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.60 0.00 52 I 7.66 3.85 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 1.54 1.64 1.05 0.00 0.00 53 N 8.82 4.37 0.00 2.73 2.87 0.00 0.00 7.24 7.53 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 54 E 7.66 4.23 0.00 2.33 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.39 0.00 55 V 7.65 4.56 2.31 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 0.82 0.00 0.00 1.02 0.00 0.00 56 D 7.74 4.69 0.00 2.75 2.63 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 57 A 7.89 4.75 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 D 7.72 5.15 0.00 2.71 2.59 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 59 G 8.69 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 0.00 0.00 0.00 60 N 8.24 4.45 0.00 2.84 2.89 0.00 0.00 6.96 8.24 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 61 G 7.32 3.39 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 0.00 62 T 7.66 5.45 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 63 I 8.22 4.79 2.00 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 1.48 1.44 0.98 0.00 0.00 64 D 8.43 5.12 0.00 2.85 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 F 8.91 3.11 0.00 2.87 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 66 P 0.00 4.57 0.00 2.17 2.17 0.00 4.20 0.00 0.00 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.14 0.00 67 E 9.30 4.32 0.00 2.06 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.70 0.00 68 F 8.65 4.38 0.00 3.07 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 69 L 8.02 4.02 0.00 1.70 1.69 0.95 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 70 T 7.86 4.12 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 1.20 0.00 0.00 71 M 8.05 3.71 0.00 2.09 2.05 0.00 0.00 0.00 0.00 0.00 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.59 0.00 72 M 7.47 4.56 0.00 2.34 2.05 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.83 0.00 73 A 7.61 4.66 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 74 R 7.44 4.36 0.00 1.78 2.01 0.00 3.30 0.00 0.00 3.14 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.77 0.00 75 K 7.92 4.33 0.00 1.69 1.80 0.00 1.72 0.00 0.00 1.62 0.00 0.00 2.99 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.33 1.39 7.81 76 M 9.22 4.52 0.00 2.10 2.05 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.44 0.00 77 K 8.03 4.11 0.00 1.72 1.79 0.00 1.64 0.00 0.00 1.61 0.00 0.00 3.02 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.41 1.48 7.81 78 D 7.34 4.68 0.00 2.66 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 T 7.71 3.93 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 1.26 0.00 0.00 80 D 8.39 4.82 0.00 2.70 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 S 8.01 4.50 0.00 4.13 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 82 E 8.36 3.93 0.00 2.02 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 2.40 2.51 0.00 83 E 7.91 3.97 0.00 2.30 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 2.32 2.42 0.00 84 E 8.13 3.95 0.00 2.27 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.54 0.00 85 I 7.74 4.04 2.12 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 1.40 1.13 0.87 0.00 0.00 86 R 8.63 4.39 0.00 1.66 2.13 0.00 2.94 0.00 0.00 2.93 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.33 0.00 87 E 8.56 4.04 0.00 2.11 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 2.39 2.64 0.00 88 A 8.31 4.35 1.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 F 8.58 3.75 0.00 3.80 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 R 8.09 3.99 0.00 2.04 2.07 0.00 3.25 0.00 0.00 3.20 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.97 0.00 91 V 7.84 3.65 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 0.37 0.00 0.00 0.89 0.00 0.00 92 F 8.09 4.05 0.00 2.60 2.93 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 93 D 7.35 4.51 0.00 1.87 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 K 7.80 4.01 0.00 1.96 1.87 0.00 1.76 0.00 0.00 1.66 0.00 0.00 3.01 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.62 1.38 7.81 95 D 7.93 4.39 0.00 2.74 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 96 G 7.88 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 97 N 8.73 4.71 0.00 3.07 3.17 0.00 0.00 6.92 7.44 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 98 G 8.44 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 Y 7.77 5.05 0.00 2.81 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 0.00 100 I 9.64 4.48 1.73 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.04 0.76 0.00 0.00 101 S 10.30 4.70 0.00 3.77 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 0.00 102 A 8.83 4.19 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 A 8.07 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 0.00 104 E 8.02 4.00 0.00 2.40 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 0.00 2.39 2.33 0.00 105 L 8.38 4.08 0.00 1.75 1.95 0.95 0.87 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 0.00 106 R 7.94 3.88 0.00 2.23 1.94 0.00 3.19 0.00 0.00 3.23 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.67 0.00 107 H 8.09 4.11 0.00 3.13 3.49 0.00 5.99 0.00 0.00 0.00 0.00 6.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 V 7.78 3.87 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 0.33 0.00 0.00 0.65 0.00 0.00 109 M 8.24 4.19 0.00 2.14 2.37 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 3.02 0.00 110 T 7.75 4.78 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 1.34 0.00 0.00 111 N 7.83 4.57 0.00 2.65 2.83 0.00 0.00 6.85 6.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 L 7.56 4.17 0.00 1.64 1.68 0.90 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 113 G 8.08 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 0.00 114 E 7.92 4.31 0.00 2.09 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.33 0.00 115 K 8.60 4.32 0.00 1.80 1.78 0.00 1.80 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.45 1.41 7.81 116 L 8.15 4.66 0.00 1.64 1.59 0.97 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 117 T 8.25 4.15 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 1.29 0.00 0.00 118 D 8.84 4.45 0.00 2.71 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 0.00 119 E 8.50 4.35 0.00 1.97 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.48 0.00 120 E 7.80 4.30 0.00 1.99 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 2.33 2.32 0.00 121 V 7.55 3.69 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.96 0.00 0.00 122 D 8.22 4.45 0.00 2.84 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 0.00 123 Q 7.89 3.99 0.00 2.24 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.69 0.00 0.00 0.00 0.00 0.00 2.36 2.56 0.00 124 M 8.56 3.87 0.00 2.06 2.05 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.87 2.63 0.00 125 I 8.02 3.61 2.03 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 1.12 0.95 0.00 0.00 126 R 8.09 3.81 0.00 2.25 1.94 0.00 3.11 0.00 0.00 3.10 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.64 0.00 127 E 8.15 4.06 0.00 2.03 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.33 0.00 128 A 7.30 4.37 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 0.00 129 D 7.54 4.66 0.00 2.84 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 0.00 130 I 10.02 4.25 1.88 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 1.36 0.90 0.91 0.00 0.00 131 D 8.39 4.74 0.00 2.79 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 0.00 132 G 8.45 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 0.00 133 D 8.03 4.33 0.00 2.76 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 0.00 134 G 8.84 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 0.00 135 Q 7.74 4.80 0.00 2.18 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.05 6.54 0.00 0.00 0.00 0.00 0.00 2.42 2.50 0.00 136 V 8.73 4.99 2.23 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 0.92 0.00 0.00 1.03 0.00 0.00 137 N 8.76 5.26 0.00 2.52 2.76 0.00 0.00 5.83 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 0.00 138 Y 7.98 3.43 0.00 2.02 2.63 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 0.00 139 E 8.27 3.57 0.00 2.33 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 2.39 2.40 0.00 140 E 9.40 4.02 0.00 2.33 2.23 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 2.53 2.52 0.00 141 F 8.47 4.48 0.00 3.24 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 V 8.13 3.26 1.82 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 0.80 0.00 0.00 -0.21 0.00 0.00 143 Q 7.75 3.88 0.00 2.19 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.41 0.00 0.00 0.00 0.00 0.00 2.45 2.47 0.00 144 M 7.91 3.78 0.00 2.10 2.14 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.71 0.00 145 M 7.80 3.86 0.00 1.82 1.49 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.35 0.00 146 T 5.79 3.75 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 0.00 147 A 7.46 3.82 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 0.00 148 K 8.44 4.10 0.00 1.81 1.67 0.00 1.80 0.00 0.00 1.73 0.00 0.00 3.05 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.38 1.41 7.81