NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 4.0282 8.2127 109.7491 45.5121 0.0000 173.3897 2 F 4.0030 8.9627 119.8560 61.0245 39.1643 176.7201 3 K 3.9237 8.3290 117.9132 59.5330 32.3521 178.4992 4 Q 4.0012 8.1031 119.3284 59.2857 28.8802 177.8139 5 D 4.5510 8.3826 120.0366 57.4334 40.8479 178.7931 6 I 3.7382 7.8625 120.1465 64.3536 37.0701 178.3356 7 A 4.0140 7.7872 121.1816 55.3044 17.9690 179.6791 8 T 3.7977 8.0759 113.6134 66.8977 68.7421 176.5143 9 I 3.4196 7.8404 121.5980 64.5194 36.9442 178.7634 10 R 4.0889 8.2304 117.8732 59.2355 29.9013 178.9036 11 G 3.9123 8.1416 104.9200 46.9077 0.0000 173.3539 12 D 4.8528 8.1275 118.7144 51.7188 41.5776 175.4766 13 L 4.1076 7.9863 125.5994 58.3795 42.6461 177.5914 14 R 3.7542 7.9455 117.9687 59.8142 29.9620 178.4315 15 T 3.7020 7.6463 114.6633 66.8684 68.4643 176.2107 16 Y 3.8970 7.7652 118.3229 60.7778 37.7787 178.4731 17 A 2.0000 7.9485 121.9863 54.6971 18.3350 179.7625 18 Q 3.6744 7.7021 116.3946 59.0280 28.7322 178.7641 19 D 4.2275 7.8892 119.9019 57.4377 40.7722 179.0129 20 I 3.1577 7.2735 120.4965 63.8494 36.9637 178.1675 21 F 4.2125 7.8296 121.6305 61.4273 39.0928 177.2358 22 L 3.7881 8.2327 118.5435 57.5850 41.3451 179.3231 23 A 3.9715 8.1123 120.9029 54.9128 18.2887 179.3970 24 F 4.3597 8.5282 119.4955 61.7636 39.6151 177.5070 25 L 3.5921 7.7568 118.4775 57.5436 41.0363 179.3608 26 N 4.2779 8.0694 116.3138 56.0172 38.5507 177.0998 27 K 3.9327 7.9542 120.3054 58.0882 33.7452 176.6210 28 Y 4.7606 7.6472 116.1690 54.4277 38.3805 173.9844 29 P 4.7705 0.0000 0.0000 65.3446 31.6835 178.1999 30 D 4.4982 8.1058 117.5933 56.5739 40.7128 177.8260 31 E 4.3773 8.5084 119.4074 58.5736 29.3813 178.8154 32 R 4.3764 8.0818 119.2807 58.9928 29.8644 178.3112 33 R 4.1308 7.6800 114.7864 59.0759 29.3022 177.6523 34 Y 4.2948 7.5931 115.3235 58.2833 39.3407 175.8212 35 F 4.7532 8.3586 120.1187 54.7154 39.5754 175.5940 36 K 3.9793 8.0493 123.7843 59.4072 32.9368 179.3192 37 N 4.7211 7.9742 114.6271 54.4256 39.0364 174.8807 38 Y 4.8321 8.0171 116.0940 57.8739 38.8869 175.8316 39 V 3.8355 7.3707 120.1273 63.9798 31.9623 175.7465 40 G 3.9599 8.9564 114.1081 46.1351 0.0000 172.9051 41 K 4.8778 8.0162 117.1704 52.6666 34.9247 176.9959 42 S 4.3280 8.6247 117.9590 58.0535 65.1245 175.1115 43 D 4.0968 8.4050 121.8300 57.6972 40.2868 179.2057 44 Q 3.9584 7.8043 117.0434 58.7161 28.9310 177.9773 45 E 4.0427 8.1120 119.7522 59.3467 29.4873 179.2813 46 L 3.5836 7.7335 119.0358 57.6148 41.3092 179.6749 47 K 4.2231 7.5676 116.7027 58.3282 32.0646 178.5228 48 S 4.5562 7.6110 113.0330 58.0144 63.8900 173.5625 49 M 4.4466 7.6193 124.0081 53.7622 33.1641 176.4367 50 A 4.0661 8.8913 126.4115 55.5372 18.5114 179.4768 51 K 4.0594 8.1053 115.9716 58.8944 32.2887 179.2462 52 F 4.5168 7.7297 122.5281 60.8282 39.3316 177.3868 53 G 3.4925 8.1556 104.7574 47.7114 0.0000 175.1814 54 D 4.3566 8.1136 121.2467 57.7105 40.8889 178.7120 55 H 4.3624 8.7508 117.3576 58.8841 28.7050 178.1149 56 T 3.6854 7.6253 111.4643 64.6281 68.5341 176.3040 57 E 3.8872 8.1780 122.3715 58.9444 29.6919 179.0018 58 K 4.1170 8.2515 118.5408 58.9598 31.9744 179.1361 59 W 4.2375 8.6350 129.0460 60.8426 30.6713 178.2313 60 F 3.8613 8.4581 117.5425 59.9817 38.1850 177.2562 61 N 4.3399 8.9324 117.4908 56.7439 38.7072 176.6307 62 L 4.0133 8.1294 121.6593 58.2769 42.0916 178.3510 63 M 4.2294 8.5719 118.5771 59.3204 32.0705 178.2393 64 M 4.2200 8.5511 118.8522 58.3047 32.1136 178.6488 65 E 4.0037 8.4530 119.0808 59.3478 29.5171 179.5422 66 V 3.8453 8.3220 118.3739 65.9794 31.4342 177.9133 67 A 3.6862 8.2985 119.8146 55.2439 18.2636 178.8984 68 D 4.3834 8.2271 115.6332 57.1939 41.3718 177.9188 69 R 4.1052 7.9240 117.6712 57.2446 30.4598 176.5266 70 A 4.3682 7.0237 121.1900 52.5400 19.2090 176.5463 71 T 4.4465 8.3521 116.8463 63.1070 70.6483 175.0096 72 D 4.2260 9.5898 127.1802 55.7246 38.5631 173.8747 73 C 3.3589 7.5586 111.0512 60.2138 26.1436 173.0595 74 V 4.2347 7.7645 121.6015 60.3989 31.5159 173.8120 75 P 4.8533 0.0000 0.0000 61.8291 32.5086 176.6208 76 L 4.0897 8.3408 119.4777 54.7067 43.1550 178.3855 77 A 3.9970 8.6515 125.1707 55.2723 18.3863 180.1102 78 S 4.0445 8.0307 112.3482 61.7324 63.1293 176.4711 79 D 4.3222 7.9547 121.7446 56.9924 40.7176 178.2247 80 A 3.8968 7.9178 121.3471 55.1545 18.2912 179.1577 81 N 4.1776 8.3979 115.7125 57.0559 38.8893 176.9220 82 T 3.8450 7.9410 117.1164 66.9656 68.3821 176.4465 83 L 4.0366 7.5162 118.7376 57.7302 41.6582 179.5026 84 V 3.6640 7.6182 117.4491 65.8191 31.6235 177.5019 85 Q 4.2539 8.0231 115.1219 55.8123 29.2608 176.2696 86 M 4.0594 7.3640 122.0703 55.0560 32.7720 177.4374 87 K 3.9000 8.7984 122.9588 60.1124 32.7545 178.8999 88 Q 4.0791 7.9710 116.6208 57.9766 28.9237 176.3998 89 H 4.8979 8.2461 115.1894 55.3336 29.1801 176.3900 90 S 4.1871 7.9510 116.5912 60.8944 62.7976 175.3238 91 S 4.5312 7.8471 114.5989 58.6287 63.3299 174.1492 92 L 4.4757 7.6546 120.3078 53.5810 42.4016 175.5378 93 T 4.8038 8.1982 109.3689 59.1051 72.1040 174.9624 94 T 4.0730 8.4892 111.7745 64.7589 68.4652 176.4992 95 G 3.6629 7.7611 108.5404 47.8549 0.0000 175.3949 96 N 4.4139 8.2911 118.6965 56.2511 38.5307 177.5573 97 F 4.0075 8.3627 118.7552 60.2928 39.0409 177.3718 98 E 4.1496 8.6507 118.5673 59.5251 29.3299 179.5820 99 K 3.7420 8.1194 118.3095 59.2300 31.9732 178.9283 100 L 3.4174 7.7308 120.5382 58.3294 41.7853 179.2324 101 F 4.1122 8.4147 117.4510 60.1786 38.8047 177.8469 102 V 3.7576 8.3828 118.1212 66.2291 31.2872 178.0384 103 A 4.1642 8.5424 120.4418 55.0240 18.2134 179.3861 104 L 3.8517 8.2686 119.1346 58.2826 42.1354 179.4494 105 V 3.6947 8.2533 118.4479 65.9031 31.5078 177.4686 106 E 3.9697 8.5078 119.2439 59.5292 29.4546 178.1745 107 Y 3.9856 8.4003 119.7127 61.0476 38.6519 177.9818 108 M 3.8725 8.0290 118.3315 58.5245 32.1023 178.7687 109 R 4.1193 8.1160 117.0105 58.9461 30.3009 178.4796 110 A 4.1765 7.7952 119.6585 53.0668 18.9562 178.0899 111 S 4.1543 7.0242 111.6415 58.0881 64.0116 174.5327 112 G 3.7822 8.2317 110.5261 45.5672 0.0000 174.6996 113 Q 4.0144 8.0279 120.9820 55.3434 29.2556 176.0796 114 S 4.4531 7.9425 123.1906 56.9840 61.8393 173.4846 115 F 5.1398 7.7877 124.6562 56.7116 41.0096 176.3332 116 D 4.8223 9.8461 124.5965 52.8298 39.7934 176.5984 117 S 4.4134 8.5435 118.2945 61.5741 62.8465 175.1403 118 Q 4.1392 8.3111 119.9652 59.2534 28.4358 179.0296 119 S 4.0708 8.3014 115.7473 61.3205 62.7608 176.7733 120 W 4.4812 8.4159 121.3363 59.5700 28.8760 177.8887 121 D 4.4939 8.6072 118.2517 57.4977 40.6602 178.3721 122 R 3.8250 8.0825 119.1291 59.2667 30.0454 178.0313 123 F 4.4323 8.0174 122.3805 60.5968 39.2312 177.1507 124 G 2.4629 8.0670 105.2444 47.3646 0.0000 175.6746 125 K 3.8563 7.9074 121.1519 59.2469 32.1247 179.3022 126 N 4.2384 8.2188 117.0286 56.0264 38.3714 177.3454 127 L 3.6568 7.7598 122.2983 57.7965 42.0470 179.0753 128 V 3.4157 7.7057 118.5134 66.0314 31.4545 178.0472 129 S 4.0134 7.9293 114.5590 61.7334 62.7103 176.7306 130 A 3.9510 7.9143 123.2097 54.8865 18.0143 179.7011 131 L 3.7202 8.1752 118.0723 57.8598 41.6622 179.6068 132 S 4.2826 7.9537 114.3969 61.1009 62.1304 176.4930 133 S 4.1602 7.9208 116.2408 61.0171 62.5557 175.5159 134 A 4.4062 7.4582 121.2797 51.8791 18.4224 177.5279 135 G 3.8627 7.8542 106.4967 46.1081 0.0000 174.0157 136 M 4.0733 8.1344 120.3215 54.7016 32.6428 176.3130 137 K 4.1627 8.5798 124.6163 56.7942 32.2544 176.8140 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 G 8.21 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 0.00 0.00 0.00 2 F 8.96 4.00 0.00 2.97 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 3 K 8.33 3.92 0.00 1.84 1.86 0.00 1.78 0.00 0.00 1.77 0.00 0.00 2.98 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.63 1.49 7.81 4 Q 8.10 4.00 0.00 2.17 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.90 0.00 0.00 0.00 0.00 0.00 2.41 2.49 0.00 5 D 8.38 4.55 0.00 3.39 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 6 I 7.86 3.74 1.97 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.50 0.91 0.00 0.00 7 A 7.79 4.01 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 T 8.08 3.80 4.32 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 1.02 0.00 0.00 9 I 7.84 3.42 1.76 0.00 0.00 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 1.18 0.80 0.00 0.00 10 R 8.23 4.09 0.00 1.85 2.03 0.00 3.20 0.00 0.00 3.25 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.79 0.00 11 G 8.14 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 D 8.13 4.85 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 13 L 7.99 4.11 0.00 1.97 1.67 0.98 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 14 R 7.95 3.75 0.00 1.91 1.86 0.00 3.22 0.00 0.00 3.22 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.72 0.00 15 T 7.65 3.70 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 0.97 0.00 0.00 16 Y 7.77 3.90 0.00 2.87 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 A 7.95 2.00 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 Q 7.70 3.67 0.00 2.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.75 0.00 0.00 0.00 0.00 0.00 1.96 2.30 0.00 19 D 7.89 4.23 0.00 2.67 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 20 I 7.27 3.16 1.15 0.00 0.00 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 -0.23 0.79 0.00 0.00 21 F 7.83 4.21 0.00 2.77 3.01 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 22 L 8.23 3.79 0.00 1.74 1.65 0.94 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 23 A 8.11 3.97 1.44 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 24 F 8.53 4.36 0.00 3.08 3.31 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 25 L 7.76 3.59 0.00 1.43 1.48 0.60 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 26 N 8.07 4.28 0.00 2.74 2.80 0.00 0.00 6.97 8.29 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 27 K 7.95 3.93 0.00 1.66 1.53 0.00 1.90 0.00 0.00 1.69 0.00 0.00 3.08 0.00 0.00 2.84 0.00 0.00 0.00 0.00 0.30 1.05 7.81 28 Y 7.65 4.76 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 29 P 0.00 4.77 0.00 2.23 2.27 0.00 3.90 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 1.88 0.00 30 D 8.11 4.50 0.00 2.83 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 31 E 8.51 4.38 0.00 1.77 2.15 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 2.42 2.20 0.00 32 R 8.08 4.38 0.00 1.97 2.00 0.00 3.17 0.00 0.00 3.46 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.88 0.00 33 R 7.68 4.13 0.00 1.83 1.96 0.00 2.93 0.00 0.00 3.24 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.94 0.00 34 Y 7.59 4.29 0.00 2.70 2.50 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 35 F 8.36 4.75 0.00 3.35 2.45 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.05 3.98 0.00 1.93 2.06 0.00 1.49 0.00 0.00 1.80 0.00 0.00 2.91 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.46 7.81 37 N 7.97 4.72 0.00 2.71 3.02 0.00 0.00 6.85 7.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 Y 8.02 4.83 0.00 3.23 2.97 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 39 V 7.37 3.84 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.00 0.00 1.03 0.00 0.00 40 G 8.96 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 41 K 8.02 4.88 0.00 1.84 1.62 0.00 2.01 0.00 0.00 0.61 0.00 0.00 3.13 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.31 1.35 7.81 42 S 8.62 4.33 0.00 3.98 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 43 D 8.41 4.10 0.00 2.65 2.65 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 0.00 44 Q 7.80 3.96 0.00 1.96 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 7.05 0.00 0.00 0.00 0.00 0.00 2.31 2.35 0.00 45 E 8.11 4.04 0.00 2.19 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 0.00 2.29 2.30 0.00 46 L 7.73 3.58 0.00 0.91 0.13 0.42 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 47 K 7.57 4.22 0.00 1.82 1.87 0.00 1.80 0.00 0.00 1.75 0.00 0.00 3.26 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.59 1.52 7.81 48 S 7.61 4.56 0.00 4.03 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 49 M 7.62 4.45 0.00 2.21 2.24 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 2.72 2.50 0.00 50 A 8.89 4.07 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 K 8.11 4.06 0.00 1.88 1.68 0.00 1.71 0.00 0.00 1.74 0.00 0.00 2.98 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.55 1.53 7.81 52 F 7.73 4.52 0.00 2.98 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 53 G 8.16 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 0.00 0.00 0.00 54 D 8.11 4.36 0.00 2.91 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 55 H 8.75 4.36 0.00 3.36 3.47 0.00 5.81 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 T 7.63 3.69 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 0.12 0.00 0.00 57 E 8.18 3.89 0.00 2.07 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.33 0.00 58 K 8.25 4.12 0.00 1.97 1.89 0.00 1.74 0.00 0.00 1.59 0.00 0.00 2.92 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.49 1.60 7.81 59 W 8.63 4.24 0.00 3.33 3.32 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 60 F 8.46 3.86 0.00 2.97 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 61 N 8.93 4.34 0.00 2.84 3.05 0.00 0.00 6.71 6.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 L 8.13 4.01 0.00 1.89 1.91 0.98 0.71 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 63 M 8.57 4.23 0.00 2.30 2.13 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 3.04 3.03 0.00 64 M 8.55 4.22 0.00 2.12 2.28 0.00 0.00 0.00 0.00 0.00 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 3.01 0.00 65 E 8.45 4.00 0.00 2.19 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 2.60 2.51 0.00 66 V 8.32 3.85 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 1.26 0.00 0.00 1.11 0.00 0.00 67 A 8.30 3.69 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 D 8.23 4.38 0.00 2.89 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 69 R 7.92 4.11 0.00 2.17 1.99 0.00 3.34 0.00 0.00 3.26 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.67 0.00 70 A 7.02 4.37 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 71 T 8.35 4.45 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 1.19 0.00 0.00 72 D 9.59 4.23 0.00 2.67 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 73 C 7.56 3.36 0.00 2.88 2.74 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 74 V 7.76 4.23 2.15 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 0.96 0.00 0.00 0.93 0.00 0.00 75 P 0.00 4.85 0.00 2.22 2.12 0.00 3.74 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.72 0.00 76 L 8.34 4.09 0.00 1.87 1.64 0.94 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 77 A 8.65 4.00 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 78 S 8.03 4.04 0.00 4.05 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 79 D 7.95 4.32 0.00 2.94 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 80 A 7.92 3.90 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 81 N 8.40 4.18 0.00 2.89 2.95 0.00 0.00 7.23 7.85 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 82 T 7.94 3.84 4.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 83 L 7.52 4.04 0.00 1.68 1.69 0.93 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 84 V 7.62 3.66 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 0.79 0.00 0.00 0.81 0.00 0.00 85 Q 8.02 4.25 0.00 2.03 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.56 0.00 0.00 0.00 0.00 0.00 2.59 2.51 0.00 86 M 7.36 4.06 0.00 2.01 1.79 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.90 2.40 0.00 87 K 8.80 3.90 0.00 1.91 2.05 0.00 1.49 0.00 0.00 1.80 0.00 0.00 2.88 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.45 1.44 7.81 88 Q 7.97 4.08 0.00 1.86 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.51 7.24 0.00 0.00 0.00 0.00 0.00 2.32 2.39 0.00 89 H 8.25 4.90 0.00 3.30 3.25 0.00 5.64 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 90 S 7.95 4.19 0.00 4.00 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 91 S 7.85 4.53 0.00 3.97 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 0.00 92 L 7.65 4.48 0.00 1.77 1.66 0.52 0.01 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 93 T 8.20 4.80 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 94 T 8.49 4.07 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 1.12 0.00 0.00 95 G 7.76 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 N 8.29 4.41 0.00 2.77 2.67 0.00 0.00 6.99 8.25 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 97 F 8.36 4.01 0.00 3.19 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 E 8.65 4.15 0.00 2.23 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 2.39 2.60 0.00 99 K 8.12 3.74 0.00 1.94 1.07 0.00 1.48 0.00 0.00 0.82 0.00 0.00 2.86 0.00 0.00 2.98 0.00 0.00 0.00 0.00 0.68 1.43 7.81 100 L 7.73 3.42 0.00 0.92 1.52 0.38 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 101 F 8.41 4.11 0.00 3.36 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 0.00 102 V 8.38 3.76 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 1.25 0.00 0.00 1.15 0.00 0.00 103 A 8.54 4.16 1.68 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 0.00 0.00 104 L 8.27 3.85 0.00 1.69 1.88 0.76 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 105 V 8.25 3.69 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 1.28 0.00 0.00 106 E 8.51 3.97 0.00 2.24 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 2.36 2.37 0.00 107 Y 8.40 3.99 0.00 3.15 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 M 8.03 3.87 0.00 1.95 2.20 0.00 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 1.23 0.00 109 R 8.12 4.12 0.00 1.82 2.04 0.00 3.23 0.00 0.00 3.29 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.94 0.00 110 A 7.80 4.18 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 0.00 111 S 7.02 4.15 0.00 3.96 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 G 8.23 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 Q 8.03 4.01 0.00 2.03 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 7.37 0.00 0.00 0.00 0.00 0.00 1.95 1.29 0.00 114 S 7.94 4.45 0.00 3.97 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 0.00 115 F 7.79 5.14 0.00 3.12 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 0.00 116 D 9.85 4.82 0.00 2.83 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 0.00 117 S 8.54 4.41 0.00 4.10 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 0.00 118 Q 8.31 4.14 0.00 2.21 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.69 0.00 0.00 0.00 0.00 0.00 2.52 2.54 0.00 119 S 8.30 4.07 0.00 4.10 3.53 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 0.00 120 W 8.42 4.48 0.00 3.78 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 D 8.61 4.49 0.00 3.02 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 R 8.08 3.83 0.00 2.02 1.94 0.00 3.10 0.00 0.00 3.05 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.58 0.00 123 F 8.02 4.43 0.00 2.62 3.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 G 8.07 2.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 K 7.91 3.86 0.00 1.91 1.80 0.00 1.66 0.00 0.00 1.63 0.00 0.00 2.98 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.44 1.62 7.81 126 N 8.22 4.24 0.00 2.73 2.72 0.00 0.00 6.72 6.49 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 0.00 127 L 7.76 3.66 0.00 0.93 1.16 0.73 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 128 V 7.71 3.42 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.97 0.00 0.00 129 S 7.93 4.01 0.00 3.98 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 0.00 130 A 7.91 3.95 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 0.00 131 L 8.18 3.72 0.00 1.55 1.40 -0.01 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 132 S 7.95 4.28 0.00 3.82 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 0.00 133 S 7.92 4.16 0.00 3.96 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 0.00 134 A 7.46 4.41 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 0.00 135 G 7.85 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 136 M 8.13 4.07 0.00 1.99 1.81 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.46 0.00 137 K 8.58 4.16 0.00 1.79 1.71 0.00 1.99 0.00 0.00 1.73 0.00 0.00 2.99 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.43 1.37 7.81