NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 T 4.2031 8.1744 110.9375 61.4747 69.9985 173.0264 2 D 4.4811 8.5086 123.1359 52.0875 42.8001 173.6317 3 L 5.0347 8.4823 127.8250 54.0470 42.7892 177.9714 4 S 4.2002 8.1074 117.7579 61.4387 62.6913 176.4466 5 A 4.0400 7.9656 124.0862 55.0095 18.1488 179.3729 6 Q 4.0188 8.1150 116.1229 59.0668 28.8816 178.7217 7 K 3.8459 8.3685 119.5516 59.7478 31.9934 179.2482 8 R 3.9119 7.7051 118.5267 59.3826 29.9908 178.6168 9 L 4.0018 8.0814 118.6047 57.7643 41.6647 179.2961 10 A 4.0996 9.0455 121.3937 55.1231 18.2523 179.5117 11 A 3.9940 8.1183 119.3352 55.2879 18.5648 179.4625 12 D 4.2653 7.9957 116.6531 57.3705 41.1480 178.8182 13 V 3.6664 7.9903 118.9534 64.8306 31.5393 177.7921 14 L 4.1462 8.3695 117.3300 53.9746 42.9153 175.9698 15 D 4.3312 7.6981 117.6191 54.6877 39.6522 171.8686 16 V 4.5068 8.2052 118.1208 61.0136 35.7906 174.1120 17 G 3.7725 8.4401 112.1128 44.9920 0.0000 174.8331 18 K 3.8939 8.8805 122.8025 59.6503 32.1843 178.6641 19 N 4.4839 8.0919 113.8704 55.1080 38.8286 175.7047 20 R 4.3807 8.3600 117.1729 56.8587 31.2258 176.7040 21 V 4.3406 7.3176 111.9869 60.9162 32.3305 175.5311 22 W 4.7380 9.6959 135.0000 55.5379 33.5162 174.0316 23 F 5.2276 7.8674 125.0397 55.1778 40.6862 174.6040 24 N 3.1400 8.0277 123.4018 53.0988 38.9700 173.8046 25 P 4.1118 0.0000 0.0000 65.6522 31.5663 177.2045 26 E 4.2742 8.7572 115.7706 57.4602 29.7556 177.1462 27 R 4.6284 7.9428 118.9505 55.4763 31.4025 177.7978 28 Q 3.9507 8.4885 119.3711 59.2098 28.5150 178.5934 29 G 3.6538 8.0800 105.9291 48.1671 0.0000 175.2271 30 D 4.3165 7.8227 119.5629 57.1412 41.3343 178.5414 31 I 3.6178 7.9365 120.2878 63.8808 36.6928 178.3323 32 A 3.9268 8.2110 121.9451 55.2734 18.3400 179.1308 33 D 4.5577 7.6954 115.2187 55.1315 40.9395 176.5595 34 A 3.9991 7.2752 122.8621 52.6797 18.4214 176.6682 35 I 4.2595 8.6624 123.5566 62.4071 39.6546 176.8480 36 T 4.5839 8.5242 110.2965 59.9192 72.1813 175.7685 37 R 3.9547 8.3294 120.1485 59.1671 30.1253 178.9623 38 E 3.9190 8.1034 118.7718 59.4770 29.8937 178.3150 39 D 4.3718 8.1833 118.8985 57.3345 40.8120 179.1579 40 V 3.5234 7.6375 118.4092 66.2209 31.6616 178.1078 41 R 3.9386 8.0618 117.7857 59.3407 29.8455 178.6807 42 E 3.9039 8.0998 118.5077 59.4617 29.7604 178.9591 43 L 4.1380 7.7821 118.4358 57.4716 41.5439 179.8851 44 V 3.8814 7.7415 119.7899 65.7310 31.3396 177.7343 45 D 4.4487 7.9457 117.1104 57.4262 40.8074 178.2192 46 E 4.2267 8.5007 116.6326 56.6520 29.4472 177.9646 47 G 3.9777 8.4686 107.2521 45.7854 0.0000 174.7195 48 A 4.2862 8.2704 123.1545 53.7892 19.3216 177.8171 49 I 5.1371 7.9077 116.3549 59.9415 40.4649 175.1033 50 Q 4.7869 9.7284 124.7850 54.1729 33.9047 173.7818 51 A 5.1163 8.4217 121.1512 50.0029 20.5733 176.6657 52 K 4.0488 9.0528 122.6071 57.1820 32.9681 177.0675 53 D 4.6342 8.4649 122.4267 53.4470 41.8474 176.5994 54 K 4.2036 8.2815 122.0322 55.9879 33.6703 176.8533 55 K 4.2441 8.3964 122.8757 56.3354 32.9935 176.2348 56 G 4.1466 8.1068 110.0161 43.6615 0.0000 172.6029 57 N 4.4060 8.7372 122.4594 53.3910 39.1935 174.9237 58 S 4.3573 8.5296 118.9369 58.7081 63.7402 174.8053 59 R 4.6446 8.5069 122.6395 56.0138 30.4302 178.4375 60 G 3.6823 7.9727 107.2878 48.3885 0.0000 176.4182 61 R 4.0032 7.9942 120.3820 58.2483 30.0505 179.0582 62 A 4.0125 7.8125 120.5112 55.1607 18.5044 179.6844 63 R 3.9158 8.3018 116.9225 59.3040 30.0950 179.0971 64 E 3.9429 8.0564 117.9656 59.4317 29.4382 179.3772 65 R 3.8816 7.8049 118.1283 59.5805 30.0729 178.3218 66 Q 4.0095 8.4939 118.2199 59.1194 28.6584 179.1989 67 K 3.9730 8.1219 119.1773 59.4489 32.1853 179.2035 68 K 3.9493 8.0762 118.5474 60.1328 32.0900 179.5740 69 R 4.8661 8.6309 119.1534 58.6171 29.7807 178.8769 70 A 4.1209 8.1209 120.0208 54.6820 18.5012 178.2626 71 Y 4.3493 8.0497 116.4662 58.3060 39.0928 176.0072 72 G 3.8577 7.8308 106.9887 46.0670 0.0000 173.1219 73 H 4.8097 8.7090 117.8434 54.6268 30.8091 174.2851 74 Q 3.5012 8.6324 115.9639 57.0385 25.6246 174.7624 75 K 4.5962 7.8136 111.6241 55.8179 33.8793 177.2824 76 G 3.8735 8.1519 108.2168 44.5130 0.0000 175.0357 77 A 3.9980 8.6534 121.2688 55.1677 18.2437 179.5694 78 G 3.8722 8.0531 101.9551 46.9813 0.0000 173.9739 79 S 4.6549 8.1888 114.8683 58.0948 64.3176 174.2853 80 R 4.4617 7.4664 119.0674 54.9700 31.0347 175.9653 81 K 4.3448 8.6670 121.6319 57.1242 34.3995 176.6084 82 G 3.9848 7.7263 105.7538 43.6612 0.0000 173.0603 83 K 4.0771 8.2672 120.3710 55.7843 33.2301 177.6206 84 A 4.0981 8.8034 125.3988 55.3646 18.1151 180.1926 85 G 3.7251 8.0696 101.1562 46.0098 0.0000 174.7931 86 A 4.3371 7.8126 122.6568 54.7144 19.3205 179.4747 87 R 4.1847 7.8849 115.0842 57.6800 30.5269 177.0028 88 Q 4.2444 7.9153 120.0608 53.2743 31.8577 173.0578 89 N 4.6654 8.8241 124.4285 53.2830 39.5872 174.9606 90 S 4.2146 8.7641 124.8242 61.6626 62.9820 176.3584 91 K 4.0273 8.0155 122.5424 59.1205 32.0645 178.2902 92 E 4.7985 8.8085 121.3610 59.0275 29.6124 178.1995 93 D 4.3604 8.7529 118.4218 57.2142 41.1414 178.1200 94 W 4.2191 8.4408 128.8953 60.3720 30.7008 177.8891 95 E 3.5913 8.1778 118.5520 59.2769 28.8692 178.9090 96 S 3.9563 7.9493 113.1033 61.4953 62.3871 176.2835 97 R 3.8126 7.9025 120.3458 59.4645 29.9712 179.0750 98 I 3.3034 7.2674 118.0784 63.4297 37.6451 178.1963 99 R 3.8051 7.6358 119.1467 58.8020 29.8687 178.4292 100 A 3.9243 7.8873 120.5466 55.5409 18.4702 179.6143 101 Q 3.9181 8.1424 116.2964 59.3289 28.7871 179.6637 102 R 4.0676 7.9280 118.9754 59.3070 29.8773 179.1924 103 T 3.9135 8.1175 115.3976 66.4705 68.7425 176.0302 104 K 3.9486 8.1770 121.4908 59.9732 32.1246 178.5680 105 L 4.1501 8.0748 118.7495 58.0078 41.5153 179.6973 106 R 3.9564 8.2811 118.6046 59.1621 29.9507 178.5860 107 E 4.0188 8.1762 118.5248 59.4805 29.7648 179.0362 108 L 4.2227 8.0476 118.3205 57.7334 41.4490 179.6267 109 R 4.0469 7.7852 118.4055 59.3445 29.8266 178.2130 110 D 4.2611 7.4165 116.2004 57.2837 40.9498 177.9917 111 E 4.0041 8.3566 119.2273 57.9507 29.5508 177.5755 112 G 4.0509 7.9335 106.1491 45.5940 0.0000 174.6030 113 T 3.9876 7.8167 115.1776 65.8388 68.6034 174.0899 114 L 4.8485 7.6416 119.9080 52.5625 44.9891 176.5387 115 S 4.4871 8.4527 117.3232 57.6327 64.0858 175.1686 116 S 4.3437 8.6439 114.4641 60.0388 62.5279 175.0499 117 S 4.6058 7.8605 117.5331 60.1540 63.4229 175.8464 118 Q 4.0807 7.7319 119.7654 58.7494 28.5303 177.3933 119 Y 4.1693 8.4088 121.0361 60.9007 38.7132 178.0352 120 R 3.7243 8.2484 118.7608 59.6830 29.8554 177.4155 121 D 4.3836 7.8362 117.4716 57.6002 41.2477 178.4945 122 L 4.1956 8.4356 119.6755 57.8601 41.6888 178.5936 123 Y 3.9456 8.5093 120.0227 60.9938 38.7648 178.1135 124 D 4.4228 8.4813 119.7840 57.4580 40.9239 179.0493 125 K 3.8824 7.9257 118.4587 58.8682 31.9197 179.4500 126 A 3.9177 7.8774 121.4022 55.1472 18.1896 179.9964 127 G 4.0266 7.7357 102.6739 47.2649 0.0000 175.0924 128 G 3.8872 7.6130 105.3179 44.0540 0.0000 173.7756 129 G 3.9589 8.4162 108.7662 46.6995 0.0000 175.3612 130 E 3.7482 8.1230 121.7755 57.3070 29.8431 177.2708 131 F 5.0215 7.1842 117.8171 55.3408 40.9930 175.8463 132 D 4.4124 9.1518 126.5306 57.2854 41.2581 175.9666 133 S 4.5526 7.4037 108.9895 56.3604 66.1732 174.8918 134 V 3.4957 8.5104 118.1659 66.3701 31.2050 177.7860 135 A 4.1620 8.0329 120.0682 55.4884 18.1780 178.9474 136 D 4.3639 7.8991 116.3971 56.9107 41.1574 178.3906 137 L 3.2863 7.6111 120.7744 57.8611 42.1486 178.4471 138 E 3.8878 8.5253 118.8234 59.5844 29.2179 179.4362 139 R 3.9205 7.6270 116.3997 59.6509 30.2839 178.0494 140 Y 4.2093 7.5879 116.9623 60.7428 38.8430 177.7293 141 I 3.8113 7.8148 119.7971 64.3007 38.2832 178.4631 142 D 4.5552 7.9849 118.6460 55.3788 38.0130 176.3712 143 A 3.9242 7.6433 126.1286 52.7096 18.8161 177.1515 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 T 8.17 4.20 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 2 D 8.51 4.48 0.00 2.66 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 3 L 8.48 5.03 0.00 1.89 1.85 0.93 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 4 S 8.11 4.20 0.00 4.02 4.14 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 5 A 7.97 4.04 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 6 Q 8.11 4.02 0.00 2.46 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.78 0.00 0.00 0.00 0.00 0.00 2.48 2.49 0.00 7 K 8.37 3.85 0.00 2.00 1.80 0.00 1.27 0.00 0.00 0.61 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.50 1.46 7.81 8 R 7.71 3.91 0.00 1.87 2.14 0.00 3.10 0.00 0.00 3.18 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.68 0.00 9 L 8.08 4.00 0.00 1.94 1.73 0.94 0.76 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 10 A 9.05 4.10 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 11 A 8.12 3.99 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.00 4.27 0.00 2.70 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 V 7.99 3.67 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 0.94 0.00 0.00 0.95 0.00 0.00 14 L 8.37 4.15 0.00 1.69 1.79 1.00 1.13 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 15 D 7.70 4.33 0.00 2.82 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 16 V 8.21 4.51 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 0.80 0.00 0.00 1.01 0.00 0.00 17 G 8.44 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 18 K 8.88 3.89 0.00 1.80 1.85 0.00 1.66 0.00 0.00 1.80 0.00 0.00 2.88 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.53 1.48 7.81 19 N 8.09 4.48 0.00 2.70 2.86 0.00 0.00 6.84 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 20 R 8.36 4.38 0.00 1.98 1.97 0.00 3.12 0.00 0.00 3.17 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.58 0.00 21 V 7.32 4.34 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 0.63 0.00 0.00 0.51 0.00 0.00 22 W 9.70 4.74 0.00 3.30 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 23 F 7.87 5.23 0.00 2.61 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 24 N 8.03 3.14 0.00 2.64 2.52 0.00 0.00 6.75 8.52 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 25 P 0.00 4.11 0.00 2.09 2.11 0.00 3.78 0.00 0.00 3.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.06 0.00 26 E 8.76 4.27 0.00 2.05 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 0.00 2.35 2.31 0.00 27 R 7.94 4.63 0.00 1.69 1.77 0.00 3.14 0.00 0.00 3.14 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.52 0.00 28 Q 8.49 3.95 0.00 2.04 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.85 0.00 0.00 0.00 0.00 0.00 2.40 2.58 0.00 29 G 8.08 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 0.00 0.00 0.00 0.00 30 D 7.82 4.32 0.00 2.70 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 31 I 7.94 3.62 1.64 0.00 0.00 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.91 0.05 0.00 0.00 32 A 8.21 3.93 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 33 D 7.70 4.56 0.00 2.70 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 34 A 7.28 4.00 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 35 I 8.66 4.26 1.86 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 1.72 0.96 0.90 0.00 0.00 36 T 8.52 4.58 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 1.24 0.00 0.00 37 R 8.33 3.95 0.00 1.88 2.03 0.00 3.14 0.00 0.00 3.27 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.70 0.00 38 E 8.10 3.92 0.00 2.07 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 0.00 2.37 2.46 0.00 39 D 8.18 4.37 0.00 2.87 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 40 V 7.64 3.52 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 1.08 0.00 0.00 1.00 0.00 0.00 41 R 8.06 3.94 0.00 2.02 2.00 0.00 3.19 0.00 0.00 3.10 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.93 0.00 42 E 8.10 3.90 0.00 2.18 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.35 0.00 43 L 7.78 4.14 0.00 1.85 1.64 0.79 0.54 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 44 V 7.74 3.88 2.29 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 1.27 0.00 0.00 1.02 0.00 0.00 45 D 7.95 4.45 0.00 2.84 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 46 E 8.50 4.23 0.00 2.05 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.45 0.00 47 G 8.47 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 48 A 8.27 4.29 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 49 I 7.91 5.14 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 1.23 1.12 1.23 0.00 0.00 50 Q 9.73 4.79 0.00 2.18 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.74 0.00 0.00 0.00 0.00 0.00 2.40 2.73 0.00 51 A 8.42 5.12 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 52 K 9.05 4.05 0.00 1.81 1.76 0.00 1.53 0.00 0.00 1.76 0.00 0.00 3.02 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.44 1.39 7.81 53 D 8.46 4.63 0.00 2.64 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 54 K 8.28 4.20 0.00 1.86 1.80 0.00 1.57 0.00 0.00 1.63 0.00 0.00 2.94 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.39 1.42 7.81 55 K 8.40 4.24 0.00 1.73 1.75 0.00 1.75 0.00 0.00 1.70 0.00 0.00 3.17 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.41 1.43 7.81 56 G 8.11 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 0.00 0.00 0.00 57 N 8.74 4.41 0.00 2.70 2.77 0.00 0.00 7.16 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 58 S 8.53 4.36 0.00 3.86 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 59 R 8.51 4.64 0.00 1.83 1.91 0.00 3.14 0.00 0.00 3.34 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.66 0.00 60 G 7.97 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 0.00 0.00 0.00 61 R 7.99 4.00 0.00 1.87 2.00 0.00 3.13 0.00 0.00 3.34 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.70 0.00 62 A 7.81 4.01 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 R 8.30 3.92 0.00 2.00 1.99 0.00 3.13 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.94 0.00 64 E 8.06 3.94 0.00 2.19 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 0.00 2.32 2.32 0.00 65 R 7.80 3.88 0.00 1.97 2.12 0.00 3.12 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.91 0.00 66 Q 8.49 4.01 0.00 2.28 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.58 0.00 0.00 0.00 0.00 0.00 2.39 2.50 0.00 67 K 8.12 3.97 0.00 1.99 1.84 0.00 1.68 0.00 0.00 1.63 0.00 0.00 2.95 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.73 7.81 68 K 8.08 3.95 0.00 1.97 1.99 0.00 1.76 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.66 1.69 7.81 69 R 8.63 4.87 0.00 2.07 1.99 0.00 3.15 0.00 0.00 3.28 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.68 0.00 70 A 8.12 4.12 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 Y 8.05 4.35 0.00 2.94 3.14 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 72 G 7.83 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 73 H 8.71 4.81 0.00 3.37 3.26 0.00 5.77 0.00 0.00 0.00 0.00 6.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 Q 8.63 3.50 0.00 2.24 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 7.51 0.00 0.00 0.00 0.00 0.00 2.29 2.39 0.00 75 K 7.81 4.60 0.00 1.69 1.74 0.00 1.75 0.00 0.00 1.72 0.00 0.00 3.13 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.35 1.66 7.81 76 G 8.15 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 0.00 0.00 0.00 77 A 8.65 4.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 G 8.05 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 0.00 0.00 0.00 79 S 8.19 4.65 0.00 3.94 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 80 R 7.47 4.46 0.00 1.84 1.85 0.00 3.10 0.00 0.00 3.15 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.75 0.00 81 K 8.67 4.34 0.00 1.65 1.77 0.00 1.65 0.00 0.00 1.71 0.00 0.00 3.11 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.30 1.45 7.81 82 G 7.73 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 83 K 8.27 4.08 0.00 1.84 1.69 0.00 1.62 0.00 0.00 1.82 0.00 0.00 2.97 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.50 1.50 7.81 84 A 8.80 4.10 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 85 G 8.07 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 86 A 7.81 4.34 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 87 R 7.88 4.18 0.00 1.80 2.01 0.00 3.18 0.00 0.00 3.15 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.84 0.00 88 Q 7.92 4.24 0.00 2.04 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.88 6.99 0.00 0.00 0.00 0.00 0.00 2.27 2.30 0.00 89 N 8.82 4.67 0.00 2.81 2.73 0.00 0.00 6.91 7.63 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 90 S 8.76 4.21 0.00 4.10 4.14 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 91 K 8.02 4.03 0.00 1.83 2.03 0.00 1.81 0.00 0.00 1.87 0.00 0.00 2.95 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.55 1.46 7.81 92 E 8.81 4.80 0.00 2.44 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 2.32 2.34 0.00 93 D 8.75 4.36 0.00 2.89 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 W 8.44 4.22 0.00 3.49 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 95 E 8.18 3.59 0.00 2.23 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 0.00 2.43 2.72 0.00 96 S 7.95 3.96 0.00 3.88 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 97 R 7.90 3.81 0.00 1.79 1.88 0.00 3.36 0.00 0.00 3.11 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.78 0.00 98 I 7.27 3.30 0.56 0.00 0.00 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.58 0.32 0.00 0.00 99 R 7.64 3.81 0.00 2.08 1.88 0.00 3.26 0.00 0.00 3.12 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.54 0.00 100 A 7.89 3.92 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 0.00 101 Q 8.14 3.92 0.00 2.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.76 0.00 0.00 0.00 0.00 0.00 2.37 2.49 0.00 102 R 7.93 4.07 0.00 2.03 2.08 0.00 3.08 0.00 0.00 3.17 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.54 0.00 103 T 8.12 3.91 4.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 104 K 8.18 3.95 0.00 1.95 2.00 0.00 1.53 0.00 0.00 1.64 0.00 0.00 3.01 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.41 1.54 7.81 105 L 8.07 4.15 0.00 2.07 2.09 0.95 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 106 R 8.28 3.96 0.00 2.22 2.13 0.00 3.11 0.00 0.00 3.18 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.68 0.00 107 E 8.18 4.02 0.00 2.17 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 2.69 0.00 108 L 8.05 4.22 0.00 1.74 1.77 0.94 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 109 R 7.79 4.05 0.00 1.69 1.75 0.00 2.62 0.00 0.00 2.25 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.44 0.00 110 D 7.42 4.26 0.00 2.70 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 0.00 111 E 8.36 4.00 0.00 1.97 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 0.00 2.32 2.33 0.00 112 G 7.93 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 0.00 113 T 7.82 3.99 4.38 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 1.22 0.00 0.00 114 L 7.64 4.85 0.00 1.68 1.63 1.04 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 115 S 8.45 4.49 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 0.00 116 S 8.64 4.34 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 0.00 117 S 7.86 4.61 0.00 3.92 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 0.00 118 Q 7.73 4.08 0.00 2.26 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.52 0.00 0.00 0.00 0.00 0.00 2.42 2.60 0.00 119 Y 8.41 4.17 0.00 3.05 3.08 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 0.00 120 R 8.25 3.72 0.00 2.18 1.97 0.00 3.27 0.00 0.00 3.26 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.78 0.00 121 D 7.84 4.38 0.00 2.88 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 0.00 122 L 8.44 4.20 0.00 1.90 1.77 0.98 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 123 Y 8.51 3.95 0.00 2.39 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 0.00 124 D 8.48 4.42 0.00 2.76 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 0.00 125 K 7.93 3.88 0.00 1.84 1.29 0.00 1.73 0.00 0.00 1.52 0.00 0.00 2.98 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.32 1.51 7.81 126 A 7.88 3.92 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 G 7.74 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 0.00 128 G 7.61 3.89 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 0.00 0.00 0.00 129 G 8.42 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 0.00 130 E 8.12 3.75 0.00 1.16 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 1.99 0.00 131 F 7.18 5.02 0.00 3.29 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 0.00 132 D 9.15 4.41 0.00 2.72 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 0.00 133 S 7.40 4.55 0.00 4.03 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 0.00 134 V 8.51 3.50 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 1.04 0.00 0.00 0.90 0.00 0.00 135 A 8.03 4.16 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 0.00 136 D 7.90 4.36 0.00 2.80 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 0.00 137 L 7.61 3.29 0.00 1.59 1.61 -0.42 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 138 E 8.53 3.89 0.00 2.10 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 2.30 2.61 0.00 139 R 7.63 3.92 0.00 2.02 2.05 0.00 3.20 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.93 0.00 140 Y 7.59 4.21 0.00 3.02 3.03 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 0.00 141 I 7.81 3.81 2.03 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.85 0.90 0.00 0.00 142 D 7.98 4.56 0.00 2.74 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 A 7.64 3.92 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00