NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4225 8.2893 120.3486 54.9374 32.8336 175.0393 2 R 3.9005 8.4528 123.9360 55.3002 30.1925 175.1156 3 L 3.9706 8.4699 122.1112 55.6542 43.2354 177.6919 4 N 4.4021 8.6783 120.4107 53.6828 39.2004 172.7255 5 T 3.4804 8.1355 112.0266 63.2060 65.8085 172.2466 6 L 4.5160 8.0831 120.4726 54.5720 44.7718 176.4074 7 S 4.5689 8.0075 110.6733 57.7325 59.2585 168.7251 8 P 4.3786 0.0000 0.0000 63.7458 31.9487 175.3539 9 A 4.4737 8.9351 122.6485 51.7750 17.9294 177.3130 10 E 4.6436 8.5916 110.3620 55.3062 28.9207 178.8069 11 G 4.2136 8.6730 105.1828 44.1943 0.0000 171.2062 12 S 4.6418 7.7629 115.5880 57.5464 64.9391 173.5339 13 K 4.5630 8.4196 117.8508 57.4155 35.8455 178.0524 14 K 3.3953 9.2184 110.9586 59.9214 31.0553 178.3194 15 A 3.6198 8.9807 117.0779 52.1102 16.6738 178.8682 16 G 3.6558 8.0277 114.0967 46.4596 0.0000 174.6552 17 K 4.1023 8.4157 128.5496 55.9026 32.3513 174.7088 18 R 4.5261 8.3893 118.7520 54.7024 31.1928 176.6958 19 L 4.0993 8.5878 126.4652 57.8251 41.3458 176.9890 20 G 4.4419 8.9697 110.8340 45.1266 0.0000 174.4193 21 R 4.6473 6.9113 111.5294 53.9764 31.2460 176.4594 22 G 4.2218 8.1799 107.0300 48.1889 0.0000 173.5389 23 I 4.5493 6.9341 120.4661 59.3688 38.4780 176.3332 24 G 3.7469 9.1547 118.6060 46.8167 0.0000 173.8351 25 S 3.5980 9.6374 120.3819 56.9001 61.1605 172.8500 26 G 3.7513 8.2366 110.1372 46.6365 0.0000 175.5545 27 L 3.4680 7.9657 117.6304 55.0391 39.0008 174.5507 28 G 3.8636 8.2036 112.4242 44.5984 0.0000 171.4653 29 K 4.2166 8.4626 124.5198 56.2083 33.1761 175.5800 30 T 4.4511 8.1642 110.5938 60.8884 71.0908 174.7106 31 G 4.1022 9.4591 109.8089 46.2423 0.0000 172.7122 32 G 4.0551 7.4749 102.6624 46.3530 0.0000 176.3232 33 R 4.2469 8.5611 125.2342 55.3024 31.2619 176.3312 34 G 3.7980 8.8406 103.6130 48.6169 0.0000 173.9575 35 H 4.9692 7.2981 114.9651 53.6176 29.4449 173.9811 36 K 4.4121 7.8025 135.0000 59.5437 32.1792 175.6132 37 G 3.8635 8.4996 110.3763 41.9866 0.0000 174.6911 38 Q 3.9545 8.6335 117.2412 54.2849 28.0068 173.5239 39 K 3.6333 8.1500 116.7071 56.8716 32.8908 176.9316 40 S 4.6764 8.1386 110.0406 58.1505 61.2456 176.5181 41 R 4.7145 8.3052 111.6409 55.2851 30.6796 175.1509 42 S 4.5936 8.1475 108.8137 57.7098 64.3035 174.1525 43 G 4.2069 8.5116 115.1962 45.9938 0.0000 176.4637 44 G 4.0216 8.4790 104.4391 45.9938 0.0000 174.0571 45 G 3.9848 8.2807 105.7648 47.4178 0.0000 176.0859 46 V 4.0757 7.8407 110.7359 61.4063 31.2746 176.6252 47 R 4.6722 7.7617 117.6715 55.7966 29.8002 178.7060 48 R 4.2915 7.7523 117.5029 55.8537 27.6976 176.1807 49 G 3.9514 7.3728 106.9302 44.5248 0.0000 169.2483 50 F 4.5246 7.8501 123.6939 55.2633 41.5888 176.2664 51 E 4.1621 9.0525 125.7387 59.0215 29.9579 176.4574 52 G 3.9140 8.4652 112.0925 44.3801 0.0000 173.3546 53 G 3.8816 6.8742 106.0107 44.4659 0.0000 174.0448 54 Q 3.9822 8.6118 122.7325 58.9439 29.1632 175.4566 55 M 4.5540 7.1970 118.0656 55.4682 39.5962 173.6434 56 P 4.1082 0.0000 0.0000 60.6718 32.3270 176.9459 57 L 3.8410 9.1174 118.0804 57.5175 38.7677 174.6059 58 Y 3.5602 8.7671 115.9800 58.9633 36.7585 172.1167 59 R 4.2485 9.2681 118.1377 58.1603 30.4429 177.5467 60 R 4.6203 7.7331 112.6881 55.7180 32.6070 175.5345 61 L 4.1484 8.0011 117.4483 54.8672 42.3844 173.3293 62 P 4.9472 0.0000 0.0000 61.4734 34.1283 172.1427 63 K 4.7808 8.2258 118.9439 54.9591 34.4298 174.9600 64 F 4.6791 8.7884 118.3486 56.4355 40.9855 176.4576 65 G 4.1686 8.2422 115.3966 45.7276 0.0000 173.3286 66 F 5.1156 8.5293 125.3629 55.9716 41.9928 174.9178 67 T 3.6933 9.0830 117.1184 61.6893 68.7109 173.7039 68 S 3.8983 8.3780 119.6646 57.9635 63.4403 174.1252 69 R 3.9587 8.1079 117.7896 55.9361 29.3076 177.6801 70 K 4.1628 8.6342 119.4844 56.9827 31.4053 177.9626 71 A 4.1781 8.3926 124.5162 51.3441 16.4690 179.3192 72 A 3.0338 7.1120 117.1046 53.7121 20.1903 178.1903 73 I 4.3862 7.6632 127.1911 59.0645 40.6616 177.0266 74 T 4.3026 8.3842 127.0645 62.3618 66.5066 175.3728 75 A 3.8967 7.8655 122.8745 52.6625 19.1559 177.8972 76 E 4.1016 8.7376 122.2909 56.4525 30.1565 176.9221 77 I 4.0167 7.6187 107.1624 60.2433 37.7381 174.1024 78 R 4.0340 8.1176 125.8688 56.1529 30.2260 178.3201 79 L 4.2424 8.5641 121.3028 57.4281 41.7719 178.7547 80 S 4.1489 7.9061 111.2431 59.4619 62.7798 174.3053 81 D 4.5439 9.2569 119.8820 57.1375 41.6327 177.5021 82 L 3.3717 7.4333 113.2876 59.0882 41.2997 177.5118 83 A 4.2481 8.5354 132.2602 52.9300 17.1532 178.2353 84 K 5.3795 7.8355 135.0000 58.0134 31.4811 175.6403 85 V 3.8326 7.2518 119.8841 61.6501 31.9974 175.5538 86 E 4.8614 8.1728 121.0155 54.4180 31.6324 174.2937 87 G 3.6162 9.5597 110.5334 46.0227 0.0000 172.5743 88 G 3.9031 8.1487 118.0991 46.0720 0.0000 173.5817 89 V 4.1785 7.3224 121.2961 60.6359 29.5634 178.4602 90 V 4.1654 7.2628 121.3355 60.5165 30.6826 175.8712 91 D 4.7114 8.1467 123.2531 52.4170 40.2467 180.4111 92 L 3.0484 8.1139 117.1539 54.0262 43.2449 180.5771 93 N 3.3524 8.0950 115.6205 54.2502 39.9447 175.6976 94 T 3.9137 7.9943 117.7898 63.1420 70.4374 175.4315 95 L 4.6849 7.3435 123.3230 53.4041 42.4984 177.2772 96 K 4.5763 7.9165 116.4225 54.8312 36.1782 176.7984 97 A 4.1126 8.9400 126.2363 54.6100 19.8335 178.2266 98 A 3.4657 7.6045 117.1735 53.9018 18.1235 175.8346 99 N 4.7239 8.7842 108.6379 55.8113 39.5609 177.8210 100 I 4.5975 7.1850 117.4238 60.3815 38.1340 175.2858 101 I 4.2463 7.9698 118.9858 61.5438 37.2551 177.3470 102 G 4.0179 7.7270 110.2117 45.5755 0.0000 174.9076 103 I 4.4670 7.4521 121.2626 61.0521 38.7124 173.7239 104 Q 4.4809 8.5996 120.4252 55.7482 26.8416 178.6342 105 I 4.6142 8.6974 125.8748 60.5966 39.7808 173.0643 106 E 4.5445 8.1037 124.7009 54.7469 33.5199 175.4452 107 F 4.4465 7.0699 122.2877 58.6638 42.3448 173.0170 108 A 4.3571 7.4699 123.4300 53.5599 20.7277 177.8229 109 K 3.9713 7.8940 113.0119 56.4637 30.8003 173.9839 110 V 4.3431 8.2904 115.0368 64.7323 36.9679 176.0593 111 I 3.3783 7.1501 111.7198 60.2413 38.2653 173.5459 112 L 4.5813 8.1083 122.4826 53.4343 41.8955 176.3090 113 A 4.6662 7.5780 131.8320 51.2754 17.7046 180.7875 114 G 3.7736 8.6922 114.0231 46.6974 0.0000 173.4687 115 E 3.9143 8.9612 128.3386 55.6456 31.2546 172.9988 116 V 4.5483 7.9377 117.7011 61.3273 37.8728 173.5092 117 T 3.9469 7.7772 127.7182 61.1501 73.1589 172.9413 118 T 5.6162 6.8213 126.5404 64.4625 69.0868 171.1809 119 P 4.3040 0.0000 0.0000 62.5395 31.3698 176.3044 120 V 4.4658 7.6205 121.7244 61.5628 32.4499 171.0251 121 T 5.0747 7.8028 117.0966 59.5125 70.5780 173.7711 122 V 4.4071 8.2742 128.7022 61.2784 32.1879 175.1104 123 R 4.3573 8.1030 124.2595 54.2358 31.7076 176.0266 124 G 4.0546 8.8376 107.1850 45.2159 0.0000 170.1135 125 L 3.3648 8.0661 126.5044 55.3684 42.2552 171.5977 126 R 4.2338 8.8002 125.8550 56.3560 30.9396 175.5384 127 V 4.5395 7.9924 116.6363 59.6210 35.6750 175.2373 128 T 4.3252 8.5156 113.1658 61.0130 69.7344 176.1716 129 K 4.2765 8.4779 125.8571 59.5102 33.1871 178.4474 130 G 3.4923 8.3132 105.0709 47.8904 0.0000 175.3228 131 A 3.5816 8.0962 123.5510 54.5115 17.9393 179.3231 132 R 3.7914 7.9214 116.5148 59.8660 30.3450 178.1988 133 A 4.1686 7.4142 116.6388 54.6897 18.4050 179.0988 134 A 3.8883 8.7238 119.6707 54.8923 18.5117 178.5572 135 I 4.3570 7.7033 116.5466 61.4910 37.7433 176.9776 136 E 4.0334 8.7925 124.7266 58.6430 30.3584 177.1851 137 A 4.3509 7.9113 123.0583 50.2993 17.7225 175.3206 138 A 4.4776 5.9683 122.7543 52.6193 24.2270 177.2396 139 G 3.9847 7.4515 103.9810 43.7622 0.0000 173.8606 140 G 3.5923 8.8812 116.2319 46.7579 0.0000 174.8468 141 K 3.5062 8.6520 116.6038 55.1584 33.6619 176.1688 142 I 3.2405 7.6735 117.2466 61.1191 36.1142 171.9128 143 E 4.6829 8.4868 123.4505 54.1465 31.5331 176.0554 144 E 4.2136 8.5848 119.4417 56.4480 29.8349 175.3978 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 M 8.29 4.42 0.00 1.97 2.07 0.00 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.60 0.00 2 R 8.45 3.90 0.00 2.02 1.93 0.00 3.14 0.00 0.00 3.23 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.77 0.00 3 L 8.47 3.97 0.00 1.64 1.64 0.92 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 4 N 8.68 4.40 0.00 2.86 2.85 0.00 0.00 7.20 7.70 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 5 T 8.14 3.48 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 6 L 8.08 4.52 0.00 1.62 1.64 0.94 1.14 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 7 S 8.01 4.57 0.00 3.99 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 8 P 0.00 4.38 0.00 2.18 2.09 0.00 3.67 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.06 0.00 9 A 8.94 4.47 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 E 8.59 4.64 0.00 1.87 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 2.17 2.27 0.00 11 G 8.67 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 S 7.76 4.64 0.00 3.87 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 13 K 8.42 4.56 0.00 1.70 1.80 0.00 1.80 0.00 0.00 1.75 0.00 0.00 3.05 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.32 1.32 7.81 14 K 9.22 3.40 0.00 1.85 1.68 0.00 1.58 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.42 1.47 7.81 15 A 8.98 3.62 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 16 G 8.03 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 17 K 8.42 4.10 0.00 1.70 1.78 0.00 1.63 0.00 0.00 1.63 0.00 0.00 3.03 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.42 1.50 7.81 18 R 8.39 4.53 0.00 1.76 1.80 0.00 3.47 0.00 0.00 3.27 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.64 0.00 19 L 8.59 4.10 0.00 1.79 1.77 0.95 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 20 G 8.97 4.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 R 6.91 4.65 0.00 1.87 1.99 0.00 2.85 0.00 0.00 3.88 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.49 0.00 22 G 8.18 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 0.00 0.00 0.00 23 I 6.93 4.55 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.53 0.91 0.00 0.00 24 G 9.15 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 0.00 0.00 0.00 25 S 9.64 3.60 0.00 4.04 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 26 G 8.24 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 0.00 0.00 0.00 27 L 7.97 3.47 0.00 1.71 1.83 0.92 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 28 G 8.20 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 29 K 8.46 4.22 0.00 1.73 1.75 0.00 1.76 0.00 0.00 1.75 0.00 0.00 3.10 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.42 1.43 7.81 30 T 8.16 4.45 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 31 G 9.46 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 0.00 0.00 0.00 32 G 7.47 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 33 R 8.56 4.25 0.00 1.76 1.75 0.00 3.23 0.00 0.00 3.21 7.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.60 0.00 34 G 8.84 3.80 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 0.00 0.00 0.00 35 H 7.30 4.97 0.00 3.19 3.28 0.00 5.54 0.00 0.00 0.00 0.00 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 K 7.80 4.41 0.00 1.73 1.59 0.00 1.67 0.00 0.00 1.71 0.00 0.00 2.88 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.51 1.50 7.81 37 G 8.50 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 38 Q 8.63 3.95 0.00 2.23 2.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.53 5.96 0.00 0.00 0.00 0.00 0.00 2.16 2.28 0.00 39 K 8.15 3.63 0.00 1.89 1.85 0.00 1.74 0.00 0.00 1.63 0.00 0.00 2.84 0.00 0.00 3.26 0.00 0.00 0.00 0.00 1.39 1.50 7.81 40 S 8.14 4.68 0.00 3.82 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 41 R 8.31 4.71 0.00 1.78 1.84 0.00 3.19 0.00 0.00 3.27 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.61 0.00 42 S 8.15 4.59 0.00 3.93 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 43 G 8.51 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 G 8.48 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 G 8.28 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 46 V 7.84 4.08 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 0.70 0.00 0.00 0.94 0.00 0.00 47 R 7.76 4.67 0.00 1.73 1.85 0.00 3.28 0.00 0.00 3.25 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.58 0.00 48 R 7.75 4.29 0.00 1.82 1.88 0.00 3.26 0.00 0.00 3.23 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.68 0.00 49 G 7.37 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 50 F 7.85 4.52 0.00 3.02 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 51 E 9.05 4.16 0.00 2.11 2.02 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 2.32 2.29 0.00 52 G 8.47 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 53 G 6.87 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 0.00 0.00 0.00 54 Q 8.61 3.98 0.00 2.08 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.77 0.00 0.00 0.00 0.00 0.00 2.28 2.35 0.00 55 M 7.20 4.55 0.00 1.90 1.78 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.59 0.00 56 P 0.00 4.11 0.00 2.17 1.96 0.00 3.87 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.12 0.00 57 L 9.12 3.84 0.00 1.84 1.69 0.80 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 58 Y 8.77 3.56 0.00 3.03 3.09 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 59 R 9.27 4.25 0.00 1.87 2.05 0.00 3.35 0.00 0.00 3.35 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 1.76 0.00 60 R 7.73 4.62 0.00 1.79 1.94 0.00 3.26 0.00 0.00 3.20 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.65 0.00 61 L 8.00 4.15 0.00 1.54 1.45 0.92 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 62 P 0.00 4.95 0.00 2.12 1.92 0.00 3.48 0.00 0.00 3.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.81 0.00 63 K 8.23 4.78 0.00 1.77 1.83 0.00 1.76 0.00 0.00 1.71 0.00 0.00 2.88 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.42 1.56 7.81 64 F 8.79 4.68 0.00 2.96 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 65 G 8.24 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 0.00 0.00 0.00 0.00 66 F 8.53 5.12 0.00 2.84 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 67 T 9.08 3.69 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 1.27 0.00 0.00 68 S 8.38 3.90 0.00 3.88 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 R 8.11 3.96 0.00 1.98 2.06 0.00 2.94 0.00 0.00 3.31 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.60 0.00 70 K 8.63 4.16 0.00 1.77 1.87 0.00 1.75 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.43 1.44 7.81 71 A 8.39 4.18 1.22 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 0.00 0.00 72 A 7.11 3.03 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 73 I 7.66 4.39 2.08 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 0.49 0.95 0.00 0.00 74 T 8.38 4.30 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 75 A 7.87 3.90 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 76 E 8.74 4.10 0.00 1.96 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 2.32 2.37 0.00 77 I 7.62 4.02 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 1.40 0.16 0.90 0.00 0.00 78 R 8.12 4.03 0.00 2.07 1.90 0.00 3.14 0.00 0.00 3.34 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.66 0.00 79 L 8.56 4.24 0.00 1.99 1.78 0.94 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 80 S 7.91 4.15 0.00 4.02 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 81 D 9.26 4.54 0.00 2.83 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 82 L 7.43 3.37 0.00 1.77 1.52 0.95 0.85 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 83 A 8.54 4.25 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 84 K 7.84 5.38 0.00 1.80 2.14 0.00 2.07 0.00 0.00 1.75 0.00 0.00 3.02 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.18 1.15 7.81 85 V 7.25 3.83 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 0.76 0.00 0.00 0.92 0.00 0.00 86 E 8.17 4.86 0.00 1.87 1.88 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 2.04 2.19 0.00 87 G 9.56 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 G 8.15 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 V 7.32 4.18 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 0.82 0.00 0.00 0.92 0.00 0.00 90 V 7.26 4.17 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 0.84 0.00 0.00 0.91 0.00 0.00 91 D 8.15 4.71 0.00 2.72 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 92 L 8.11 3.05 0.00 1.74 1.53 0.92 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 93 N 8.10 3.35 0.00 2.78 2.96 0.00 0.00 6.88 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 T 7.99 3.91 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 1.20 0.00 0.00 95 L 7.34 4.68 0.00 1.61 1.70 0.91 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 96 K 7.92 4.58 0.00 1.68 1.64 0.00 1.64 0.00 0.00 1.99 0.00 0.00 3.22 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.35 1.39 7.81 97 A 8.94 4.11 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 98 A 7.60 3.47 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 99 N 8.78 4.72 0.00 2.72 2.87 0.00 0.00 6.53 7.45 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 0.00 100 I 7.18 4.60 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.39 0.91 0.00 0.00 101 I 7.97 4.25 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.76 0.91 0.00 0.00 102 G 7.73 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 I 7.45 4.47 1.88 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 1.46 0.94 0.92 0.00 0.00 104 Q 8.60 4.48 0.00 2.05 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.97 6.74 0.00 0.00 0.00 0.00 0.00 2.32 2.43 0.00 105 I 8.70 4.61 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 0.61 0.93 0.00 0.00 106 E 8.10 4.54 0.00 1.96 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 2.23 2.37 0.00 107 F 7.07 4.45 0.00 2.92 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 0.00 108 A 7.47 4.36 1.09 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 0.00 109 K 7.89 3.97 0.00 2.01 1.96 0.00 1.82 0.00 0.00 1.70 0.00 0.00 2.94 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.53 1.64 7.81 110 V 8.29 4.34 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 0.78 0.00 0.00 0.95 0.00 0.00 111 I 7.15 3.38 1.88 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.86 0.92 0.00 0.00 112 L 8.11 4.58 0.00 1.60 1.61 0.92 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 113 A 7.58 4.67 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 G 8.69 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 0.00 115 E 8.96 3.91 0.00 2.08 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 2.18 2.37 0.00 116 V 7.94 4.55 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 0.65 0.00 0.00 0.93 0.00 0.00 117 T 7.78 3.95 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 0.00 118 T 6.82 5.62 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 0.00 119 P 0.00 4.30 0.00 2.04 2.01 0.00 3.75 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.06 0.00 120 V 7.62 4.47 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 0.78 0.00 0.00 0.92 0.00 0.00 121 T 7.80 5.07 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 1.20 0.00 0.00 122 V 8.27 4.41 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 0.91 0.00 0.00 123 R 8.10 4.36 0.00 2.12 1.97 0.00 3.04 0.00 0.00 3.22 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.67 0.00 124 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 0.00 125 L 8.07 3.36 0.00 1.40 1.58 0.35 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 126 R 8.80 4.23 0.00 1.63 1.94 0.00 3.39 0.00 0.00 3.34 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.82 0.00 127 V 7.99 4.54 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 0.82 0.00 0.00 0.94 0.00 0.00 128 T 8.52 4.33 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 129 K 8.48 4.28 0.00 1.83 1.83 0.00 1.72 0.00 0.00 1.83 0.00 0.00 2.89 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.52 1.51 7.81 130 G 8.31 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 0.00 131 A 8.10 3.58 1.37 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 0.00 0.00 132 R 7.92 3.79 0.00 1.80 2.15 0.00 3.31 0.00 0.00 3.23 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.71 0.00 133 A 7.41 4.17 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 0.00 134 A 8.72 3.89 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 0.00 135 I 7.70 4.36 1.91 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 1.18 0.87 0.90 0.00 0.00 136 E 8.79 4.03 0.00 1.87 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 2.32 2.30 0.00 137 A 7.91 4.35 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 0.00 138 A 5.97 4.48 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 0.00 139 G 7.45 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 0.00 140 G 8.88 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 K 8.65 3.51 0.00 1.79 1.12 0.00 1.78 0.00 0.00 1.75 0.00 0.00 3.02 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.35 1.35 7.81 142 I 7.67 3.24 1.84 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 1.35 0.56 0.99 0.00 0.00 143 E 8.49 4.68 0.00 2.10 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 2.25 2.19 0.00 144 E 8.58 4.21 0.00 2.09 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 2.17 2.30 0.00