NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 C 4.6702 8.2033 120.8518 59.0474 33.4915 174.7920 2 D 4.3572 7.9720 118.2529 55.3367 41.0629 176.7076 3 A 4.0221 8.8103 123.0199 54.6316 19.3925 178.0376 4 F 4.4822 7.6013 112.5525 58.4583 39.6331 176.7089 5 V 3.9222 7.4980 120.9747 63.0560 31.9330 175.3132 6 G 3.7956 7.8594 112.2395 44.0569 0.0000 171.5143 7 T 4.9316 7.8695 116.1026 61.5943 70.7982 174.1439 8 W 5.4404 9.2287 125.9701 54.6306 33.0888 174.5253 9 K 5.1074 9.4696 122.8538 54.6947 35.2504 175.1326 10 L 3.7467 8.2621 124.9711 55.3495 41.8530 176.8473 11 V 4.4952 8.6279 118.8628 61.5804 34.4332 176.0106 12 S 4.6543 7.4936 113.4114 56.9815 66.2085 173.2468 13 S 5.0036 8.4427 115.7126 56.7320 65.6416 172.8456 14 E 4.5125 8.5005 124.8281 55.2873 33.8783 175.2534 15 N 4.0397 9.1021 120.8056 54.6867 37.8594 175.5993 16 F 4.8149 8.1912 122.0138 60.2217 39.3383 176.2924 17 D 4.1141 8.0813 117.3781 57.5810 41.1121 177.9572 18 D 4.2547 8.0636 118.6757 57.0002 40.8493 178.0543 19 Y 4.0929 7.9217 119.9403 60.9654 38.8819 177.8047 20 M 3.6402 8.1538 119.9105 58.1894 31.7939 178.5542 21 K 3.7485 8.1273 117.6616 59.8371 32.3932 178.4449 22 E 4.0044 8.0081 117.7320 59.3667 29.5576 178.7766 23 V 3.8842 7.2488 117.5054 64.2474 31.5463 176.7466 24 G 4.1301 7.6307 105.9080 45.0304 0.0000 173.6622 25 V 3.6546 7.4745 119.4638 62.2291 32.2232 176.7828 26 G 3.8878 8.4666 113.2436 43.9226 0.0000 174.1339 27 F 3.8987 8.9475 123.0214 61.4183 39.3248 177.6733 28 A 4.0764 8.1549 119.3855 55.5901 18.2587 179.5867 29 T 3.8411 7.8607 113.7882 66.7461 68.5059 176.8027 30 R 3.5951 7.9805 120.0769 59.1040 29.9141 179.1378 31 K 3.7068 7.5765 117.9826 59.5233 31.7760 179.6375 32 V 3.5338 7.4962 117.6394 65.8470 31.2360 177.9088 33 A 3.4593 8.0532 120.4947 54.8563 18.2079 179.6199 34 G 3.7479 8.0450 103.2903 47.5372 0.0000 175.1910 35 M 4.2445 7.5729 118.9804 55.5139 32.7192 176.6346 36 A 4.2489 7.1175 122.1861 51.9387 19.1299 177.8095 37 K 4.4516 8.1718 121.2435 53.7093 32.4038 173.9888 38 P 4.8292 0.0000 0.0000 62.3616 33.1199 175.0034 39 N 5.2798 8.9755 120.2484 52.8853 40.7655 173.9077 40 M 5.1992 9.5303 121.8683 53.9956 35.4413 174.0250 41 I 5.0045 9.4702 128.5129 59.6869 40.0224 174.6303 42 I 5.1961 8.9580 128.4560 59.5333 39.9365 175.0085 43 S 5.0249 9.1630 120.5664 56.6009 66.9998 172.8283 44 V 4.6361 8.3534 120.1211 61.1501 34.0572 174.5369 45 N 4.7550 9.1886 125.8819 52.2142 41.1373 174.9995 46 G 3.8006 8.1618 118.3356 47.0689 0.0000 173.1120 47 D 4.5415 8.8775 124.0973 52.8705 39.9313 175.1299 48 L 4.4962 7.9736 124.2200 53.7650 43.7132 175.1348 49 V 4.5043 8.0687 126.7970 61.5126 33.9664 174.5606 50 T 5.0306 8.5642 122.3407 61.8518 72.9959 173.0360 51 I 4.9611 8.8399 125.7547 59.8265 40.6475 174.4162 52 R 5.0296 9.3140 127.4376 54.7040 32.3230 175.5755 53 S 5.2614 8.9524 118.3256 56.5342 65.4723 172.4565 54 E 5.7088 9.9267 126.5499 53.7253 32.3283 174.8949 55 S 5.1800 8.5884 118.4214 56.0216 65.9102 174.4162 56 T 3.9405 8.8989 110.3841 64.8867 67.7353 174.7084 57 F 4.4891 7.7673 123.7317 59.7214 40.3018 174.6456 58 K 4.4331 8.2695 117.2632 54.9670 36.7782 174.7819 59 N 5.5321 8.5557 117.6227 51.9865 40.8518 174.2141 60 T 5.0056 8.6193 113.6003 60.0523 72.7333 172.5478 61 E 5.3478 8.5041 121.4664 55.0389 32.7824 173.8877 62 I 4.7642 8.7464 119.9907 59.2342 40.7803 174.4477 63 S 5.1886 8.4884 119.9118 56.8332 65.9071 173.1531 64 F 4.5133 8.3920 117.9946 55.6896 41.7427 172.8680 65 K 4.9385 8.4121 118.6915 54.2858 34.4238 176.2624 66 L 4.3843 8.7447 123.9546 56.5568 42.0434 177.3442 67 G 3.9347 9.6321 110.5304 45.9886 0.0000 173.1830 68 V 4.3381 7.5537 118.7580 60.2109 33.0212 175.0221 69 E 4.5726 8.8936 129.0346 56.5902 30.1841 175.6735 70 F 5.1750 8.8381 120.5049 55.1833 41.9480 173.4041 71 D 5.0935 8.7879 119.5033 54.0614 42.0465 175.5571 72 E 4.7708 9.1080 121.9924 54.7645 33.8388 173.9389 73 I 4.9538 8.2687 126.5017 59.5863 38.7647 175.8288 74 T 4.0878 8.9105 118.2493 60.7339 69.5124 175.4368 75 A 3.9029 8.5411 124.7587 55.0866 18.3904 178.1334 76 D 4.7416 8.0646 112.6477 53.4159 39.7219 176.1153 77 D 4.5662 8.1727 118.2820 55.5492 38.6899 174.3609 78 R 4.0459 7.6055 118.0199 55.5729 30.7819 175.6338 79 K 4.8233 8.3872 123.3489 55.6237 32.8078 175.9422 80 V 4.7934 8.8705 120.7673 59.4500 36.1793 174.7467 81 K 4.6735 8.6989 122.0909 55.4823 33.7038 176.1174 82 S 5.6430 8.3164 120.4032 55.7332 66.6483 173.1291 83 I 4.8713 8.0175 122.3211 59.5820 40.9832 174.2352 84 I 5.0442 8.4905 126.5889 59.7196 40.4550 174.6017 85 T 4.9643 8.9421 115.5650 59.9730 72.9271 172.2694 86 L 5.0131 8.5252 124.2819 53.6481 43.9053 175.5991 87 D 4.5943 9.2353 127.2195 52.8066 42.7745 175.8677 88 G 4.2620 9.7325 116.0741 46.4049 0.0000 172.5500 89 G 3.9979 8.1072 103.3144 45.4035 0.0000 171.9706 90 A 4.9567 7.8390 122.3575 50.4246 21.2939 176.0688 91 L 4.4764 8.7065 125.4151 54.3085 43.3008 175.5419 92 V 4.6239 8.9921 127.6799 61.1670 33.9044 173.8230 93 Q 4.9150 9.0334 130.0316 54.2927 31.4756 174.0009 94 V 4.7934 8.6109 126.6441 61.2825 34.0820 174.0466 95 Q 5.2406 9.0140 126.7872 54.1084 31.5160 174.7508 96 K 5.4930 8.8357 123.1342 54.6128 35.9737 175.1910 97 W 4.7114 9.2848 117.7074 56.3449 31.6416 174.0385 98 D 4.2544 9.7416 120.1459 55.5914 37.7171 175.0751 99 G 3.7235 7.9038 104.9017 45.7223 0.0000 172.8602 100 K 4.2367 7.5449 120.3509 54.5336 34.7067 174.5952 101 S 5.7879 7.4465 111.8050 59.3526 65.3900 174.2610 102 T 4.9874 8.5958 114.5151 61.1225 71.3085 172.1215 103 T 5.0608 8.9705 124.1872 61.9421 71.3719 173.5317 104 I 4.7887 9.0888 127.0511 59.5523 40.0036 174.3206 105 K 4.7523 9.2394 130.2861 54.8948 33.9036 175.1339 106 R 5.1314 9.1346 127.8028 54.3987 32.0703 175.5830 107 K 5.1976 9.1561 122.9378 55.2188 36.6894 175.3283 108 R 4.6887 8.4183 120.4833 55.3184 31.5160 175.8818 109 D 4.6615 9.2446 123.6078 52.9920 44.3165 176.7631 110 G 3.8801 8.3355 116.1899 47.0094 0.0000 172.9942 111 D 4.7488 8.9582 123.3232 53.1660 39.8496 175.6535 112 K 4.9577 8.5456 120.5734 55.0180 35.1732 174.9612 113 L 4.5742 8.8851 126.1419 53.6349 43.5715 175.1490 114 V 4.6088 9.2111 128.2452 61.3477 33.6264 174.4143 115 V 4.6552 9.3246 129.4239 61.4586 33.4095 174.0288 116 E 5.0544 9.1931 128.7776 54.8622 31.9250 174.7725 117 C 5.0544 9.0917 123.1029 57.8307 30.6611 173.1705 118 V 5.0319 8.9906 124.1485 61.4398 34.7007 174.2250 119 M 4.8632 9.3785 126.4721 54.7997 35.8265 174.8437 120 K 3.6474 9.8106 127.1518 57.5925 29.8557 176.2447 121 G 3.9908 8.3000 105.4970 45.4782 0.0000 173.6757 122 V 4.1298 7.6655 121.0512 62.4516 32.7014 174.8813 123 T 5.1984 8.6382 124.0277 61.8252 71.2657 173.2937 124 S 5.0194 9.0558 119.8739 56.8185 66.3037 172.8231 125 T 4.8487 8.6035 120.9519 61.9497 72.1102 172.9810 126 R 4.9097 9.2126 125.9010 54.1931 33.5627 174.8633 127 V 4.8127 8.3975 123.3729 61.3836 34.0453 174.0071 128 Y 5.3996 9.4583 125.2131 56.2156 41.6758 174.3856 129 E 5.4237 9.1856 118.7814 54.2833 33.6830 175.1955 130 R 3.8928 8.6651 119.3417 56.2252 30.8361 176.8281 131 A 4.1339 8.4038 125.3735 52.4936 18.4773 177.2561 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 C 8.20 4.67 0.00 3.05 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 2 D 7.97 4.36 0.00 2.86 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 3 A 8.81 4.02 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 4 F 7.60 4.48 0.00 3.25 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 V 7.50 3.92 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.00 0.00 1.01 0.00 0.00 6 G 7.86 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 7 T 7.87 4.93 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 8 W 9.23 5.44 0.00 3.33 3.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 K 9.47 5.11 0.00 1.79 1.95 0.00 1.33 0.00 0.00 1.60 0.00 0.00 2.92 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.58 1.39 7.81 10 L 8.26 3.75 0.00 1.33 1.41 0.18 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 11 V 8.63 4.50 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 0.88 0.00 0.00 0.94 0.00 0.00 12 S 7.49 4.65 0.00 3.79 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 S 8.44 5.00 0.00 3.66 3.64 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 14 E 8.50 4.51 0.00 1.92 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.21 0.00 15 N 9.10 4.04 0.00 3.00 3.04 0.00 0.00 6.85 7.71 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 16 F 8.19 4.81 0.00 3.07 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 D 8.08 4.11 0.00 2.79 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 18 D 8.06 4.25 0.00 2.91 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 19 Y 7.92 4.09 0.00 3.13 3.21 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 20 M 8.15 3.64 0.00 1.77 1.94 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 2.12 0.00 21 K 8.13 3.75 0.00 1.82 1.87 0.00 1.70 0.00 0.00 1.63 0.00 0.00 3.00 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.45 1.60 7.81 22 E 8.01 4.00 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 2.53 2.34 0.00 23 V 7.25 3.88 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 0.75 0.00 0.00 0.39 0.00 0.00 24 G 7.63 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 0.00 0.00 0.00 25 V 7.47 3.65 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 0.72 0.00 0.00 0.80 0.00 0.00 26 G 8.47 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 27 F 8.95 3.90 0.00 3.15 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 28 A 8.15 4.08 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 29 T 7.86 3.84 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 1.31 0.00 0.00 30 R 7.98 3.60 0.00 1.71 1.72 0.00 3.16 0.00 0.00 3.15 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.83 0.00 31 K 7.58 3.71 0.00 1.80 1.74 0.00 1.28 0.00 0.00 1.35 0.00 0.00 2.56 0.00 0.00 2.68 0.00 0.00 0.00 0.00 1.01 1.37 7.81 32 V 7.50 3.53 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 1.24 0.00 0.00 1.02 0.00 0.00 33 A 8.05 3.46 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 G 8.05 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 35 M 7.57 4.24 0.00 1.94 2.17 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.53 0.00 36 A 7.12 4.25 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 37 K 8.17 4.45 0.00 1.72 1.72 0.00 1.75 0.00 0.00 1.69 0.00 0.00 2.96 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.28 1.40 7.81 38 P 0.00 4.83 0.00 2.28 2.10 0.00 3.56 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.22 0.00 39 N 8.98 5.28 0.00 2.82 2.81 0.00 0.00 6.47 6.94 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 40 M 9.53 5.20 0.00 1.79 1.67 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.41 0.00 41 I 9.47 5.00 1.91 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.64 0.94 0.00 0.00 42 I 8.96 5.20 2.30 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.85 1.05 0.00 0.00 43 S 9.16 5.02 0.00 3.81 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 44 V 8.35 4.64 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 0.79 0.00 0.00 0.93 0.00 0.00 45 N 9.19 4.75 0.00 2.60 2.58 0.00 0.00 6.79 7.78 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 46 G 8.16 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 47 D 8.88 4.54 0.00 2.76 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 48 L 7.97 4.50 0.00 1.68 1.57 0.81 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 49 V 8.07 4.50 0.67 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 0.82 0.00 0.00 0.70 0.00 0.00 50 T 8.56 5.03 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 51 I 8.84 4.96 1.98 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.98 0.92 0.00 0.00 52 R 9.31 5.03 0.00 1.74 1.86 0.00 3.07 0.00 0.00 3.10 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.57 0.00 53 S 8.95 5.26 0.00 3.92 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 54 E 9.93 5.71 0.00 1.88 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 2.26 2.24 0.00 55 S 8.59 5.18 0.00 4.11 3.94 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 0.00 0.00 0.00 56 T 8.90 3.94 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 57 F 7.77 4.49 0.00 2.95 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 K 8.27 4.43 0.00 1.16 1.40 0.00 1.42 0.00 0.00 1.45 0.00 0.00 2.73 0.00 0.00 2.59 0.00 0.00 0.00 0.00 1.08 0.72 7.81 59 N 8.56 5.53 0.00 2.60 2.84 0.00 0.00 6.32 7.05 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 60 T 8.62 5.01 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 61 E 8.50 5.35 0.00 1.97 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 0.00 2.21 2.32 0.00 62 I 8.75 4.76 2.08 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.97 1.13 0.00 0.00 63 S 8.49 5.19 0.00 3.64 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 64 F 8.39 4.51 0.00 2.34 1.46 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 65 K 8.41 4.94 0.00 1.75 1.75 0.00 1.66 0.00 0.00 1.81 0.00 0.00 2.84 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.52 1.37 7.81 66 L 8.74 4.38 0.00 1.69 1.69 0.97 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 67 G 9.63 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 V 7.55 4.34 2.18 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 0.88 0.00 0.00 1.03 0.00 0.00 69 E 8.89 4.57 0.00 2.04 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 2.28 2.43 0.00 70 F 8.84 5.17 0.00 3.11 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 D 8.79 5.09 0.00 2.63 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 72 E 9.11 4.77 0.00 1.97 1.56 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 2.18 2.36 0.00 73 I 8.27 4.95 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 1.41 1.02 0.88 0.00 0.00 74 T 8.91 4.09 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 75 A 8.54 3.90 1.45 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 0.00 0.00 76 D 8.06 4.74 0.00 2.81 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 77 D 8.17 4.57 0.00 2.86 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 78 R 7.61 4.05 0.00 1.50 1.34 0.00 2.21 0.00 0.00 2.72 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.45 0.00 79 K 8.39 4.82 0.00 1.76 1.74 0.00 1.73 0.00 0.00 1.73 0.00 0.00 2.93 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.37 1.46 7.81 80 V 8.87 4.79 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.23 0.00 0.00 0.75 0.00 0.00 81 K 8.70 4.67 0.00 1.68 1.77 0.00 1.59 0.00 0.00 1.65 0.00 0.00 2.86 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.52 1.42 7.81 82 S 8.32 5.64 0.00 2.72 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 83 I 8.02 4.87 1.85 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 1.34 0.67 0.94 0.00 0.00 84 I 8.49 5.04 1.42 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.89 0.72 0.00 0.00 85 T 8.94 4.96 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 1.22 0.00 0.00 86 L 8.53 5.01 0.00 1.67 1.63 1.09 1.20 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 87 D 9.24 4.59 0.00 2.67 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 88 G 9.73 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 G 8.11 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 0.00 0.00 0.00 90 A 7.84 4.96 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 91 L 8.71 4.48 0.00 0.64 1.02 0.81 0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 92 V 8.99 4.62 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 0.94 0.00 0.00 0.96 0.00 0.00 93 Q 9.03 4.91 0.00 1.97 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.55 0.00 0.00 0.00 0.00 0.00 2.17 2.13 0.00 94 V 8.61 4.79 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 0.93 0.00 0.00 0.93 0.00 0.00 95 Q 9.01 5.24 0.00 2.08 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.52 0.00 0.00 0.00 0.00 0.00 2.15 2.25 0.00 96 K 8.84 5.49 0.00 1.69 1.69 0.00 1.69 0.00 0.00 1.70 0.00 0.00 2.89 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.36 1.37 7.81 97 W 9.28 4.71 0.00 3.41 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 98 D 9.74 4.25 0.00 2.51 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 99 G 7.90 3.72 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 0.00 100 K 7.54 4.24 0.00 0.79 0.92 0.00 1.36 0.00 0.00 0.74 0.00 0.00 2.64 0.00 0.00 2.70 0.00 0.00 0.00 0.00 0.96 0.99 7.81 101 S 7.45 5.79 0.00 3.95 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 0.00 102 T 8.60 4.99 4.58 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 1.42 0.00 0.00 103 T 8.97 5.06 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 1.21 0.00 0.00 104 I 9.09 4.79 1.83 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.87 0.85 0.00 0.00 105 K 9.24 4.75 0.00 1.75 1.65 0.00 1.60 0.00 0.00 1.64 0.00 0.00 3.07 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.34 1.38 7.81 106 R 9.13 5.13 0.00 1.39 1.65 0.00 2.88 0.00 0.00 2.95 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.39 0.00 107 K 9.16 5.20 0.00 1.80 1.91 0.00 1.31 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.49 1.40 7.81 108 R 8.42 4.69 0.00 1.51 1.75 0.00 2.75 0.00 0.00 3.10 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.61 1.02 0.00 109 D 9.24 4.66 0.00 2.58 2.54 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 0.00 0.00 0.00 0.00 110 G 8.34 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 0.00 111 D 8.96 4.75 0.00 2.86 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 0.00 112 K 8.55 4.96 0.00 1.81 1.78 0.00 1.91 0.00 0.00 1.69 0.00 0.00 2.79 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.42 1.54 7.81 113 L 8.89 4.57 0.00 0.27 0.96 -0.19 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 114 V 9.21 4.61 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 0.95 0.00 0.00 1.04 0.00 0.00 115 V 9.32 4.66 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 0.77 0.00 0.00 0.84 0.00 0.00 116 E 9.19 5.05 0.00 1.87 1.79 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 2.20 2.23 0.00 117 C 9.09 5.05 0.00 1.65 1.85 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 0.00 118 V 8.99 5.03 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.94 0.00 0.00 119 M 9.38 4.86 0.00 2.21 2.05 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.55 0.00 120 K 9.81 3.65 0.00 1.91 1.83 0.00 1.85 0.00 0.00 1.68 0.00 0.00 2.74 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.33 1.32 7.81 121 G 8.30 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 V 7.67 4.13 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 1.06 0.00 0.00 0.97 0.00 0.00 123 T 8.64 5.20 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 124 S 9.06 5.02 0.00 4.07 3.38 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 0.00 125 T 8.60 4.85 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 1.18 0.00 0.00 126 R 9.21 4.91 0.00 1.61 1.54 0.00 2.21 0.00 0.00 2.69 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 1.23 0.00 127 V 8.40 4.81 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 0.94 0.00 0.00 0.91 0.00 0.00 128 Y 9.46 5.40 0.00 2.96 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 0.00 129 E 9.19 5.42 0.00 2.11 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 2.25 2.33 0.00 130 R 8.67 3.89 0.00 1.49 1.57 0.00 2.97 0.00 0.00 2.87 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.76 0.00 131 A 8.40 4.13 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