NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.1772 8.1727 122.0542 56.3180 34.1289 174.1346 2 V 4.6080 8.1987 127.0995 60.7016 32.1226 174.5180 3 F 4.4353 8.7766 127.2988 57.3662 40.2459 174.7091 4 E 4.2220 9.0356 119.5874 55.7005 31.1669 176.8379 5 R 3.2093 8.8265 120.6843 60.5954 30.3386 179.2055 6 C 4.3239 8.2531 115.5762 59.8588 36.8985 175.8063 7 E 3.8938 8.3152 121.2767 59.0315 29.1501 178.6357 8 L 3.6521 8.0038 120.3539 57.7472 42.1916 178.5695 9 A 3.9569 7.7946 120.7976 55.5133 18.2462 179.9424 10 R 3.9480 7.9148 116.0282 59.3430 29.9927 179.5657 11 T 3.8407 7.6038 115.6857 66.7432 68.5071 176.8990 12 L 3.8127 8.1162 121.2037 57.4120 41.5228 179.6460 13 K 3.9053 7.9317 119.6019 59.5124 31.9718 178.9676 14 R 3.9639 8.0270 118.0051 58.9380 29.9918 177.4266 15 L 4.4094 7.7541 116.9531 54.1233 41.6194 177.0627 16 G 3.8939 7.6685 106.5121 46.7279 0.0000 175.3896 17 M 3.8562 8.0528 122.4249 57.2225 32.1580 176.1175 18 D 4.5314 8.0119 118.4793 55.7036 41.5597 175.7466 19 G 3.9104 9.7561 115.5309 45.7958 0.0000 171.5583 20 Y 4.2433 8.3080 122.0669 57.9810 38.7374 175.6429 21 R 3.6348 8.9644 126.6815 57.2398 28.4837 176.6121 22 G 3.8703 8.0225 101.6980 44.9652 0.0000 173.8807 23 I 4.0510 7.6616 122.0092 59.5527 38.2383 176.0152 24 S 4.8539 8.3035 119.8965 57.4593 64.2557 174.8948 25 L 4.2764 8.8840 122.9011 58.3998 41.7759 179.2253 26 A 4.2768 8.1328 120.2177 54.8316 18.3316 179.0898 27 N 4.5525 8.1590 115.3328 55.9736 38.6826 177.6308 28 W 4.1827 8.0522 119.9400 60.1760 29.2347 178.3258 29 M 4.2566 8.3358 118.6798 58.5304 31.2880 178.0514 30 C 3.2335 7.9067 118.2868 58.9095 44.7670 175.3977 31 L 4.0231 8.2734 121.9338 58.1960 41.7955 178.5741 32 A 4.1624 8.5170 121.1160 55.3514 18.1278 179.4918 33 K 2.9314 8.1154 117.8400 58.9246 31.9368 178.6853 34 W 4.3319 7.6663 117.3157 58.4329 29.3387 178.2993 35 E 4.3624 8.3105 118.6693 58.5729 29.3699 177.6559 36 S 4.5149 8.0131 109.4377 56.5663 64.7449 174.5789 37 G 3.4222 7.8221 108.9571 46.9197 0.0000 173.7713 38 Y 3.6425 7.7057 113.5260 58.2562 35.6689 168.4503 39 N 5.2770 7.6242 120.3505 52.0108 39.4407 175.9665 40 T 4.0604 8.9870 117.7866 64.1452 68.9210 175.7170 41 R 4.3992 8.4877 119.7779 55.8531 30.7496 176.3045 42 A 4.4234 7.7963 121.5190 52.4109 19.5040 176.9653 43 T 5.5639 8.1232 108.9630 60.3158 72.4040 172.3746 44 N 5.0575 8.4360 119.1100 52.4393 43.1158 171.9034 45 Y 5.1477 8.6942 125.6702 56.2398 41.5174 173.9566 46 N 4.7740 8.8180 124.7366 51.1312 39.0641 175.3067 47 A 3.5754 8.0815 127.6322 54.6067 19.0459 179.1981 48 G 3.7451 8.1299 104.4441 48.2650 0.0000 174.0122 49 D 4.7393 7.6855 115.6048 52.1003 39.8205 175.9837 50 R 3.9857 8.0286 115.8234 56.9914 28.2167 176.0909 51 S 4.8622 7.6158 113.0144 57.1777 65.9216 172.9059 52 V 4.9580 8.6347 119.4229 61.3282 35.1743 173.6288 53 D 5.6193 9.1292 126.9916 53.2129 42.9362 174.9790 54 Y 5.0503 9.4190 121.4329 57.4398 41.4437 177.4542 55 G 4.2210 8.7402 111.3926 45.2292 0.0000 173.4867 56 I 3.8600 8.2327 116.8982 63.1567 37.7797 177.2127 57 F 4.7043 7.9013 115.0885 56.5113 39.6924 175.5289 58 Q 3.5969 7.8225 119.0732 57.1388 26.5396 173.8664 59 I 4.4499 8.3380 119.1852 60.9716 39.2607 176.7625 60 N 5.4665 9.3142 126.2606 53.4195 39.6863 175.8194 61 S 4.8242 9.0646 120.7319 60.5280 63.2443 175.5113 62 R 3.7806 8.8849 122.4404 58.5623 30.2826 177.7319 63 Y 4.2302 7.6828 114.2112 57.3819 40.8664 176.7866 64 W 4.8911 8.2147 118.9372 57.7874 31.3628 174.0273 65 C 5.6281 8.2033 112.4279 53.5006 45.9444 172.1091 66 N 5.1747 8.7330 119.1580 52.1273 39.8520 174.7979 67 D 4.6781 8.7755 124.2556 52.3032 40.1221 176.9226 68 G 3.9394 8.5642 106.7743 46.5103 0.0000 174.4649 69 K 4.5631 8.3967 116.7212 55.8733 33.4026 175.6673 70 T 4.5424 7.6460 116.8341 60.8340 70.1221 172.2702 71 P 4.2097 0.0000 0.0000 63.6460 31.8829 176.5338 72 G 3.7740 8.8057 107.6218 45.8350 0.0000 173.6232 73 A 3.9627 7.4259 122.7254 52.4891 18.6277 177.9008 74 V 4.3032 8.1053 123.0760 61.2087 34.4123 174.8613 75 N 4.9765 8.0480 119.4977 51.9931 38.8743 175.1425 76 A 4.0415 7.7819 123.2294 55.6250 19.0617 178.7501 77 C 4.4850 8.4526 111.5757 57.8864 41.1398 173.1660 78 H 4.1144 8.1936 116.9369 55.7497 26.3123 174.0957 79 L 4.6240 8.1696 117.8583 54.3564 43.9542 175.9351 80 S 4.7313 8.4055 116.4202 58.6042 63.6597 176.4148 81 C 4.0720 8.6072 121.3532 59.6554 40.3642 176.7273 82 S 3.9855 7.9266 115.5872 61.2909 62.3313 176.1203 83 A 4.0570 7.6327 123.2850 54.0440 18.3689 177.8519 84 L 4.4923 7.8584 116.6635 54.8440 41.8978 177.4761 85 L 5.5250 7.9249 117.0368 53.8678 42.1280 176.4025 86 Q 4.5692 7.7336 117.5078 54.5697 30.2176 175.7355 87 D 4.3965 8.5475 119.8705 57.1093 41.0963 176.6343 88 N 4.6056 8.0583 118.1813 53.1028 39.0890 174.6053 89 I 4.2564 8.4083 118.9550 60.8671 38.0441 176.8879 90 A 3.9337 8.5368 124.8924 55.9861 18.2060 179.9442 91 D 4.2963 8.1285 116.3541 57.4774 40.9446 178.8232 92 A 4.0654 7.9522 120.7045 55.1713 18.4005 179.6505 93 V 3.4102 8.1838 116.9290 66.1165 31.5349 178.1362 94 A 3.8462 8.0609 120.4880 55.1688 18.1446 178.7744 95 C 4.3374 8.2569 116.9085 59.5162 37.9751 175.6324 96 A 3.9686 8.4703 122.9491 55.0499 17.6656 179.7746 97 K 3.8846 7.9154 116.3857 59.0008 32.1550 179.3296 98 R 4.0855 7.3939 118.0349 59.0161 30.1281 178.1998 99 V 2.1815 7.3129 118.4642 65.8521 31.2719 177.9158 100 V 3.7473 7.4255 108.3434 62.3716 31.2295 177.2547 101 R 4.2458 7.8640 119.6492 57.6759 30.6776 177.0017 102 D 4.6005 7.9640 118.5504 53.3760 41.2695 175.5522 103 P 4.5596 0.0000 0.0000 63.9873 30.8470 176.4740 104 Q 4.2556 8.1479 121.3436 55.5576 31.0965 177.2760 105 G 3.7030 7.7918 106.0711 45.3773 0.0000 173.9361 106 I 3.8834 7.7651 118.1159 63.1467 38.1000 178.3872 107 R 4.4130 7.6256 116.9424 57.6370 30.1133 177.2045 108 A 3.9092 7.6846 121.7927 54.2489 18.4018 178.5757 109 W 4.6477 8.1233 117.0397 55.5641 30.4953 177.5220 110 V 3.7403 8.6227 123.6484 66.1948 31.2010 177.8666 111 A 4.0629 8.2720 119.8673 54.6214 18.1532 179.3580 112 W 3.9362 8.3283 126.7549 60.7821 30.7457 178.1245 113 R 3.7020 7.6725 115.2877 59.4476 29.6067 178.4753 114 N 4.3915 7.9145 114.7565 54.9335 38.7226 176.6848 115 R 4.0369 7.6939 116.7055 55.5584 32.1593 175.6496 116 C 4.5405 7.7759 115.5194 57.7231 42.4878 174.3509 117 Q 3.3596 6.4799 119.4997 57.3464 28.5680 176.0127 118 N 4.2657 8.7402 120.5595 53.6589 36.3127 173.7559 119 R 4.5117 7.3239 116.9150 53.8047 32.7089 175.1017 120 D 4.5316 8.4594 119.0255 54.5792 40.9924 176.0127 121 V 4.7919 8.3433 118.7430 61.1108 33.1190 177.8780 122 R 4.1432 8.2461 122.5583 59.0063 29.2590 178.7372 123 Q 3.9571 7.9374 117.3397 59.4417 28.1941 178.1520 124 Y 4.4677 7.2338 116.4305 59.9705 37.9039 177.0422 125 V 4.4511 7.4398 109.7895 60.5312 33.2625 175.4529 126 Q 3.9131 7.7928 120.0339 56.9592 28.7897 176.7227 127 G 3.8633 8.7506 113.4500 47.5522 0.0000 174.0182 128 C 4.8207 8.0417 112.7585 55.5570 42.3739 174.7082 129 G 3.7977 8.2314 107.0595 47.0288 0.0000 174.1840 130 V 4.0248 7.8120 117.6951 61.1428 32.3491 175.9256 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 K 8.17 4.18 0.00 1.95 1.66 0.00 1.30 0.00 0.00 1.08 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.96 1.18 7.81 2 V 8.20 4.61 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 0.97 0.00 0.00 0.95 0.00 0.00 3 F 8.78 4.44 0.00 2.81 2.85 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 4 E 9.04 4.22 0.00 2.12 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 2.24 2.30 0.00 5 R 8.83 3.21 0.00 1.95 1.94 0.00 3.31 0.00 0.00 3.49 7.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.81 0.00 6 C 8.25 4.32 0.00 3.34 3.12 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 0.00 7 E 8.32 3.89 0.00 2.17 2.21 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 2.55 2.37 0.00 8 L 8.00 3.65 0.00 1.44 1.35 -0.24 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 9 A 7.79 3.96 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 10 R 7.91 3.95 0.00 1.91 1.99 0.00 3.13 0.00 0.00 3.32 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.88 0.00 11 T 7.60 3.84 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 1.21 0.00 0.00 12 L 8.12 3.81 0.00 1.57 1.54 0.94 0.60 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 13 K 7.93 3.91 0.00 1.98 1.96 0.00 1.65 0.00 0.00 1.58 0.00 0.00 2.91 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.44 1.46 7.81 14 R 8.03 3.96 0.00 1.87 2.20 0.00 3.30 0.00 0.00 3.22 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.65 0.00 15 L 7.75 4.41 0.00 1.50 1.53 0.83 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 16 G 7.67 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 17 M 8.05 3.86 0.00 1.23 1.90 0.00 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.20 0.00 18 D 8.01 4.53 0.00 2.69 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 19 G 9.76 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 20 Y 8.31 4.24 0.00 3.40 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 21 R 8.96 3.63 0.00 1.54 1.83 0.00 2.97 0.00 0.00 3.07 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.50 0.00 22 G 8.02 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 0.00 0.00 0.00 23 I 7.66 4.05 1.77 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.48 -0.25 0.00 0.00 24 S 8.30 4.85 0.00 4.08 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 L 8.88 4.28 0.00 2.06 1.82 0.96 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 26 A 8.13 4.28 1.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 N 8.16 4.55 0.00 2.85 2.85 0.00 0.00 6.86 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 28 W 8.05 4.18 0.00 3.59 3.13 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 29 M 8.34 4.26 0.00 2.22 2.39 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 2.94 0.00 30 C 7.91 3.23 0.00 2.69 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 31 L 8.27 4.02 0.00 1.84 1.91 0.78 -0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 32 A 8.52 4.16 1.50 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 0.00 0.00 33 K 8.12 2.93 0.00 1.49 1.61 0.00 0.68 0.00 0.00 1.02 0.00 0.00 2.78 0.00 0.00 2.45 0.00 0.00 0.00 0.00 1.18 0.56 7.81 34 W 7.67 4.33 0.00 3.28 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 35 E 8.31 4.36 0.00 2.13 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 2.55 2.40 0.00 36 S 8.01 4.51 0.00 4.08 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 37 G 7.82 3.42 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 0.00 38 Y 7.71 3.64 0.00 3.23 2.99 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 39 N 7.62 5.28 0.00 2.77 2.86 0.00 0.00 6.97 7.10 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 40 T 8.99 4.06 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 1.42 0.00 0.00 41 R 8.49 4.40 0.00 1.94 2.02 0.00 3.18 0.00 0.00 3.24 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.66 0.00 42 A 7.80 4.42 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 43 T 8.12 5.56 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 0.99 0.00 0.00 44 N 8.44 5.06 0.00 2.97 2.82 0.00 0.00 6.39 7.56 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 45 Y 8.69 5.15 0.00 3.07 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 46 N 8.82 4.77 0.00 2.64 2.61 0.00 0.00 6.53 8.46 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 47 A 8.08 3.58 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 48 G 8.13 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 49 D 7.69 4.74 0.00 2.70 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 50 R 8.03 3.99 0.00 2.03 2.15 0.00 3.18 0.00 0.00 3.18 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.70 0.00 51 S 7.62 4.86 0.00 3.95 3.92 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 52 V 8.63 4.96 2.17 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 0.42 0.00 0.00 1.11 0.00 0.00 53 D 9.13 5.62 0.00 2.79 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 54 Y 9.42 5.05 0.00 2.93 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 55 G 8.74 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 56 I 8.23 3.86 1.64 0.00 0.00 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 1.65 0.20 0.00 0.00 57 F 7.90 4.70 0.00 3.15 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 58 Q 7.82 3.60 0.00 2.56 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.75 6.83 0.00 0.00 0.00 0.00 0.00 2.52 2.78 0.00 59 I 8.34 4.45 2.13 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.97 1.20 0.00 0.00 60 N 9.31 5.47 0.00 3.13 3.07 0.00 0.00 6.97 7.79 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 61 S 9.06 4.82 0.00 4.15 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 R 8.88 3.78 0.00 1.63 1.86 0.00 2.63 0.00 0.00 2.93 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.50 0.00 63 Y 7.68 4.23 0.00 1.51 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 0.00 0.00 0.00 64 W 8.21 4.89 0.00 3.55 3.29 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 65 C 8.20 5.63 0.00 3.04 3.20 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 66 N 8.73 5.17 0.00 2.86 2.70 0.00 0.00 7.09 7.92 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 67 D 8.78 4.68 0.00 2.88 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 68 G 8.56 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 0.00 0.00 0.00 69 K 8.40 4.56 0.00 1.79 1.81 0.00 1.69 0.00 0.00 1.75 0.00 0.00 3.09 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.38 1.69 7.81 70 T 7.65 4.54 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 71 P 0.00 4.21 0.00 2.01 1.97 0.00 3.81 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.09 0.00 72 G 8.81 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 73 A 7.43 3.96 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 V 8.11 4.30 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 0.91 0.00 0.00 75 N 8.05 4.98 0.00 2.67 2.60 0.00 0.00 6.84 8.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 A 7.78 4.04 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 77 C 8.45 4.48 0.00 3.46 3.25 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 78 H 8.19 4.11 0.00 3.25 3.36 0.00 5.87 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 79 L 8.17 4.62 0.00 1.84 1.73 0.97 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 80 S 8.41 4.73 0.00 3.88 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 81 C 8.61 4.07 0.00 2.04 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 S 7.93 3.99 0.00 4.07 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 83 A 7.63 4.06 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 84 L 7.86 4.49 0.00 1.88 1.78 1.03 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 85 L 7.92 5.53 0.00 1.83 1.72 1.13 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 86 Q 7.73 4.57 0.00 2.19 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.38 7.09 0.00 0.00 0.00 0.00 0.00 2.59 2.33 0.00 87 D 8.55 4.40 0.00 2.64 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 88 N 8.06 4.61 0.00 2.70 2.75 0.00 0.00 6.93 7.94 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 89 I 8.41 4.26 1.75 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.99 0.93 0.00 0.00 90 A 8.54 3.93 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 D 8.13 4.30 0.00 2.71 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 A 7.95 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 93 V 8.18 3.41 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 0.78 0.00 0.00 0.87 0.00 0.00 94 A 8.06 3.85 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 95 C 8.26 4.34 0.00 3.07 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 96 A 8.47 3.97 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 K 7.92 3.88 0.00 1.65 1.56 0.00 1.32 0.00 0.00 0.98 0.00 0.00 2.18 0.00 0.00 2.50 0.00 0.00 0.00 0.00 0.30 0.97 7.81 98 R 7.39 4.09 0.00 2.00 2.09 0.00 3.28 0.00 0.00 3.21 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.83 0.00 99 V 7.31 2.18 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 -0.32 0.00 0.00 0.05 0.00 0.00 100 V 7.43 3.75 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 1.00 0.00 0.00 1.33 0.00 0.00 101 R 7.86 4.25 0.00 2.07 2.03 0.00 3.25 0.00 0.00 3.31 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 2.04 0.00 102 D 7.96 4.60 0.00 3.09 2.62 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 0.00 103 P 0.00 4.56 0.00 2.16 2.14 0.00 3.75 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.95 0.00 104 Q 8.15 4.26 0.00 1.93 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.79 0.00 0.00 0.00 0.00 0.00 2.18 2.29 0.00 105 G 7.79 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 0.00 0.00 0.00 106 I 7.77 3.88 1.14 0.00 0.00 -0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.46 0.92 -0.67 0.00 0.00 107 R 7.63 4.41 0.00 2.01 2.08 0.00 3.36 0.00 0.00 3.27 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.60 0.00 108 A 7.68 3.91 0.79 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 0.00 0.00 109 W 8.12 4.65 0.00 3.61 3.15 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 0.00 110 V 8.62 3.74 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 1.09 0.00 0.00 0.99 0.00 0.00 111 A 8.27 4.06 1.50 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 0.00 0.00 112 W 8.33 3.94 0.00 3.48 3.55 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 0.00 0.00 0.00 0.00 113 R 7.67 3.70 0.00 2.16 1.98 0.00 3.35 0.00 0.00 3.54 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 2.05 0.00 114 N 7.91 4.39 0.00 2.56 2.70 0.00 0.00 6.87 7.31 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 0.00 115 R 7.69 4.04 0.00 0.67 0.66 0.00 2.73 0.00 0.00 2.25 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 1.21 0.00 116 C 7.78 4.54 0.00 1.65 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 0.00 117 Q 6.48 3.36 0.00 0.93 1.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.53 6.13 0.00 0.00 0.00 0.00 0.00 2.14 2.13 0.00 118 N 8.74 4.27 0.00 2.81 2.89 0.00 0.00 6.98 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 0.00 119 R 7.32 4.51 0.00 1.85 1.81 0.00 3.02 0.00 0.00 3.02 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.42 0.00 120 D 8.46 4.53 0.00 2.64 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 V 8.34 4.79 2.62 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 1.09 0.00 0.00 1.07 0.00 0.00 122 R 8.25 4.14 0.00 2.08 1.99 0.00 3.16 0.00 0.00 3.25 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.68 0.00 123 Q 7.94 3.96 0.00 2.05 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.90 0.00 0.00 0.00 0.00 0.00 1.55 1.38 0.00 124 Y 7.23 4.47 0.00 3.35 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 V 7.44 4.45 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 0.83 0.00 0.00 1.10 0.00 0.00 126 Q 7.79 3.91 0.00 2.05 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.68 0.00 0.00 0.00 0.00 0.00 2.54 2.44 0.00 127 G 8.75 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 0.00 128 C 8.04 4.82 0.00 2.95 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 G 8.23 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 0.00 130 V 7.81 4.02 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 0.96 0.00 0.00