NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 C 4.7259 8.3133 115.5848 55.5781 43.5824 172.2860 2 E 5.0676 8.4897 119.0829 54.7131 30.0177 172.7152 3 E 4.4673 8.7662 123.1730 56.3661 31.2146 174.5436 4 P 3.5922 0.0000 0.0000 61.4738 31.7137 174.0695 5 P 4.1940 0.0000 0.0000 63.0276 31.7321 175.5578 6 T 4.5409 7.5498 108.4499 59.8438 70.9664 173.3385 7 F 4.8450 8.2133 121.2456 55.4529 42.7252 174.8338 8 E 4.0751 8.9268 122.4315 58.2921 29.9875 177.0818 9 A 3.4476 7.8115 118.9696 51.6866 21.4031 176.3157 10 M 5.6817 7.8200 113.5864 53.0871 34.8174 175.4481 11 E 4.8595 8.5489 120.8589 54.0958 32.9564 175.4076 12 L 3.5374 8.7022 126.0146 55.2624 43.0082 175.8656 13 I 4.1867 8.1342 125.4885 60.8724 38.4767 176.8329 14 G 4.0666 8.7909 111.2503 45.3295 0.0000 172.9950 15 K 4.2819 8.1534 118.5437 54.4924 33.0654 175.6554 16 P 4.3656 0.0000 0.0000 63.1528 31.7502 176.2056 17 K 4.4900 8.5092 122.1569 54.0838 33.9570 175.0217 18 P 5.2817 0.0000 0.0000 64.5950 31.8906 175.5836 19 Y 5.0994 7.5184 117.8687 55.7168 41.7602 174.1624 20 Y 4.7249 7.9236 122.8931 56.0055 41.3767 175.5527 21 E 4.1473 9.4854 123.0423 55.5703 31.4311 176.3042 22 I 3.7524 8.0327 122.5310 62.6527 37.5451 176.9565 23 G 3.9476 8.7316 113.8760 44.9090 0.0000 173.2020 24 E 4.3475 7.8353 119.7652 55.9666 30.9009 175.6091 25 R 5.3320 8.6746 123.5364 54.7213 32.6168 174.9917 26 V 4.4391 8.8359 119.4288 59.6291 34.6070 174.4266 27 D 5.3810 8.3869 122.8187 52.8420 44.4270 174.6808 28 Y 5.2498 8.4542 118.9474 56.0893 41.3248 174.4996 29 K 4.7014 9.0982 118.7724 55.4096 36.7584 174.6501 30 C 4.9673 8.6235 118.3921 55.9602 41.9400 174.1997 31 K 4.2213 9.4522 123.7885 56.8461 32.5399 178.2763 32 K 4.1789 8.3075 118.3794 58.9864 34.2906 176.0024 33 G 3.9693 8.0109 107.2505 46.0229 0.0000 172.0914 34 Y 4.9662 8.0101 116.8249 55.8974 40.7439 175.2184 35 F 4.8946 10.1626 121.9754 55.8839 42.1610 174.1777 36 Y 4.9560 8.8336 124.2288 57.1726 39.4057 174.3331 37 I 4.0729 7.7168 128.3439 58.2838 38.9275 174.3838 38 P 4.3177 0.0000 0.0000 62.1797 31.7584 174.2914 39 P 4.9024 0.0000 0.0000 62.2507 32.4948 174.6067 40 L 3.6387 7.7606 117.8275 54.0078 42.0333 176.4914 41 A 4.0457 8.7668 126.2166 53.3094 19.0979 178.1473 42 T 4.5468 8.2184 115.0742 60.0184 68.6924 171.4501 43 H 5.2991 7.3829 115.2004 56.6790 31.9830 173.6358 44 T 4.4872 8.5501 111.2691 61.6724 71.4208 171.6180 45 I 5.9534 8.3070 124.5850 58.7860 42.1723 174.4488 46 C 4.6268 8.3604 122.7827 55.0231 46.5231 173.0736 47 D 4.9167 8.4389 126.5897 51.6497 41.2755 177.4265 48 R 3.7620 8.5488 117.0725 59.0964 30.2247 177.0317 49 N 4.7307 7.8974 114.8869 52.8149 38.7845 174.2923 50 H 3.8504 7.8007 111.3565 56.4227 27.2662 174.3543 51 T 4.5957 7.2358 105.7197 59.4113 71.6133 172.5368 52 W 5.0770 8.3170 121.3348 55.5082 30.5764 176.5984 53 L 4.3216 8.3790 122.6363 53.9973 41.7759 175.5499 54 P 4.6427 0.0000 0.0000 63.3894 31.9760 175.9889 55 V 4.3942 7.9911 119.8923 60.8274 34.0340 173.0074 56 S 4.4465 7.8518 114.7910 56.0920 65.9382 174.7408 57 D 3.9574 7.9693 121.2110 55.4322 39.3420 177.9135 58 D 4.1267 7.3472 115.5724 55.6542 40.5801 176.5072 59 A 4.7561 8.0675 120.7093 51.9926 20.8295 176.1071 60 C 5.5344 8.1624 113.2525 55.6372 39.6363 173.3764 61 Y 5.4243 9.6644 122.5363 56.1171 39.2378 175.4081 62 R 4.9249 8.4357 117.7491 56.1553 30.1730 175.4986 63 E 4.4982 9.0909 117.6157 56.0904 31.2311 175.4877 64 T 5.1905 8.4413 115.0722 60.1815 71.1458 173.7285 65 C 5.3902 9.2584 123.8808 53.9505 41.4732 171.8908 66 P 4.2800 0.0000 0.0000 63.6236 31.0213 174.8439 67 Y 3.9535 8.1475 122.8535 56.9874 39.6905 176.1050 68 I 3.9577 7.4743 126.1778 58.3699 38.0554 174.5106 69 R 3.3724 7.8499 123.7674 56.2259 30.1715 174.7755 70 D 4.3897 8.8039 124.7403 53.7622 40.6852 173.4510 71 P 4.4006 0.0000 0.0000 62.1087 31.0793 176.3861 72 L 3.6889 8.5986 120.4015 57.6445 40.3626 175.7909 73 N 4.2645 9.1545 118.8678 51.3100 35.3472 172.5550 74 G 4.3270 7.3566 109.3192 44.3037 0.0000 169.5584 75 Q 5.5344 8.7924 121.4093 53.4991 31.3215 174.5036 76 A 4.8299 8.8242 124.5473 50.1034 20.8960 176.2937 77 V 4.4901 7.5586 120.4865 59.6605 35.6086 172.0755 78 P 4.7571 0.0000 0.0000 62.1979 32.5127 174.9041 79 A 4.3380 8.1431 128.4969 52.9224 19.1009 177.1740 80 N 4.5861 9.4586 119.4299 52.3449 36.4197 175.0154 81 G 4.1904 7.5550 105.7758 46.1408 0.0000 173.2633 82 T 4.0495 7.2462 109.7411 61.6890 69.9431 171.6244 83 Y 4.5808 8.0889 122.4625 58.2685 39.4390 175.0564 84 E 4.6227 7.9112 121.4855 55.9979 30.3140 176.7317 85 F 4.1281 8.7768 120.9009 57.8250 38.5792 175.9434 86 G 3.9979 9.2728 106.8699 46.2072 0.0000 173.0206 87 Y 5.7053 7.5019 118.1724 55.8898 41.6346 174.2462 88 Q 5.2951 8.4221 116.0097 56.2951 32.7193 173.0824 89 M 4.7725 8.7361 118.7290 54.0927 36.1035 173.5381 90 H 5.3161 8.3729 118.1908 54.2814 34.0761 172.8008 91 F 4.7310 8.2950 117.5967 56.6973 42.7708 174.6995 92 I 4.4030 8.9183 125.7594 59.8335 39.2802 173.8538 93 C 4.6653 8.7641 124.9793 57.1704 41.1445 171.4182 94 N 4.4825 9.0758 120.0042 53.0468 39.0521 175.5624 95 E 3.7949 8.7599 120.9086 60.5606 32.7250 180.6793 96 G 4.1662 8.3800 104.0533 48.0273 0.0000 174.1444 97 Y 4.7178 8.8087 122.9701 57.4878 39.2452 174.1421 98 Y 4.5259 8.9124 127.0229 57.0651 40.0803 174.1196 99 L 4.4687 8.5750 119.7290 53.8163 42.5214 176.9744 100 I 4.5288 7.4601 126.9460 60.9284 38.0982 176.2345 101 G 3.9698 7.2229 108.6172 46.1633 0.0000 173.6336 102 E 4.2064 8.8279 120.4978 56.5337 30.0567 176.0389 103 E 4.4885 8.7801 121.8411 57.3806 31.5555 175.5450 104 I 5.0697 7.6381 118.6767 58.5707 39.8839 175.4288 105 L 4.7280 8.2280 125.0691 53.1854 45.4094 174.9925 106 Y 4.9634 8.6147 122.9836 57.4252 39.4436 174.1733 107 C 4.4287 8.9721 125.4864 55.9294 42.7337 172.1623 108 E 5.1764 8.9112 124.0490 54.3598 33.9142 174.9348 109 L 4.1724 8.3033 123.7849 54.8728 43.0845 175.9809 110 K 4.5693 8.2528 123.3343 55.3638 36.6953 180.0636 111 G 3.9124 8.0398 112.0370 46.6028 0.0000 174.8203 112 S 4.7143 8.5153 115.0001 56.2854 62.2452 173.7986 113 V 4.2454 8.5214 118.5964 59.8754 34.7872 172.9966 114 A 4.1655 8.7412 126.6297 53.0100 18.0278 176.3700 115 I 4.7689 8.1645 123.0087 60.8483 40.2435 175.2917 116 W 5.4334 8.5260 122.8857 54.7566 32.5025 176.9478 117 S 4.0131 8.8990 113.0963 60.1759 61.7927 176.1215 118 G 4.4244 7.5113 114.6850 44.4697 0.0000 173.2025 119 K 4.2239 7.3018 115.6532 54.1404 36.5151 173.6723 120 P 4.0366 0.0000 0.0000 61.7745 31.8891 173.6997 121 P 4.5164 0.0000 0.0000 62.0469 33.3320 174.3031 122 I 4.6312 7.7975 118.5596 60.0315 41.9099 174.9972 123 C 5.1831 7.9716 117.1685 55.3413 43.4689 174.4142 124 E 4.2690 8.1719 118.2747 54.2608 30.8297 175.3804 125 K 3.4415 8.3413 125.9236 55.5432 32.6655 177.2213 126 V 3.9532 6.1306 124.9134 62.0426 31.2395 174.4402 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 8.31 4.73 0.00 2.72 3.17 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 2 E 8.49 5.07 0.00 2.24 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 2.36 2.46 0.00 3 E 8.77 4.47 0.00 2.16 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 2.46 2.69 0.00 4 P 0.00 3.59 0.00 1.61 0.49 0.00 3.85 0.00 0.00 3.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.35 0.00 5 P 0.00 4.19 0.00 1.61 1.67 0.00 3.44 0.00 0.00 3.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.05 0.00 6 T 7.55 4.54 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 1.16 0.00 0.00 7 F 8.21 4.85 0.00 3.06 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 8 E 8.93 4.08 0.00 1.96 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 2.38 2.36 0.00 9 A 7.81 3.45 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 M 7.82 5.68 0.00 1.77 1.65 0.00 0.00 0.00 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.21 0.00 11 E 8.55 4.86 0.00 1.91 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 2.30 2.28 0.00 12 L 8.70 3.54 0.00 1.11 1.36 0.30 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 13 I 8.13 4.19 1.84 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.74 0.86 0.00 0.00 14 G 8.79 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 K 8.15 4.28 0.00 1.75 1.74 0.00 1.77 0.00 0.00 1.70 0.00 0.00 2.81 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.41 1.44 7.81 16 P 0.00 4.37 0.00 2.06 2.05 0.00 3.65 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.09 0.00 17 K 8.51 4.49 0.00 0.79 1.29 0.00 1.08 0.00 0.00 1.58 0.00 0.00 3.06 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.26 1.23 7.81 18 P 0.00 5.28 0.00 2.25 2.30 0.00 3.69 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.90 0.00 19 Y 7.52 5.10 0.00 2.88 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 20 Y 7.92 4.72 0.00 2.78 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 21 E 9.49 4.15 0.00 1.83 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 2.31 2.49 0.00 22 I 8.03 3.75 1.78 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.09 0.84 0.00 0.00 23 G 8.73 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 24 E 7.84 4.35 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 2.40 2.34 0.00 25 R 8.67 5.33 0.00 1.86 1.84 0.00 3.24 0.00 0.00 3.26 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.81 0.00 26 V 8.84 4.44 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 0.06 0.00 0.00 0.43 0.00 0.00 27 D 8.39 5.38 0.00 2.57 2.48 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 28 Y 8.45 5.25 0.00 2.62 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 K 9.10 4.70 0.00 1.71 1.82 0.00 1.28 0.00 0.00 1.62 0.00 0.00 2.87 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.52 1.39 7.81 30 C 8.62 4.97 0.00 2.97 3.19 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 31 K 9.45 4.22 0.00 1.65 1.82 0.00 1.52 0.00 0.00 1.64 0.00 0.00 2.78 0.00 0.00 3.27 0.00 0.00 0.00 0.00 1.58 1.29 7.81 32 K 8.31 4.18 0.00 1.75 1.70 0.00 1.65 0.00 0.00 1.71 0.00 0.00 3.07 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.43 1.56 7.81 33 G 8.01 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 0.00 0.00 0.00 34 Y 8.01 4.97 0.00 3.09 2.95 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 35 F 10.16 4.89 0.00 3.06 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 36 Y 8.83 4.96 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 37 I 7.72 4.07 1.55 0.00 0.00 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 -0.36 0.30 0.00 0.00 38 P 0.00 4.32 0.00 2.10 1.97 0.00 3.34 0.00 0.00 3.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.81 0.00 39 P 0.00 4.90 0.00 2.19 2.15 0.00 3.81 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.94 0.00 40 L 7.76 3.64 0.00 1.71 1.71 0.92 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 41 A 8.77 4.05 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 42 T 8.22 4.55 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 1.28 0.00 0.00 43 H 7.38 5.30 0.00 3.37 3.29 0.00 5.56 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 T 8.55 4.49 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 1.24 0.00 0.00 45 I 8.31 5.95 1.91 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.86 0.93 0.00 0.00 46 C 8.36 4.63 0.00 2.17 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 47 D 8.44 4.92 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 48 R 8.55 3.76 0.00 1.78 2.05 0.00 3.17 0.00 0.00 3.14 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.63 0.00 49 N 7.90 4.73 0.00 2.85 2.89 0.00 0.00 7.27 7.77 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 50 H 7.80 3.85 0.00 3.25 3.23 0.00 5.65 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 T 7.24 4.60 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 1.28 0.00 0.00 52 W 8.32 5.08 0.00 3.23 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 53 L 8.38 4.32 0.00 1.61 1.64 0.94 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 54 P 0.00 4.64 0.00 1.95 2.03 0.00 3.75 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.14 0.00 55 V 7.99 4.39 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 0.59 0.00 0.00 0.75 0.00 0.00 56 S 7.85 4.45 0.00 3.83 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 57 D 7.97 3.96 0.00 2.70 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 58 D 7.35 4.13 0.00 2.63 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 59 A 8.07 4.76 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 60 C 8.16 5.53 0.00 2.89 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 61 Y 9.66 5.42 0.00 2.97 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 62 R 8.44 4.92 0.00 1.83 1.00 0.00 2.38 0.00 0.00 2.93 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.77 0.00 63 E 9.09 4.50 0.00 2.50 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.43 0.00 64 T 8.44 5.19 4.31 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 1.35 0.00 0.00 65 C 9.26 5.39 0.00 2.93 2.48 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 66 P 0.00 4.28 0.00 2.33 2.24 0.00 4.24 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.16 0.00 67 Y 8.15 3.95 0.00 2.62 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 68 I 7.47 3.96 1.62 0.00 0.00 0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.47 0.94 0.00 0.00 69 R 7.85 3.37 0.00 1.58 1.75 0.00 3.27 0.00 0.00 3.11 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.68 0.00 70 D 8.80 4.39 0.00 2.75 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 71 P 0.00 4.40 0.00 2.02 1.96 0.00 3.90 0.00 0.00 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.95 0.00 72 L 8.60 3.69 0.00 1.82 1.82 0.87 0.44 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 73 N 9.15 4.26 0.00 2.80 2.84 0.00 0.00 7.07 7.65 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 74 G 7.36 4.33 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 0.00 75 Q 8.79 5.53 0.00 1.99 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.71 0.00 0.00 0.00 0.00 0.00 2.31 2.15 0.00 76 A 8.82 4.83 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 77 V 7.56 4.49 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 0.62 0.00 0.00 0.88 0.00 0.00 78 P 0.00 4.76 0.00 2.11 1.95 0.00 3.63 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.91 0.00 79 A 8.14 4.34 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 80 N 9.46 4.59 0.00 3.05 3.80 0.00 0.00 7.09 7.60 0.00 0.00 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 G 7.55 4.19 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 0.00 82 T 7.25 4.05 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.00 0.00 83 Y 8.09 4.58 0.00 3.11 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 84 E 7.91 4.62 0.00 1.22 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 2.15 2.06 0.00 85 F 8.78 4.13 0.00 2.91 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 86 G 9.27 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 87 Y 7.50 5.71 0.00 3.18 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 88 Q 8.42 5.30 0.00 2.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.02 6.64 0.00 0.00 0.00 0.00 0.00 2.41 2.54 0.00 89 M 8.74 4.77 0.00 1.87 1.53 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.38 0.00 90 H 8.37 5.32 0.00 3.01 2.99 0.00 5.66 0.00 0.00 0.00 0.00 6.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 F 8.30 4.73 0.00 2.79 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 92 I 8.92 4.40 1.88 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 1.23 0.83 0.95 0.00 0.00 93 C 8.76 4.67 0.00 3.09 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 N 9.08 4.48 0.00 2.69 2.59 0.00 0.00 7.09 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 95 E 8.76 3.79 0.00 1.98 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 2.35 2.32 0.00 96 G 8.38 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 97 Y 8.81 4.72 0.00 2.89 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 98 Y 8.91 4.53 0.00 3.11 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 L 8.58 4.47 0.00 1.75 1.69 0.97 0.80 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 0.00 100 I 7.46 4.53 1.76 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.06 0.94 0.00 0.00 101 G 7.22 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 0.00 0.00 0.00 102 E 8.83 4.21 0.00 2.00 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 2.34 2.33 0.00 103 E 8.78 4.49 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 2.36 2.52 0.00 104 I 7.64 5.07 1.75 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 1.49 1.76 0.52 0.00 0.00 105 L 8.23 4.73 0.00 1.63 1.82 0.92 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 106 Y 8.61 4.96 0.00 3.26 2.94 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 0.00 107 C 8.97 4.43 0.00 1.23 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 0.00 0.00 0.00 0.00 108 E 8.91 5.18 0.00 1.89 1.74 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 2.24 2.46 0.00 109 L 8.30 4.17 0.00 0.98 1.24 0.77 -0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 110 K 8.25 4.57 0.00 1.81 1.53 0.00 1.68 0.00 0.00 1.66 0.00 0.00 2.99 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.33 1.40 7.81 111 G 8.04 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 0.00 112 S 8.52 4.71 0.00 3.77 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 0.00 113 V 8.52 4.25 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 0.67 0.00 0.00 0.94 0.00 0.00 114 A 8.74 4.17 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 0.00 115 I 8.16 4.77 1.89 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.92 1.01 0.00 0.00 116 W 8.53 5.43 0.00 3.30 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 0.00 117 S 8.90 4.01 0.00 4.10 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 0.00 118 G 7.51 4.42 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 0.00 119 K 7.30 4.22 0.00 1.67 1.60 0.00 1.72 0.00 0.00 1.73 0.00 0.00 3.05 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.26 1.25 7.81 120 P 0.00 4.04 0.00 1.59 1.78 0.00 3.63 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.76 0.00 121 P 0.00 4.52 0.00 1.85 2.06 0.00 2.20 0.00 0.00 3.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 1.66 0.00 122 I 7.80 4.63 1.75 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 1.37 0.81 0.00 0.00 123 C 7.97 5.18 0.00 3.06 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 0.00 124 E 8.17 4.27 0.00 1.16 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 1.88 2.00 0.00 125 K 8.34 3.44 0.00 1.51 1.55 0.00 1.14 0.00 0.00 1.59 0.00 0.00 2.89 0.00 0.00 2.67 0.00 0.00 0.00 0.00 1.26 1.19 7.81 126 V 6.13 3.95 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 1.12 0.00 0.00 0.99 0.00 0.00