NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.3292 8.2493 123.5822 52.2904 21.3873 176.7946 2 T 3.8429 8.3042 104.5862 60.0959 69.9891 170.3051 3 V 3.5584 8.7457 123.2041 66.4532 32.5258 178.8466 4 N 4.3856 8.3339 116.0918 56.9615 38.4428 176.6125 5 Q 4.0694 8.0637 119.1329 58.9743 28.9638 178.3501 6 L 4.1842 7.9052 119.3136 57.7482 41.3680 179.7344 7 V 3.6023 8.0700 118.1147 66.4534 31.5739 177.1135 8 R 4.2010 7.7200 116.9570 55.3401 29.9981 175.9808 9 K 4.4208 7.5008 132.6157 53.7547 33.2507 176.0106 10 P 5.0127 0.0000 0.0000 60.9762 30.2797 178.7084 11 R 4.3731 8.3956 126.7315 55.1187 32.4647 174.4866 12 A 4.1957 8.5608 127.0105 51.3569 19.1336 176.1557 13 R 3.8563 8.6817 124.1945 56.4437 29.8453 178.3872 14 K 4.1433 7.3926 121.2178 57.7430 35.5548 175.5117 15 V 4.3516 7.9924 115.1359 60.6833 31.0338 174.5219 16 A 4.1753 7.8041 124.2616 52.4584 19.3080 176.8993 17 K 4.6971 8.1669 117.6630 54.5041 36.0297 175.6948 18 S 4.6432 8.3492 114.6722 57.0886 63.1868 173.8456 19 N 4.7013 8.7843 123.4308 54.7067 38.4093 176.2147 20 V 4.8936 7.5507 112.1060 59.1253 32.8191 173.9616 21 P 4.6225 0.0000 0.0000 62.5895 29.1372 176.9399 22 A 3.9376 7.7373 122.1574 51.6828 19.5035 176.3805 23 L 3.3806 7.9459 123.2761 55.0794 42.3694 174.3534 24 E 3.5312 9.2516 117.1147 56.2764 28.3520 174.5140 25 A 3.6934 7.7269 120.3801 53.3381 15.4916 175.6834 26 C 4.8883 7.0865 116.4698 54.6007 33.0005 174.2229 27 P 4.3679 0.0000 0.0000 65.7166 31.0306 175.8668 28 Q 4.7095 7.0064 111.4863 55.1809 31.7187 173.5433 29 K 4.5972 8.7763 120.0342 54.8487 36.3835 175.1150 30 R 4.9609 8.2478 124.6773 54.6094 33.0915 174.5457 31 G 4.4366 7.7400 108.4869 45.5233 0.0000 176.0429 32 V 4.0940 8.7397 125.5412 62.7736 29.5138 178.7315 33 C 6.3000 8.6596 116.7136 59.4291 29.9914 172.6822 34 T 4.0671 8.3692 121.5473 66.7376 68.9364 173.9176 35 R 4.2749 7.3694 116.9261 55.0333 34.6085 174.7504 36 V 4.6557 7.4514 111.2328 61.2746 31.4927 174.8966 37 Y 4.9738 7.6554 119.3981 58.0321 40.8393 175.6948 38 T 5.1341 8.7519 109.3337 60.5052 71.5276 173.4424 39 T 4.7390 8.6751 115.6793 59.9858 72.0303 173.0743 40 T 4.6097 8.1591 111.5464 59.1977 70.3571 172.9426 41 P 5.1627 0.0000 0.0000 61.9124 32.6184 175.0090 42 K 4.3167 8.1242 117.2312 56.6974 34.3429 176.0647 43 K 3.5026 8.5310 117.7384 57.5992 31.4528 172.1170 44 P 4.2871 0.0000 0.0000 66.3323 31.1608 176.4734 45 N 4.1915 8.1552 115.3460 54.2232 38.6247 175.1540 46 S 4.5105 8.4177 118.4153 56.2120 63.8119 172.6572 47 A 4.8845 7.8615 125.7724 50.3568 22.5641 175.8857 48 L 4.7602 8.1046 111.7816 52.7923 41.2396 176.7461 49 R 3.9973 7.6677 118.7181 57.0691 32.1352 177.2797 50 K 4.6606 9.0972 122.1297 55.3106 33.7761 175.7334 51 V 5.0691 7.7600 126.1155 61.7892 34.6115 174.3222 52 C 4.8636 8.0924 110.5249 57.5756 33.1082 173.9015 53 R 4.4482 8.4698 123.9945 56.2932 30.8313 176.1774 54 V 4.7198 8.6910 115.1431 59.8204 36.3139 174.9736 55 R 4.8039 8.5319 125.0353 54.2099 29.9815 175.1955 56 L 5.3362 8.6327 124.9474 53.9800 42.8025 178.5080 57 T 3.9949 8.6535 110.2819 63.9634 68.9538 174.7792 58 N 4.7100 8.1158 118.6500 52.1427 38.0943 175.0775 59 G 3.9679 7.8871 104.7147 47.3689 0.0000 174.2428 60 F 4.7526 7.7757 116.7610 55.8190 42.8116 175.9210 61 E 4.6680 8.5961 125.7929 54.9468 28.4390 175.4590 62 V 4.6603 7.9237 119.1804 60.6107 33.8556 175.1762 63 T 4.9578 8.3328 112.9909 60.1069 71.2481 173.1173 64 S 5.2275 8.7990 119.3246 56.7086 66.0685 171.8812 65 Y 5.1190 8.5798 124.4318 56.5682 40.6709 174.4604 66 I 4.2586 7.0168 124.7383 59.1467 38.8308 175.7275 67 G 3.9295 8.3558 113.5671 44.5785 0.0000 175.7454 68 G 3.3454 8.3443 108.0691 45.9945 0.0000 172.8265 69 E 4.5993 8.1810 120.4501 55.9642 33.5669 174.9796 70 G 3.8220 8.9119 108.4391 46.2896 0.0000 173.4141 71 H 4.6026 8.2229 114.7800 55.2028 30.6098 176.6353 72 N 4.6306 8.0643 116.5885 51.4840 36.8645 174.1944 73 L 3.8246 9.0871 120.7810 54.0542 43.3440 171.0661 74 Q 4.4490 9.3118 119.3245 56.1996 28.7325 177.4523 75 E 4.4931 9.2759 126.4299 57.6366 31.9254 175.8033 76 H 4.9527 8.4666 115.6606 54.5785 28.2444 175.0183 77 S 4.5466 7.8137 113.4912 56.2427 64.3654 175.0594 78 V 3.9080 8.6894 125.8811 63.7493 32.2808 174.6023 79 I 4.8606 8.6245 123.1120 58.8059 41.4739 173.6557 80 L 4.9711 8.1036 122.4618 53.4768 45.0121 175.7854 81 I 4.3415 9.4206 129.3609 61.5649 37.7361 176.8458 82 R 3.9676 9.7914 127.9971 56.1710 31.4227 174.7980 83 G 3.7358 8.7397 110.5468 46.1632 0.0000 173.1077 84 G 4.4823 8.2299 117.5197 44.8810 0.0000 172.3193 85 R 4.0285 8.5634 125.3616 56.0947 30.8461 176.9132 86 V 4.2211 7.9176 117.3809 60.9595 33.1583 175.5251 87 K 4.7418 8.5460 130.8132 54.1117 29.8073 175.0733 88 D 4.8516 6.9893 129.7489 53.7744 43.1932 175.3226 89 L 4.4911 7.2015 119.5897 52.1073 42.7941 174.1612 90 P 4.6396 0.0000 0.0000 62.8847 29.4861 174.7165 91 G 3.5678 8.0493 122.1921 46.1530 0.0000 171.2924 92 V 4.0028 7.3928 122.2365 62.4751 31.3898 175.9257 93 R 4.5019 7.7950 124.9303 56.0688 32.7439 174.8911 94 Y 5.6133 7.5821 115.5531 56.5180 42.7008 173.3284 95 H 5.8322 8.9620 115.8926 54.5701 33.9664 172.7522 96 T 5.0443 8.1681 109.4626 59.8042 70.9306 172.9694 97 V 3.7542 8.4181 121.2454 60.8819 32.3643 176.8454 98 R 4.5978 7.7996 129.2010 53.6417 27.7163 176.2325 99 G 4.1572 7.6612 115.3504 45.8205 0.0000 171.6337 100 A 4.2696 7.4503 123.4774 52.0149 21.0406 178.6097 101 L 3.8606 7.4769 115.2341 54.8284 43.2321 178.3312 102 D 4.4374 9.2836 130.7769 58.0411 40.7229 176.3786 103 C 4.3726 7.5479 114.5169 57.9227 27.6173 174.6263 104 S 4.5692 8.1572 124.5571 58.4855 63.2511 173.5905 105 G 4.8275 8.1576 105.4684 43.3421 0.0000 172.9221 106 V 3.7352 7.8489 121.5740 63.5467 31.7226 175.3336 107 K 4.4779 8.6213 127.1508 56.1369 34.5511 176.6566 108 D 4.6827 8.9019 122.5137 54.4721 38.5099 174.6059 109 R 4.3564 7.2582 118.5025 55.6146 30.9677 176.3662 110 K 4.4963 8.4464 119.2310 57.5539 36.2071 177.8348 111 Q 3.9835 8.6208 117.4677 57.5857 27.9894 177.8618 112 A 4.4508 8.9851 121.2356 51.6234 17.8269 180.1125 113 R 3.9828 8.1349 125.0837 59.6814 30.9842 179.6298 114 S 3.9260 8.3419 110.4391 61.2828 62.2434 174.9379 115 K 3.9446 7.2495 116.7780 57.1483 32.5875 176.0999 116 Y 3.3693 7.7467 116.8134 60.0859 35.0977 170.6609 117 G 3.9012 8.0435 101.8338 46.3989 0.0000 174.1445 118 V 4.4994 7.7008 127.9873 60.7855 34.3745 174.6943 119 K 4.1416 8.5553 127.0028 55.8790 32.6317 176.8395 120 R 4.0352 8.4862 121.9281 56.0912 31.2338 176.4724 121 P 4.7348 0.0000 0.0000 61.5321 30.5903 179.0149 122 K 4.1711 8.1490 116.9086 56.7571 32.7240 175.4515 123 A 4.0967 8.2769 127.0213 53.0214 18.8667 175.8820 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 A 8.25 4.33 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 2 T 8.30 3.84 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 3 V 8.75 3.56 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 0.92 0.00 0.00 0.93 0.00 0.00 4 N 8.33 4.39 0.00 2.87 2.83 0.00 0.00 7.22 7.12 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 5 Q 8.06 4.07 0.00 2.31 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.55 0.00 0.00 0.00 0.00 0.00 2.37 2.39 0.00 6 L 7.91 4.18 0.00 1.68 1.73 0.92 0.81 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 7 V 8.07 3.60 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 0.79 0.00 0.00 0.96 0.00 0.00 8 R 7.72 4.20 0.00 2.11 1.76 0.00 3.33 0.00 0.00 3.15 8.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.67 0.00 9 K 7.50 4.42 0.00 1.76 1.72 0.00 1.89 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.36 1.38 7.81 10 P 0.00 5.01 0.00 2.07 1.76 0.00 3.72 0.00 0.00 3.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.25 0.00 11 R 8.40 4.37 0.00 1.73 1.81 0.00 3.20 0.00 0.00 3.23 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.59 0.00 12 A 8.56 4.20 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 13 R 8.68 3.86 0.00 1.79 1.79 0.00 3.34 0.00 0.00 3.28 7.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.69 0.00 14 K 7.39 4.14 0.00 1.84 1.80 0.00 1.53 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.25 1.16 7.81 15 V 7.99 4.35 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 0.85 0.00 0.00 0.94 0.00 0.00 16 A 7.80 4.18 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 17 K 8.17 4.70 0.00 1.72 1.71 0.00 1.75 0.00 0.00 1.64 0.00 0.00 2.95 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.34 1.56 7.81 18 S 8.35 4.64 0.00 3.84 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 N 8.78 4.70 0.00 2.77 2.87 0.00 0.00 6.85 7.68 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 20 V 7.55 4.89 2.23 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 1.00 0.00 0.00 0.98 0.00 0.00 21 P 0.00 4.62 0.00 2.44 2.24 0.00 4.04 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.13 0.00 22 A 7.74 3.94 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 L 7.95 3.38 0.00 1.40 1.30 0.93 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 24 E 9.25 3.53 0.00 2.04 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.21 0.00 25 A 7.73 3.69 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 26 C 7.09 4.89 0.00 3.01 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 P 0.00 4.37 0.00 2.16 2.19 0.00 3.75 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 1.94 1.92 0.00 28 Q 7.01 4.71 0.00 2.03 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.57 6.73 0.00 0.00 0.00 0.00 0.00 2.22 2.40 0.00 29 K 8.78 4.60 0.00 1.68 1.51 0.00 1.37 0.00 0.00 1.48 0.00 0.00 2.75 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.14 1.30 7.81 30 R 8.25 4.96 0.00 1.90 1.76 0.00 3.31 0.00 0.00 3.33 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.78 0.00 31 G 7.74 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 32 V 8.74 4.09 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 0.88 0.00 0.00 0.95 0.00 0.00 33 C 8.66 6.30 0.00 3.00 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 34 T 8.37 4.07 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 35 R 7.37 4.27 0.00 1.58 1.49 0.00 2.95 0.00 0.00 2.93 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.20 0.00 36 V 7.45 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 0.80 0.00 0.00 0.91 0.00 0.00 37 Y 7.66 4.97 0.00 2.99 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 38 T 8.75 5.13 4.48 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 1.32 0.00 0.00 39 T 8.68 4.74 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 1.22 0.00 0.00 40 T 8.16 4.61 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 41 P 0.00 5.16 0.00 2.30 2.05 0.00 3.42 0.00 0.00 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 1.91 0.00 42 K 8.12 4.32 0.00 1.74 1.80 0.00 1.87 0.00 0.00 1.67 0.00 0.00 2.95 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.38 1.54 7.81 43 K 8.53 3.50 0.00 1.80 1.78 0.00 1.77 0.00 0.00 1.75 0.00 0.00 3.05 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.35 1.34 7.81 44 P 0.00 4.29 0.00 2.17 2.19 0.00 3.79 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 1.98 1.99 0.00 45 N 8.16 4.19 0.00 2.91 2.86 0.00 0.00 6.66 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 S 8.42 4.51 0.00 3.78 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 A 7.86 4.88 1.21 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 48 L 8.10 4.76 0.00 1.63 1.63 0.93 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 49 R 7.67 4.00 0.00 1.87 1.82 0.00 3.06 0.00 0.00 3.18 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.56 0.00 50 K 9.10 4.66 0.00 1.72 1.73 0.00 1.67 0.00 0.00 1.83 0.00 0.00 2.86 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.52 1.68 7.81 51 V 7.76 5.07 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 0.91 0.00 0.00 0.99 0.00 0.00 52 C 8.09 4.86 0.00 3.18 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 53 R 8.47 4.45 0.00 1.90 1.92 0.00 3.10 0.00 0.00 3.20 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.66 0.00 54 V 8.69 4.72 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 0.89 0.00 0.00 1.09 0.00 0.00 55 R 8.53 4.80 0.00 1.92 1.85 0.00 3.24 0.00 0.00 3.37 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.69 0.00 56 L 8.63 5.34 0.00 1.85 1.61 0.96 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 57 T 8.65 3.99 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 58 N 8.12 4.71 0.00 2.78 2.81 0.00 0.00 6.01 7.00 0.00 0.00 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 G 7.89 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 60 F 7.78 4.75 0.00 3.17 3.04 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 61 E 8.60 4.67 0.00 2.09 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 2.19 2.24 0.00 62 V 7.92 4.66 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 1.16 0.00 0.00 1.21 0.00 0.00 63 T 8.33 4.96 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 1.23 0.00 0.00 64 S 8.80 5.23 0.00 4.10 3.81 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 65 Y 8.58 5.12 0.00 3.10 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 66 I 7.02 4.26 1.63 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 1.59 0.71 0.00 0.00 67 G 8.36 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 G 8.34 3.35 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 0.00 69 E 8.18 4.60 0.00 1.84 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 2.15 2.27 0.00 70 G 8.91 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 0.00 0.00 0.00 71 H 8.22 4.60 0.00 3.27 3.29 0.00 5.48 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 N 8.06 4.63 0.00 2.78 1.97 0.00 0.00 6.05 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 73 L 9.09 3.82 0.00 1.85 1.73 0.99 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 74 Q 9.31 4.45 0.00 1.87 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.79 0.00 0.00 0.00 0.00 0.00 2.24 2.25 0.00 75 E 9.28 4.49 0.00 1.63 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 2.05 2.23 0.00 76 H 8.47 4.95 0.00 2.95 3.21 0.00 5.62 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 S 7.81 4.55 0.00 3.73 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 78 V 8.69 3.91 2.27 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 1.04 0.00 0.00 0.94 0.00 0.00 79 I 8.62 4.86 1.88 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 1.27 0.90 0.97 0.00 0.00 80 L 8.10 4.97 0.00 1.72 1.50 0.97 0.95 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 81 I 9.42 4.34 1.79 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 1.13 1.02 0.95 0.00 0.00 82 R 9.79 3.97 0.00 1.69 1.98 0.00 3.25 0.00 0.00 3.21 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.56 0.00 83 G 8.74 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 0.00 0.00 0.00 84 G 8.23 4.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 R 8.56 4.03 0.00 1.80 1.89 0.00 3.16 0.00 0.00 3.15 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.66 0.00 86 V 7.92 4.22 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 0.74 0.00 0.00 1.08 0.00 0.00 87 K 8.55 4.74 0.00 1.74 1.72 0.00 1.92 0.00 0.00 1.62 0.00 0.00 2.81 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.40 1.41 7.81 88 D 6.99 4.85 0.00 2.72 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 L 7.20 4.49 0.00 1.58 1.48 0.84 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 90 P 0.00 4.64 0.00 2.15 2.07 0.00 3.75 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.93 0.00 91 G 8.05 3.57 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 0.00 92 V 7.39 4.00 2.04 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 1.09 0.00 0.00 0.93 0.00 0.00 93 R 7.79 4.50 0.00 1.09 1.69 0.00 2.60 0.00 0.00 2.27 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 1.47 0.00 94 Y 7.58 5.61 0.00 2.95 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 95 H 8.96 5.83 0.00 3.10 3.17 0.00 5.57 0.00 0.00 0.00 0.00 6.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 T 8.17 5.04 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 1.25 0.00 0.00 97 V 8.42 3.75 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 0.86 0.00 0.00 0.97 0.00 0.00 98 R 7.80 4.60 0.00 1.92 1.90 0.00 3.55 0.00 0.00 3.30 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.80 0.00 99 G 7.66 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.45 4.27 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 0.00 101 L 7.48 3.86 0.00 1.79 1.59 0.92 1.01 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 0.00 102 D 9.28 4.44 0.00 2.79 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 0.00 103 C 7.55 4.37 0.00 3.21 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 0.00 104 S 8.16 4.57 0.00 4.21 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 0.00 105 G 8.16 4.83 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 0.00 0.00 0.00 106 V 7.85 3.74 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 0.72 0.00 0.00 0.86 0.00 0.00 107 K 8.62 4.48 0.00 1.83 1.63 0.00 1.84 0.00 0.00 1.80 0.00 0.00 2.85 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.42 1.39 7.81 108 D 8.90 4.68 0.00 2.88 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 0.00 109 R 7.26 4.36 0.00 1.76 1.89 0.00 2.77 0.00 0.00 3.16 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.53 0.00 110 K 8.45 4.50 0.00 1.68 1.80 0.00 1.65 0.00 0.00 1.64 0.00 0.00 3.04 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.33 1.45 7.81 111 Q 8.62 3.98 0.00 2.01 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.71 0.00 0.00 0.00 0.00 0.00 2.37 2.45 0.00 112 A 8.99 4.45 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 0.00 113 R 8.13 3.98 0.00 1.91 2.03 0.00 3.19 0.00 0.00 3.28 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.78 0.00 114 S 8.34 3.93 0.00 3.80 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 0.00 115 K 7.25 3.94 0.00 1.40 0.74 0.00 1.74 0.00 0.00 1.49 0.00 0.00 2.95 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.22 1.23 7.81 116 Y 7.75 3.37 0.00 3.29 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.04 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 0.00 118 V 7.70 4.50 2.25 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 0.83 0.00 0.00 1.07 0.00 0.00 119 K 8.56 4.14 0.00 1.79 1.73 0.00 1.84 0.00 0.00 1.63 0.00 0.00 2.73 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.45 1.37 7.81 120 R 8.49 4.04 0.00 1.75 1.85 0.00 3.29 0.00 0.00 3.28 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.70 0.00 121 P 0.00 4.73 0.00 2.22 1.82 0.00 3.86 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.96 0.00 122 K 8.15 4.17 0.00 1.82 1.84 0.00 1.50 0.00 0.00 1.71 0.00 0.00 3.07 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.30 1.47 7.81 123 A 8.28 4.10 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