NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4340 8.2893 120.3210 54.8768 34.3790 175.5451 2 P 4.3476 0.0000 0.0000 60.9382 32.3931 174.0239 3 S 4.6088 8.1900 113.1516 56.3246 66.8868 174.6910 4 E 4.0625 8.5321 122.1906 55.8457 29.9928 176.8589 5 K 4.1496 8.4703 123.4911 56.9997 32.8838 177.3279 6 T 4.4748 8.9693 114.1501 60.4633 70.5545 175.4608 7 F 4.1646 9.6538 123.7929 61.7605 38.9587 177.3041 8 K 3.9180 8.2398 115.8966 59.4700 31.9100 178.7409 9 Q 4.1319 7.7644 116.8276 57.9604 28.7963 177.7612 10 R 4.2772 7.6433 117.5597 56.2369 31.0194 176.3896 11 R 4.6821 6.8741 113.4672 53.2893 32.6869 175.6029 12 T 4.1959 8.7909 110.9796 61.1169 70.9511 175.4019 13 F 4.0999 8.8681 123.5312 61.8990 39.3364 177.2145 14 E 3.9928 8.3566 117.3466 59.5667 29.2435 179.2411 15 Q 4.0262 8.0348 117.7583 58.9839 28.7501 179.1362 16 R 4.1898 8.2458 119.2889 59.2307 30.1081 179.0018 17 V 3.5787 7.8586 118.5225 66.1872 31.4278 177.7630 18 E 3.8939 8.1115 118.6852 59.1309 29.4661 178.1434 19 D 4.4335 8.3339 119.2970 57.7106 40.9381 179.3306 20 V 3.2958 7.6459 118.3383 65.6200 31.3497 177.7980 21 R 3.8463 8.0590 118.6748 59.6302 29.8882 178.5148 22 L 3.9684 7.9471 118.5192 57.8427 41.5611 179.3533 23 I 3.8058 7.8001 118.4473 63.8038 37.4640 178.1455 24 R 3.8850 8.3545 119.6880 58.9914 29.5780 178.8245 25 E 4.0200 7.7167 118.0160 59.4561 29.5737 178.9539 26 Q 4.1417 7.9398 116.9876 57.7269 30.4879 176.3551 27 H 4.9229 8.3448 116.1951 53.6120 29.0923 172.3401 28 P 4.5337 0.0000 0.0000 63.9499 32.1213 177.9288 29 T 4.4074 7.8090 108.7378 61.3773 69.3936 173.6693 30 K 4.9646 7.7301 121.3208 54.8605 35.3892 175.4810 31 I 3.9122 8.5231 124.5983 59.2669 39.1536 173.2220 32 P 4.9445 0.0000 0.0000 62.4017 32.5807 175.1213 33 V 4.9571 9.1106 125.2219 60.9471 34.8844 173.9940 34 I 4.6088 8.5677 128.8710 59.8442 38.8473 174.6229 35 I 5.1598 8.7421 127.9435 59.6730 39.7461 174.9850 36 E 4.9066 9.2270 125.6763 54.1870 34.2273 175.0360 37 R 2.8538 8.3537 123.0540 55.7062 30.9378 175.5646 38 Y 4.4180 8.5367 127.9332 57.8620 39.3025 177.5223 39 K 3.6879 8.1873 124.6566 59.4781 32.6835 177.7612 40 G 3.7578 6.4516 105.5835 45.0665 0.0000 172.4811 41 E 4.4738 7.9260 121.7182 54.7891 30.4601 175.8455 42 K 4.5425 8.4302 123.6139 56.8099 34.9739 177.4295 43 Q 4.1050 8.3676 119.0831 58.8734 29.2143 176.5030 44 L 4.3917 8.1020 116.7463 53.5026 42.3902 175.0796 45 P 4.6329 0.0000 0.0000 61.9884 32.3913 176.0139 46 V 3.9818 8.0786 118.8423 62.3585 32.1171 175.4898 47 L 4.3742 8.3831 128.6672 54.7898 42.5658 176.8340 48 D 4.5662 8.7354 123.8739 55.1783 39.8915 175.7493 49 K 4.7297 7.9460 117.2397 55.0781 36.4771 175.2659 50 T 4.6945 8.0847 114.0845 64.4769 71.6018 174.4932 51 K 4.6453 7.3499 120.1241 54.6593 33.4853 176.1885 52 F 4.9450 9.2544 123.6146 55.4976 43.4219 173.8773 53 L 5.1910 8.6397 120.6162 52.9889 44.1921 175.9449 54 V 4.3563 8.4146 123.6749 60.0700 34.3411 172.9444 55 P 4.5879 0.0000 0.0000 63.1576 32.0364 176.8909 56 D 4.5060 9.3199 123.3051 54.9699 39.5642 177.1590 57 H 4.6590 7.7550 114.4809 55.8956 29.7457 175.6407 58 V 3.5731 7.3906 122.4867 62.8538 31.9945 175.2616 59 N 5.1436 8.4342 124.7519 52.1561 40.0981 176.0754 60 M 4.1086 8.5356 120.8664 58.4574 31.9454 179.2182 61 S 4.1268 8.5205 114.9580 61.5425 62.9854 176.3643 62 E 3.8828 8.7272 123.0799 58.7463 29.3318 178.3922 63 L 3.8668 7.9565 120.4199 58.1227 42.0185 178.9399 64 I 3.6827 8.0823 120.0305 64.4315 37.1234 178.3661 65 K 3.7601 7.9451 119.0683 59.5725 31.8762 179.3972 66 I 3.5994 7.7578 119.8606 64.4180 37.0362 178.6663 67 I 3.4551 7.6890 120.6907 64.2149 36.9204 178.4770 68 R 3.3342 7.5246 119.2371 59.2478 29.8320 179.0918 69 R 3.7647 7.7998 118.1854 59.3626 29.8562 178.5795 70 R 3.9025 7.6979 117.5161 58.8424 30.1541 177.6510 71 L 4.1854 7.7009 116.5360 54.0611 42.2788 176.3485 72 Q 3.4509 7.7449 116.9881 56.5972 26.7738 174.1271 73 L 4.0788 7.5043 116.7074 54.1913 42.6658 177.3132 74 N 4.2861 8.6709 120.4089 53.6143 39.3940 175.4339 75 A 3.9478 8.6154 126.3470 54.7223 18.4325 177.8896 76 N 4.7332 8.3821 111.6365 53.1425 39.6174 174.3201 77 Q 4.0420 7.9233 119.3761 56.3879 29.4672 175.3933 78 A 4.2050 8.4328 127.5120 52.1642 19.4521 176.4868 79 F 4.7767 7.6577 122.4087 57.1130 42.6634 173.3955 80 F 4.8859 8.8349 124.6076 55.5940 42.9902 173.6379 81 L 5.1766 8.6985 122.4980 52.9641 43.6124 175.3451 82 L 4.7266 9.1920 126.5087 53.2130 44.6809 174.9609 83 V 4.6643 8.8267 126.4130 61.6184 34.0696 175.0258 84 N 4.4879 9.9906 125.1458 54.7755 37.7333 175.6152 85 G 4.1946 9.0993 104.4609 45.7335 0.0000 174.2945 86 H 4.1889 7.6594 117.2268 52.9090 29.8461 173.0456 87 S 3.1718 8.5928 115.1374 58.9680 60.6824 171.5332 88 M 4.6757 8.1615 127.5315 53.6474 31.4805 176.6929 89 V 4.0026 7.8924 116.8489 60.1648 33.0694 176.7926 90 S 4.2971 8.3639 117.7382 58.7479 63.3092 176.4168 91 V 3.7851 8.4764 117.7425 63.7580 31.5200 177.6879 92 S 4.4854 7.8825 112.3373 58.7055 63.8698 174.3896 93 T 4.0593 7.7578 120.7365 62.6939 68.9926 172.3547 94 P 4.8223 0.0000 0.0000 62.3438 32.3042 177.3278 95 I 3.8155 8.8383 120.9051 63.9226 37.7686 178.5740 96 S 4.2236 7.9568 115.3491 61.2979 62.7340 176.1728 97 E 3.9204 8.1830 122.6483 59.0674 29.3877 178.8507 98 V 3.6052 7.8349 117.8391 66.1177 31.6036 177.0193 99 Y 4.2142 8.4560 119.5553 61.0911 38.4802 178.2048 100 E 3.9203 8.1572 117.6259 58.9265 29.5732 178.8618 101 S 4.4890 7.9064 114.4025 59.7927 63.3674 174.6409 102 E 4.6984 8.1322 117.2604 55.0277 31.1416 176.1287 103 K 4.1477 7.7514 118.9783 56.7648 33.1070 176.4640 104 D 4.7192 9.2448 121.1511 53.9421 41.8904 177.0205 105 E 4.1324 8.9029 122.2377 59.3040 29.5079 178.1696 106 D 4.2473 8.8191 116.6910 54.0131 39.8595 177.3306 107 G 4.0105 8.3751 108.9644 45.0640 0.0000 173.8727 108 F 4.5367 9.0101 119.1470 57.1199 40.7730 174.1819 109 L 5.0673 8.9221 123.8360 54.0861 43.7505 174.6368 110 Y 5.1623 8.8543 123.6929 56.8059 40.6180 174.5763 111 M 5.4801 9.4115 122.5224 53.8170 36.8164 174.7086 112 V 5.8646 9.2697 115.0611 58.8250 35.8574 174.2025 113 Y 5.7959 8.2332 119.6576 54.8256 41.4775 173.9500 114 A 4.9104 8.0789 120.8317 51.5544 22.1162 175.6538 115 S 4.7129 8.7619 114.1272 57.4222 65.5749 174.2558 116 Q 4.3045 9.0559 119.8656 59.6277 29.0782 178.2279 117 E 4.4973 7.9625 115.1540 57.3510 31.1913 178.1942 118 T 3.8484 7.2361 115.8868 66.7118 68.7365 176.1314 119 F 4.5507 7.6790 119.1293 60.5547 38.8396 177.8963 120 G 3.6923 8.1095 103.7072 48.0083 0.0000 174.9964 121 M 4.1657 7.7562 119.4446 57.8196 31.9939 176.6568 122 K 4.2167 7.7802 122.1208 56.6092 32.2868 176.6335 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 4.43 0.00 2.01 2.12 0.00 0.00 0.00 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.52 0.00 2 P 0.00 4.35 0.00 2.24 2.03 0.00 3.72 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 2.00 0.00 3 S 8.19 4.61 0.00 3.87 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 4 E 8.53 4.06 0.00 1.92 1.90 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 2.30 2.41 0.00 5 K 8.47 4.15 0.00 1.79 1.74 0.00 1.78 0.00 0.00 1.74 0.00 0.00 3.02 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.44 1.43 7.81 6 T 8.97 4.47 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 1.23 0.00 0.00 7 F 9.65 4.16 0.00 3.09 3.23 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 8 K 8.24 3.92 0.00 1.76 1.85 0.00 1.60 0.00 0.00 1.64 0.00 0.00 2.82 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.52 1.51 7.81 9 Q 7.76 4.13 0.00 2.29 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.89 0.00 0.00 0.00 0.00 0.00 2.37 2.38 0.00 10 R 7.64 4.28 0.00 1.76 1.92 0.00 3.18 0.00 0.00 3.30 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.96 0.00 11 R 6.87 4.68 0.00 1.97 1.66 0.00 2.93 0.00 0.00 3.22 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.64 1.03 0.00 12 T 8.79 4.20 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 1.22 0.00 0.00 13 F 8.87 4.10 0.00 3.17 3.16 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 14 E 8.36 3.99 0.00 2.15 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 2.48 2.60 0.00 15 Q 8.03 4.03 0.00 2.29 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.82 0.00 0.00 0.00 0.00 0.00 2.38 2.41 0.00 16 R 8.25 4.19 0.00 2.03 2.48 0.00 3.66 0.00 0.00 2.84 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.77 0.00 17 V 7.86 3.58 2.01 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 0.99 0.00 0.00 0.23 0.00 0.00 18 E 8.11 3.89 0.00 2.14 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 2.31 2.40 0.00 19 D 8.33 4.43 0.00 3.17 2.91 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 20 V 7.65 3.30 1.87 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 0.99 0.00 0.00 -0.02 0.00 0.00 21 R 8.06 3.85 0.00 1.97 2.02 0.00 3.14 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.67 0.00 22 L 7.95 3.97 0.00 1.88 1.69 0.97 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 23 I 7.80 3.81 1.95 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 1.49 1.51 0.76 0.00 0.00 24 R 8.35 3.88 0.00 1.81 1.95 0.00 3.24 0.00 0.00 3.07 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.82 0.00 25 E 7.72 4.02 0.00 2.06 1.98 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 2.33 2.54 0.00 26 Q 7.94 4.14 0.00 1.97 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 7.26 0.00 0.00 0.00 0.00 0.00 2.34 2.48 0.00 27 H 8.34 4.92 0.00 3.19 3.13 0.00 5.62 0.00 0.00 0.00 0.00 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 P 0.00 4.53 0.00 2.16 2.29 0.00 3.33 0.00 0.00 4.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.89 0.00 29 T 7.81 4.41 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 1.21 0.00 0.00 30 K 7.73 4.96 0.00 1.59 1.66 0.00 1.60 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.32 1.36 7.81 31 I 8.52 3.91 1.73 0.00 0.00 0.40 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 1.01 0.53 0.00 0.00 32 P 0.00 4.94 0.00 1.77 1.98 0.00 2.85 0.00 0.00 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.69 0.00 33 V 9.11 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 1.15 0.00 0.00 1.00 0.00 0.00 34 I 8.57 4.61 1.09 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 0.07 -0.36 0.76 0.00 0.00 35 I 8.74 5.16 1.99 0.00 0.00 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.72 1.12 0.00 0.00 36 E 9.23 4.91 0.00 1.96 1.81 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 2.31 2.34 0.00 37 R 8.35 2.85 0.00 1.46 1.66 0.00 3.43 0.00 0.00 3.43 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.28 0.00 38 Y 8.54 4.42 0.00 3.15 2.79 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 39 K 8.19 3.69 0.00 1.68 1.73 0.00 1.45 0.00 0.00 1.57 0.00 0.00 2.94 0.00 0.00 2.90 0.00 0.00 0.00 0.00 0.85 0.75 7.81 40 G 6.45 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 0.00 0.00 0.00 41 E 7.93 4.47 0.00 1.95 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 2.35 0.00 42 K 8.43 4.54 0.00 1.74 1.80 0.00 1.82 0.00 0.00 1.62 0.00 0.00 2.93 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.31 1.32 7.81 43 Q 8.37 4.11 0.00 2.03 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 7.01 0.00 0.00 0.00 0.00 0.00 2.39 2.41 0.00 44 L 8.10 4.39 0.00 1.93 1.88 1.21 1.09 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 45 P 0.00 4.63 0.00 2.24 2.11 0.00 3.85 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.98 0.00 46 V 8.08 3.98 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 0.86 0.00 0.00 0.98 0.00 0.00 47 L 8.38 4.37 0.00 1.99 1.81 0.91 1.48 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 48 D 8.74 4.57 0.00 2.87 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 49 K 7.95 4.73 0.00 1.52 1.30 0.00 1.58 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.33 1.30 7.81 50 T 8.08 4.69 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 1.06 0.00 0.00 51 K 7.35 4.65 0.00 1.36 1.57 0.00 1.71 0.00 0.00 1.79 0.00 0.00 2.91 0.00 0.00 2.91 0.00 0.00 0.00 0.00 0.59 1.18 7.81 52 F 9.25 4.94 0.00 2.99 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 53 L 8.64 5.19 0.00 1.44 1.50 0.83 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 54 V 8.41 4.36 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 0.93 0.00 0.00 0.92 0.00 0.00 55 P 0.00 4.59 0.00 1.92 1.97 0.00 3.58 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.09 0.00 56 D 9.32 4.51 0.00 2.86 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 57 H 7.75 4.66 0.00 3.29 3.46 0.00 5.53 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 V 7.39 3.57 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 0.85 0.00 0.00 0.75 0.00 0.00 59 N 8.43 5.14 0.00 3.15 2.94 0.00 0.00 6.27 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 60 M 8.54 4.11 0.00 2.10 2.33 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.86 0.00 61 S 8.52 4.13 0.00 4.01 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 0.00 62 E 8.73 3.88 0.00 2.17 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 0.00 2.28 2.31 0.00 63 L 7.96 3.87 0.00 1.78 1.80 0.81 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 64 I 8.08 3.68 2.07 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 1.74 0.75 0.92 0.00 0.00 65 K 7.95 3.76 0.00 1.91 1.78 0.00 1.63 0.00 0.00 1.60 0.00 0.00 2.92 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.39 1.58 7.81 66 I 7.76 3.60 1.90 0.00 0.00 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 1.45 0.79 0.79 0.00 0.00 67 I 7.69 3.46 1.55 0.00 0.00 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.03 0.61 0.00 0.00 68 R 7.52 3.33 0.00 1.67 1.68 0.00 2.90 0.00 0.00 2.87 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 1.07 0.00 69 R 7.80 3.76 0.00 1.85 1.95 0.00 3.04 0.00 0.00 3.03 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.56 0.00 70 R 7.70 3.90 0.00 1.89 1.92 0.00 3.34 0.00 0.00 3.25 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.66 0.00 71 L 7.70 4.19 0.00 1.59 1.60 0.49 0.79 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 72 Q 7.74 3.45 0.00 2.18 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.85 0.00 0.00 0.00 0.00 0.00 2.26 2.27 0.00 73 L 7.50 4.08 0.00 1.52 1.52 0.72 0.97 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 74 N 8.67 4.29 0.00 2.70 2.68 0.00 0.00 7.03 7.81 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 75 A 8.62 3.95 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 N 8.38 4.73 0.00 2.65 2.89 0.00 0.00 7.15 7.90 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 77 Q 7.92 4.04 0.00 2.04 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.64 0.00 0.00 0.00 0.00 0.00 2.39 2.38 0.00 78 A 8.43 4.20 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 79 F 7.66 4.78 0.00 2.85 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 80 F 8.83 4.89 0.00 3.06 2.97 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 81 L 8.70 5.18 0.00 1.58 1.65 1.07 1.08 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 82 L 9.19 4.73 0.00 1.25 1.34 0.52 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 83 V 8.83 4.66 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 0.98 0.00 0.00 0.97 0.00 0.00 84 N 9.99 4.49 0.00 3.04 2.98 0.00 0.00 7.23 7.74 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 85 G 9.10 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 86 H 7.66 4.19 0.00 3.19 3.02 0.00 5.71 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 S 8.59 3.17 0.00 3.62 3.83 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 88 M 8.16 4.68 0.00 2.02 1.96 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.44 0.00 89 V 7.89 4.00 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 0.96 0.00 0.00 90 S 8.36 4.30 0.00 3.90 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 91 V 8.48 3.79 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 0.82 0.00 0.00 0.95 0.00 0.00 92 S 7.88 4.49 0.00 3.98 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 93 T 7.76 4.06 4.32 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 0.00 0.00 0.00 1.23 0.00 0.00 94 P 0.00 4.82 0.00 2.24 2.19 0.00 3.87 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 1.97 0.00 95 I 8.84 3.82 1.96 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 1.61 1.60 0.98 0.00 0.00 96 S 7.96 4.22 0.00 4.12 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 0.00 97 E 8.18 3.92 0.00 2.13 2.19 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 2.33 2.34 0.00 98 V 7.83 3.61 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 1.11 0.00 0.00 0.97 0.00 0.00 99 Y 8.46 4.21 0.00 3.15 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 0.00 100 E 8.16 3.92 0.00 2.03 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 2.67 2.55 0.00 101 S 7.91 4.49 0.00 3.96 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 0.00 102 E 8.13 4.70 0.00 2.06 1.95 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 2.23 2.35 0.00 103 K 7.75 4.15 0.00 1.67 1.24 0.00 1.06 0.00 0.00 0.61 0.00 0.00 2.67 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.22 1.21 7.81 104 D 9.24 4.72 0.00 3.28 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 0.00 105 E 8.90 4.13 0.00 2.25 2.26 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 2.39 2.30 0.00 106 D 8.82 4.25 0.00 2.64 2.78 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 0.00 107 G 8.38 4.01 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 0.00 0.00 0.00 108 F 9.01 4.54 0.00 3.17 2.44 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 0.00 109 L 8.92 5.07 0.00 2.17 1.83 1.07 1.01 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 0.00 110 Y 8.85 5.16 0.00 3.03 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 0.00 111 M 9.41 5.48 0.00 1.99 2.00 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.59 0.00 112 V 9.27 5.86 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 0.89 0.00 0.00 1.13 0.00 0.00 113 Y 8.23 5.80 0.00 2.34 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 0.00 114 A 8.08 4.91 0.23 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 0.00 115 S 8.76 4.71 0.00 4.12 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 0.00 116 Q 9.06 4.30 0.00 2.17 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.90 6.93 0.00 0.00 0.00 0.00 0.00 2.39 2.50 0.00 117 E 7.96 4.50 0.00 2.05 1.95 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 2.32 2.32 0.00 118 T 7.24 3.85 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 1.32 0.00 0.00 119 F 7.68 4.55 0.00 2.92 2.78 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 0.00 120 G 8.11 3.69 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 0.00 0.00 0.00 121 M 7.76 4.17 0.00 2.06 2.37 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.86 2.62 0.00 122 K 7.78 4.22 0.00 1.92 1.77 0.00 1.83 0.00 0.00 1.82 0.00 0.00 3.23 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.62 1.70 7.81