NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 9 T 4.1479 8.1631 115.2426 61.9719 68.4093 172.5694 10 G 4.1336 8.4207 113.5262 42.3839 0.0000 173.3290 11 F 5.1490 8.7676 130.7225 57.8715 38.4666 176.1568 12 L 4.2295 7.5229 120.3748 52.2606 42.8548 175.9201 13 V 3.7835 7.5638 119.3899 61.5915 32.0758 177.1318 14 K 4.2976 8.3610 121.6518 55.8528 34.2290 178.1144 15 Q 3.9399 8.5273 122.0113 59.4713 28.9349 178.9468 16 R 4.0830 8.3307 119.7155 58.7281 30.2225 178.7103 17 A 4.8072 8.0613 121.4123 54.6441 18.2910 179.2272 18 F 4.1391 8.4776 119.1525 61.6568 39.5310 177.4599 19 L 4.2794 8.5485 118.7442 57.8004 41.4266 179.5915 20 K 3.9852 8.6399 118.9465 59.2045 31.9343 178.9253 21 L 4.0437 8.1935 120.6306 58.6298 42.0423 178.4816 22 Y 3.9671 7.7752 116.4252 61.6271 37.8282 178.9645 23 M 4.1820 8.3831 119.3472 58.3452 31.9063 178.9643 24 I 3.8789 7.8881 120.1545 64.6582 37.3429 178.6383 25 T 4.6334 8.0166 117.9543 66.5103 68.1991 176.6806 26 M 4.0974 8.5299 121.0503 58.7311 31.9296 179.0000 27 T 3.5967 7.9924 115.8439 66.5624 68.6222 176.3747 28 E 4.2515 8.4653 120.6639 59.4172 29.2545 178.5244 29 Q 4.3396 7.7996 115.1018 54.6262 29.0457 175.3300 30 E 3.7358 8.2717 118.6893 57.6480 27.6510 175.1722 31 R 4.5585 8.1715 111.4454 55.6911 30.0310 175.3445 32 L 4.3665 7.4518 121.8171 54.3723 41.5680 174.3533 33 Y 5.2488 8.0757 123.1790 55.6266 40.8940 177.6001 34 G 3.8860 8.9298 112.9160 48.9185 0.0000 174.8311 35 L 4.0129 7.5693 118.9134 57.6317 42.2048 178.6216 36 K 4.0156 8.3261 118.4220 59.4499 32.4064 178.9004 37 L 3.2351 7.1017 113.0551 56.9024 42.4129 178.0834 38 L 3.9001 8.3658 119.1016 58.6674 42.5330 178.9382 39 E 3.9109 8.0781 117.6107 59.3542 29.4867 179.3206 40 V 3.5408 8.5043 118.7418 65.8354 31.3969 178.1115 41 L 3.8242 8.2084 119.0037 58.0169 41.3491 179.7426 42 R 3.8803 8.1566 118.1286 59.3129 29.7043 179.1382 43 S 4.0594 8.0281 112.3837 61.0748 62.4422 175.5070 44 E 3.8550 7.7258 121.1592 57.7673 29.5305 177.5866 45 F 5.0679 7.2894 115.7908 56.8592 39.7933 177.0351 46 K 4.1425 7.8090 119.8397 59.4411 32.4684 178.6873 47 E 4.0788 8.0671 119.8007 59.4958 29.8183 178.3615 48 I 4.0253 7.7186 118.0883 64.5210 37.3404 176.3374 49 G 3.9098 7.4387 106.1977 45.1401 0.0000 172.8174 50 F 4.8544 8.2809 122.5312 56.1848 40.3511 175.2271 51 K 4.0637 8.2751 129.6442 53.2056 31.8285 172.6794 52 P 3.6329 0.0000 0.0000 62.4739 31.9527 176.8235 53 N 4.4575 8.4925 120.0312 53.6668 40.7225 175.2226 54 H 4.1337 8.7543 125.8084 59.7065 30.2311 177.6686 55 T 4.1489 7.9259 110.3132 63.8549 68.8679 176.2577 56 E 4.0007 8.1532 122.6170 59.1680 29.8248 178.4626 57 V 3.6116 7.6993 117.8445 66.2483 31.6442 177.3125 58 Y 3.9862 7.8446 119.2287 60.9326 38.6510 178.3690 59 R 4.0774 8.3648 118.9434 59.0515 30.1054 179.2615 60 S 4.0520 8.3047 115.2457 61.4424 62.8899 176.1393 61 L 3.7686 7.6510 122.8803 58.7512 41.7927 178.9224 62 H 4.1178 7.8737 115.2850 58.2751 28.4423 177.6892 63 E 4.0862 8.1048 121.0445 59.1974 29.2808 179.1337 64 L 3.8873 7.7881 119.0852 57.4442 41.5134 179.6042 65 L 4.0852 7.7052 119.0309 58.1095 41.5077 179.2667 66 D 4.3969 8.3187 117.6425 57.1827 40.8145 177.7787 67 D 4.6883 8.2195 117.2058 53.9678 41.0061 177.2195 68 G 3.9665 7.9842 107.7852 46.0237 0.0000 174.9823 69 I 4.0464 7.9290 122.3175 63.5857 38.0167 176.0624 70 L 5.3796 7.8633 118.9239 52.8962 44.8409 175.7276 71 K 4.8566 8.9116 118.4467 55.5667 36.4944 174.8053 72 Q 4.6529 8.6205 119.5298 54.6272 30.4735 174.5676 73 I 4.3740 8.4195 125.1326 59.5900 39.0694 174.8822 74 K 5.1125 8.5650 125.5495 54.5567 35.7678 175.7610 75 V 4.4896 8.3206 122.1622 60.8829 35.0781 174.7907 76 K 4.4016 8.6826 126.8414 56.1968 33.1993 177.1889 77 K 4.1815 8.2064 124.6660 55.7115 31.3386 177.7409 78 E 4.1884 8.8428 123.4855 57.6120 29.3932 178.0059 79 G 3.9360 7.9137 106.5125 45.0611 0.0000 173.5397 80 A 4.7022 7.6565 122.6415 49.5341 21.5317 175.8723 81 K 3.9327 8.5806 121.9143 57.5675 33.0085 177.9184 82 L 3.6744 8.6988 124.0527 54.0153 39.6098 171.7672 83 Q 3.4524 8.4226 122.2872 55.5638 28.1747 172.8022 84 E 4.9252 8.2039 115.9603 55.0372 33.5999 173.9153 85 V 4.1775 8.7575 119.7461 61.8370 33.2240 175.0738 86 V 4.5613 8.4354 127.9295 61.0749 33.6641 173.6478 87 L 4.6671 8.6161 130.3809 53.3695 44.5405 174.3504 88 Y 4.9109 8.2560 123.7471 56.6481 39.7053 175.0092 89 Q 4.4623 8.5655 121.1991 53.6937 33.8630 174.3916 90 F 4.9013 8.4917 119.4234 57.8787 39.0529 175.4140 91 K 4.3168 9.4416 124.4944 57.4697 33.9590 175.9204 92 D 4.7435 7.9821 118.8946 51.3174 41.5466 174.4167 93 Y 3.8632 8.2539 125.1514 59.7387 38.9930 176.9141 94 E 3.6379 8.1147 119.1815 59.2307 29.6239 178.8166 95 A 3.9569 8.3677 120.5645 54.9489 18.3282 179.5588 96 A 3.9141 7.5610 118.7254 55.4276 18.5130 180.1235 97 K 3.8046 7.5479 116.8616 59.1075 31.9166 179.4955 98 L 3.8515 7.7586 120.9154 58.1372 42.0559 178.2596 99 Y 3.9097 8.1412 119.5325 60.6940 38.7838 177.9462 100 K 3.8630 8.4819 119.7725 59.7367 32.0752 179.3235 101 K 3.9250 7.9723 118.3099 59.5040 31.9566 179.4315 102 Q 3.8938 7.9116 118.2670 58.9907 28.5801 178.8903 103 L 3.8483 7.8882 120.2356 57.4515 41.4724 179.4870 104 K 3.8628 7.9428 119.6896 59.3350 32.0457 178.9803 105 V 3.5122 7.4706 118.2886 66.0252 31.4065 177.6430 106 E 3.9000 8.0327 118.1734 59.5935 29.2968 179.4472 107 L 3.9884 8.2290 119.1253 57.9152 41.6849 179.4121 108 D 4.3049 8.2919 118.9356 57.3454 40.6853 178.8183 109 R 3.8713 8.1661 119.3291 59.4448 29.9908 178.6544 110 S 3.9378 8.3205 115.3462 61.3451 62.7450 176.5380 111 K 3.8558 8.1558 122.2573 59.4823 31.9121 178.7305 112 K 3.8735 8.0204 118.6134 59.4401 32.0003 178.8512 113 L 3.9339 8.0678 120.5513 58.3747 41.9796 179.1539 114 I 3.7062 7.9973 119.8919 64.4043 37.0239 178.2823 115 E 3.9742 8.5014 119.8113 59.2889 29.2524 179.3576 116 K 3.9335 8.5088 119.8269 59.5062 32.4132 178.7125 117 A 4.0933 8.0932 121.0759 55.0418 18.3545 179.7039 118 L 4.2732 8.0814 117.8780 58.1579 41.5613 179.8697 119 S 4.2842 7.9631 112.9021 61.4001 63.2024 175.8899 120 D 4.4942 8.5327 122.1623 56.1113 40.7036 177.2693 121 N 4.6645 7.8959 113.5772 52.7518 39.8739 174.7231 122 F 4.4533 7.9561 123.9373 57.5958 40.0403 174.4597 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 9 T 8.16 4.15 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 10 G 8.42 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 11 F 8.77 5.15 0.00 2.90 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 12 L 7.52 4.23 0.00 1.24 1.27 0.54 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 13 V 7.56 3.78 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 0.70 0.00 0.00 1.03 0.00 0.00 14 K 8.36 4.30 0.00 1.88 1.80 0.00 1.72 0.00 0.00 1.79 0.00 0.00 2.93 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.56 1.53 7.81 15 Q 8.53 3.94 0.00 2.04 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.91 0.00 0.00 0.00 0.00 0.00 2.58 2.52 0.00 16 R 8.33 4.08 0.00 1.95 2.05 0.00 3.68 0.00 0.00 3.38 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.57 0.00 17 A 8.06 4.81 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 18 F 8.48 4.14 0.00 3.24 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 19 L 8.55 4.28 0.00 1.88 1.84 1.08 1.11 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 20 K 8.64 3.99 0.00 2.13 1.69 0.00 1.74 0.00 0.00 1.30 0.00 0.00 2.84 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.39 1.71 7.81 21 L 8.19 4.04 0.00 1.83 1.80 0.91 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 22 Y 7.78 3.97 0.00 3.22 3.07 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 23 M 8.38 4.18 0.00 1.95 2.19 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.97 2.57 0.00 24 I 7.89 3.88 2.17 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 1.71 0.83 1.25 0.00 0.00 25 T 8.02 4.63 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 1.20 0.00 0.00 26 M 8.53 4.10 0.00 2.01 2.30 0.00 0.00 0.00 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.85 2.65 0.00 27 T 7.99 3.60 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 0.02 0.00 0.00 28 E 8.47 4.25 0.00 2.29 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 2.59 3.10 0.00 29 Q 7.80 4.34 0.00 2.15 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.76 0.00 0.00 0.00 0.00 0.00 2.37 2.65 0.00 30 E 8.27 3.74 0.00 2.03 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 2.18 0.00 31 R 8.17 4.56 0.00 1.93 2.00 0.00 3.07 0.00 0.00 3.47 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.53 0.00 32 L 7.45 4.37 0.00 1.54 1.54 0.70 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 33 Y 8.08 5.25 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 34 G 8.93 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 35 L 7.57 4.01 0.00 1.69 1.68 0.91 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 36 K 8.33 4.02 0.00 1.85 1.90 0.00 1.71 0.00 0.00 1.74 0.00 0.00 2.84 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.52 1.37 7.81 37 L 7.10 3.24 0.00 2.16 1.53 0.91 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 38 L 8.37 3.90 0.00 1.75 1.63 0.85 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 39 E 8.08 3.91 0.00 2.23 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 2.39 2.41 0.00 40 V 8.50 3.54 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 1.01 0.00 0.00 0.98 0.00 0.00 41 L 8.21 3.82 0.00 2.01 1.75 0.92 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 42 R 8.16 3.88 0.00 1.97 1.93 0.00 3.06 0.00 0.00 3.04 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.71 0.00 43 S 8.03 4.06 0.00 3.86 4.02 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 44 E 7.73 3.85 0.00 1.74 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 1.47 1.47 0.00 45 F 7.29 5.07 0.00 3.13 3.14 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 0.00 46 K 7.81 4.14 0.00 1.88 2.01 0.00 1.50 0.00 0.00 1.63 0.00 0.00 3.06 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.42 1.58 7.81 47 E 8.07 4.08 0.00 1.98 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 2.32 2.49 0.00 48 I 7.72 4.03 2.07 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.61 1.00 0.00 0.00 49 G 7.44 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 50 F 8.28 4.85 0.00 2.74 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 51 K 8.28 4.06 0.00 1.67 1.64 0.00 1.84 0.00 0.00 1.68 0.00 0.00 3.00 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.22 1.33 7.81 52 P 0.00 3.63 0.00 1.92 1.89 0.00 3.45 0.00 0.00 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.09 0.00 53 N 8.49 4.46 0.00 2.93 2.75 0.00 0.00 6.41 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 54 H 8.75 4.13 0.00 3.26 3.26 0.00 5.74 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 T 7.93 4.15 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 56 E 8.15 4.00 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 2.67 2.52 0.00 57 V 7.70 3.61 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 0.97 0.00 0.00 0.98 0.00 0.00 58 Y 7.84 3.99 0.00 3.20 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 59 R 8.36 4.08 0.00 2.10 2.03 0.00 3.25 0.00 0.00 3.24 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.97 0.00 60 S 8.30 4.05 0.00 4.04 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 61 L 7.65 3.77 0.00 1.50 1.53 -0.01 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 62 H 7.87 4.12 0.00 3.11 3.25 0.00 5.67 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 E 8.10 4.09 0.00 2.25 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 2.34 2.41 0.00 64 L 7.79 3.89 0.00 1.78 1.61 0.84 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 65 L 7.71 4.09 0.00 1.84 1.71 0.75 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 66 D 8.32 4.40 0.00 2.62 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 67 D 8.22 4.69 0.00 2.69 2.69 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 68 G 7.98 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 69 I 7.93 4.05 1.98 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.57 1.05 0.00 0.00 70 L 7.86 5.38 0.00 1.48 1.60 0.71 0.59 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 71 K 8.91 4.86 0.00 1.79 1.87 0.00 1.28 0.00 0.00 1.72 0.00 0.00 3.09 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.50 1.37 7.81 72 Q 8.62 4.65 0.00 1.67 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.76 0.00 0.00 0.00 0.00 0.00 2.24 2.31 0.00 73 I 8.42 4.37 1.86 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 1.17 0.58 0.86 0.00 0.00 74 K 8.56 5.11 0.00 1.55 1.63 0.00 1.66 0.00 0.00 1.58 0.00 0.00 2.88 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.20 1.30 7.81 75 V 8.32 4.49 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 0.88 0.00 0.00 0.92 0.00 0.00 76 K 8.68 4.40 0.00 1.66 1.72 0.00 1.68 0.00 0.00 1.70 0.00 0.00 2.85 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.44 1.53 7.81 77 K 8.21 4.18 0.00 1.94 1.76 0.00 1.66 0.00 0.00 1.62 0.00 0.00 2.85 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.44 1.54 7.81 78 E 8.84 4.19 0.00 1.94 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 2.30 2.24 0.00 79 G 7.91 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 80 A 7.66 4.70 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 81 K 8.58 3.93 0.00 1.88 1.85 0.00 1.68 0.00 0.00 1.70 0.00 0.00 2.91 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.40 1.46 7.81 82 L 8.70 3.67 0.00 1.84 1.80 0.92 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 83 Q 8.42 3.45 0.00 2.24 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.69 6.61 0.00 0.00 0.00 0.00 0.00 2.36 2.29 0.00 84 E 8.20 4.93 0.00 2.13 1.91 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 2.15 2.20 0.00 85 V 8.76 4.18 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 0.92 0.00 0.00 0.90 0.00 0.00 86 V 8.44 4.56 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 0.25 0.00 0.00 0.91 0.00 0.00 87 L 8.62 4.67 0.00 1.70 1.33 0.79 0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 88 Y 8.26 4.91 0.00 2.80 2.69 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 89 Q 8.57 4.46 0.00 1.91 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 7.01 0.00 0.00 0.00 0.00 0.00 2.12 2.19 0.00 90 F 8.49 4.90 0.00 2.95 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 91 K 9.44 4.32 0.00 1.76 2.15 0.00 1.77 0.00 0.00 1.78 0.00 0.00 2.88 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.41 1.40 7.81 92 D 7.98 4.74 0.00 2.79 2.50 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 93 Y 8.25 3.86 0.00 2.87 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 94 E 8.11 3.64 0.00 2.11 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 2.36 2.28 0.00 95 A 8.37 3.96 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 96 A 7.56 3.91 1.17 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 97 K 7.55 3.80 0.00 1.46 1.62 0.00 1.43 0.00 0.00 1.15 0.00 0.00 2.62 0.00 0.00 2.82 0.00 0.00 0.00 0.00 0.80 0.26 7.81 98 L 7.76 3.85 0.00 1.92 1.76 0.91 0.85 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 99 Y 8.14 3.91 0.00 3.21 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 0.00 100 K 8.48 3.86 0.00 1.94 1.83 0.00 1.73 0.00 0.00 1.63 0.00 0.00 2.95 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.51 1.56 7.81 101 K 7.97 3.93 0.00 1.89 1.79 0.00 1.64 0.00 0.00 1.59 0.00 0.00 2.92 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.39 1.65 7.81 102 Q 7.91 3.89 0.00 1.85 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.79 0.00 0.00 0.00 0.00 0.00 2.48 2.44 0.00 103 L 7.89 3.85 0.00 1.69 1.60 0.89 0.23 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 0.00 104 K 7.94 3.86 0.00 1.82 1.94 0.00 1.49 0.00 0.00 1.53 0.00 0.00 2.96 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.40 1.61 7.81 105 V 7.47 3.51 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 1.01 0.00 0.00 0.94 0.00 0.00 106 E 8.03 3.90 0.00 2.10 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 2.54 2.40 0.00 107 L 8.23 3.99 0.00 1.78 1.72 0.88 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 108 D 8.29 4.30 0.00 2.79 2.69 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 0.00 109 R 8.17 3.87 0.00 1.93 2.02 0.00 3.17 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 1.59 1.65 0.00 110 S 8.32 3.94 0.00 4.00 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 0.00 111 K 8.16 3.86 0.00 1.90 1.96 0.00 1.65 0.00 0.00 1.64 0.00 0.00 2.95 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.54 1.48 7.81 112 K 8.02 3.87 0.00 2.00 1.85 0.00 1.72 0.00 0.00 1.57 0.00 0.00 2.89 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.46 1.60 7.81 113 L 8.07 3.93 0.00 1.96 1.64 0.96 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 114 I 8.00 3.71 1.97 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 1.45 0.49 0.90 0.00 0.00 115 E 8.50 3.97 0.00 2.28 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 0.00 2.34 2.32 0.00 116 K 8.51 3.93 0.00 1.85 1.97 0.00 1.65 0.00 0.00 1.67 0.00 0.00 2.97 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.51 1.52 7.81 117 A 8.09 4.09 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.08 4.27 0.00 1.96 1.81 0.95 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 119 S 7.96 4.28 0.00 4.07 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 0.00 120 D 8.53 4.49 0.00 2.73 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 0.00 121 N 7.90 4.66 0.00 2.33 2.16 0.00 0.00 6.78 6.73 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 0.00 122 F 7.96 4.45 0.00 3.26 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