NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 S 4.2480 8.3344 116.7747 58.1978 64.9695 173.3327 5 V 3.7952 7.5535 120.9451 60.8038 31.7452 170.0000 6 V 4.2285 8.9943 128.4690 61.5033 33.7722 174.4373 7 K 4.7619 8.0651 123.9244 54.3373 35.1710 177.5316 8 S 4.2113 8.7229 117.1877 62.0200 62.8115 176.3470 9 E 4.2864 8.1854 113.6642 57.3052 29.4878 176.4369 10 D 4.6774 7.7435 119.3110 54.3455 41.0685 177.8445 11 Y 4.1612 7.2555 119.1870 59.6070 37.8315 177.2267 12 A 4.3221 7.1027 121.0959 52.7381 19.3083 176.8131 13 L 4.6677 7.1961 115.6166 51.8947 43.5921 174.8513 14 P 4.3278 0.0000 0.0000 63.0248 31.7157 175.8828 15 S 4.8532 8.3683 115.5598 56.4209 66.0528 172.2825 16 Y 4.5297 8.3479 121.1751 56.5383 39.6633 174.8727 17 V 4.2266 6.9216 117.9510 60.0061 35.6986 174.1675 18 D 4.6360 8.3824 123.4175 52.7811 41.2088 176.2249 19 R 4.5144 7.8651 122.7549 54.0769 34.0873 176.6641 20 R 3.5248 8.6748 122.0034 59.0597 30.1207 177.1251 21 D 4.7601 7.9492 113.7345 53.6631 39.8169 175.7812 22 Y 4.8220 7.9403 120.9165 55.1750 38.6840 173.4095 23 P 4.4363 0.0000 0.0000 65.0751 31.7931 176.9534 24 L 4.6233 6.7190 116.1502 51.6386 41.3244 174.2880 25 P 4.6359 0.0000 0.0000 62.2809 31.9827 176.8238 26 D 4.5781 8.7755 118.9700 56.7946 40.9388 177.0774 27 V 4.5574 7.5226 109.4640 58.9781 35.6056 174.7984 28 A 4.2975 8.2566 123.8154 51.8479 19.2161 177.2680 29 H 3.4053 8.4163 121.8390 58.3449 29.8480 175.8702 30 V 4.1202 7.6195 119.2741 60.7549 32.6658 174.9224 31 K 4.1567 8.5548 126.5491 58.0083 33.5884 176.5336 32 N 4.7030 7.9163 117.0011 51.6970 39.4189 174.0971 33 L 4.6514 8.2202 123.2939 52.9262 44.2079 177.1719 34 S 4.5211 8.1915 117.1649 56.9897 66.1215 174.9512 35 A 3.9511 8.4474 122.6823 55.6936 17.9512 179.9653 36 S 4.1335 7.9978 111.9315 61.5508 63.0578 176.5245 37 Q 3.9643 7.8791 121.9288 58.7101 28.5914 178.5529 38 K 3.9106 8.6177 119.7121 59.4002 32.0202 179.2682 39 A 4.0046 7.9491 120.8218 54.9982 18.2928 179.4518 40 L 3.9415 8.0305 118.9624 58.3119 41.9647 179.4177 41 K 4.0320 8.1201 117.5491 59.2010 32.1968 179.0607 42 E 4.1285 8.0266 118.9137 59.3358 29.5151 179.1655 43 K 4.0116 8.5196 120.0094 59.3673 31.9738 178.2477 44 E 4.2626 8.2646 118.6818 58.6410 29.6045 178.2889 45 K 4.2544 8.0358 116.9272 57.6572 32.4449 176.6074 46 A 4.4486 7.5908 122.2542 49.9970 20.9567 176.4569 47 S 3.9642 8.3915 112.6672 58.8383 62.7371 175.3339 48 W 4.6876 8.4689 126.4381 59.2111 29.2552 178.5683 49 S 4.2878 7.9884 114.4349 61.4199 62.2887 175.5968 50 S 4.3923 7.8771 114.2574 59.6874 62.9668 174.3992 51 L 4.5142 7.6390 121.4062 54.0336 42.3704 177.5063 52 S 4.5510 9.1347 118.4132 57.4402 65.4530 175.5176 53 I 3.6480 8.2293 122.9070 65.0504 36.9128 178.2362 54 D 4.3824 8.1500 118.7830 57.6792 40.6232 178.7945 55 E 4.0776 8.2450 118.9014 58.9841 29.4694 179.4902 56 K 3.9426 8.4111 119.2975 59.3466 32.0522 179.5483 57 V 3.6271 8.1264 118.9541 66.0317 31.1853 177.7417 58 E 3.9616 8.3505 119.0653 59.2165 29.1966 178.8041 59 L 3.9775 8.0339 119.2868 57.6130 41.6187 178.8285 60 Y 4.0791 8.0494 119.6941 60.8482 38.6352 178.2393 61 R 4.3600 8.1647 118.7865 58.2140 30.2949 178.5879 62 L 4.0788 7.4422 119.1393 57.1028 41.6315 179.0822 63 K 3.5079 7.4391 119.4081 57.4561 32.0124 176.5821 64 F 5.3389 7.2868 116.7456 55.4429 42.2636 175.8857 65 K 3.7221 9.7594 125.8520 58.6279 32.3218 176.8527 66 E 5.0785 8.1628 116.4050 53.9894 32.7799 176.6129 67 S 5.1447 8.9803 118.0813 57.2085 65.5614 175.4400 68 F 3.9590 9.0679 120.4703 60.5811 38.3897 177.6572 69 A 4.0575 8.0989 119.0078 55.3127 17.9918 179.1387 70 E 4.1030 7.9534 116.5517 59.8000 29.4228 179.5067 71 M 4.2336 8.2690 115.5753 57.4065 31.3637 177.2027 72 N 4.7841 7.8202 116.2430 51.9130 39.4252 175.0879 73 R 4.1309 7.0862 117.2257 55.9094 30.2502 176.7013 74 S 4.5403 8.4081 115.3755 57.8853 64.3390 172.7027 75 T 4.7097 8.1320 110.4424 60.1765 71.7227 173.2953 76 N 4.6614 8.4160 115.9221 53.1948 39.0606 176.6968 77 E 3.9009 7.9346 121.0386 59.2767 29.3960 178.8115 78 W 4.3775 8.3639 116.0967 59.6351 27.8700 178.2392 79 K 3.2071 6.5679 118.7577 59.2672 31.2999 179.4147 80 T 3.7672 7.5059 115.3444 66.4725 68.3627 176.7231 81 V 3.5964 7.8369 120.0452 66.0872 31.6288 178.1852 82 V 3.7789 8.2769 118.3054 65.9799 31.4185 178.1569 83 G 3.6387 8.4119 105.4418 47.7668 0.0000 175.5349 84 A 4.1045 8.3533 123.3659 54.7412 18.3831 179.2165 85 A 4.1391 8.4055 119.7169 56.1134 18.4934 179.8037 86 M 4.0434 8.3519 116.7910 58.4462 31.8851 178.9346 87 F 3.9852 8.2685 120.8774 61.3674 39.6178 177.3463 88 F 4.0162 8.7460 117.7030 60.4538 38.4575 177.8538 89 I 3.9652 8.1401 119.3941 64.1547 37.0042 178.3831 90 G 3.5968 8.0379 106.8584 47.5875 0.0000 175.6338 91 F 3.9343 7.9924 123.1546 61.1693 39.2829 177.3159 92 T 3.6870 7.9061 115.3886 66.5019 68.1948 176.3316 93 A 3.9976 7.6135 122.5454 55.0382 18.2912 179.7038 94 L 3.8631 7.4427 117.4961 57.7505 41.5172 179.6669 95 L 3.8764 7.2427 118.5662 57.6892 41.6419 179.3188 96 L 4.0090 7.9047 118.9849 57.7111 41.6026 179.6658 97 I 3.7134 7.9603 119.8917 64.1423 36.9976 178.2226 98 W 4.2108 8.2675 129.2362 60.3720 30.4323 177.5618 99 E 3.9358 8.7183 119.4025 59.3361 28.9334 178.7556 100 K 3.9762 7.8646 118.1288 59.5374 32.2288 178.0043 101 H 4.0647 7.7360 117.3159 59.0049 30.0097 176.1826 102 Y 4.1762 7.3948 115.6544 57.9469 38.2375 176.3531 103 V 4.0419 7.2530 117.8850 64.3759 33.0224 175.6809 104 Y 4.6300 7.5695 116.4216 57.8739 38.4770 176.3615 105 G 4.0002 8.3960 114.6445 44.0191 0.0000 171.1929 106 P 4.4371 0.0000 0.0000 62.0364 32.2672 176.0324 107 I 3.9400 7.8071 113.5084 59.3329 38.9311 173.8197 108 P 4.2842 0.0000 0.0000 63.0955 31.8233 177.4449 109 H 4.2881 8.6163 116.6547 58.0457 28.4944 176.8480 110 T 2.6453 7.0426 108.6877 62.3930 68.4450 174.6210 111 F 4.5404 7.5994 119.9182 57.7328 39.9512 176.6894 112 E 4.1897 8.0515 121.8180 55.9307 31.1308 176.9477 113 E 3.9751 8.9964 123.6255 59.7371 29.6128 179.0808 114 E 3.9368 8.2406 118.3343 59.0131 29.8216 178.1270 115 W 3.9132 8.3427 127.8504 60.6869 30.6798 177.6791 116 V 3.7287 8.3642 118.0336 66.0907 30.8770 177.8744 117 A 4.0100 8.1213 120.3439 55.0379 18.1859 179.7929 118 K 3.7650 8.0028 116.9990 59.5826 32.0292 179.3191 119 Q 3.8047 8.3248 120.0521 59.4575 28.9502 178.5529 120 T 3.9594 8.2267 117.0221 66.4588 68.4693 176.4615 121 K 3.6189 7.9838 121.4750 59.4216 32.1250 178.5606 122 R 3.8045 8.1268 119.2086 59.8890 29.8649 178.2459 123 M 3.9820 8.2701 118.5657 58.5306 31.8802 178.8331 124 L 4.1271 8.0211 119.0235 57.7523 41.4647 179.2639 125 D 4.4727 8.2245 119.0902 56.9527 40.8643 177.6170 126 M 4.2668 8.1243 114.9151 54.1717 32.5194 176.0435 127 K 3.9683 7.6903 117.1984 56.4989 30.3304 176.2931 128 V 3.4923 8.2690 118.8183 64.2161 32.9204 174.9812 129 A 4.0916 8.7438 129.4073 52.9009 15.4937 175.4631 130 P 4.5424 0.0000 0.0000 64.5891 32.6334 179.0509 131 I 4.0782 7.8795 119.2610 64.0032 37.5492 176.0076 132 Q 4.6674 8.0967 114.7370 57.4640 35.1822 176.0361 133 G 3.9156 8.4499 105.3102 48.2171 0.0000 172.7176 134 F 4.7433 8.1507 120.7288 59.0247 41.4150 177.0311 135 S 4.2873 9.3091 116.7517 61.4397 63.0675 176.6751 136 A 4.2913 8.2442 121.6765 54.2111 18.4165 177.8271 137 K 4.5311 8.4409 115.0127 55.7550 32.4708 175.5067 138 W 4.5999 8.1007 129.5749 55.2637 32.5011 174.7605 139 D 4.4615 7.4968 125.7667 52.8708 40.1232 176.5804 140 Y 4.2707 8.4765 125.4309 60.6596 38.4535 177.5831 141 D 4.5338 8.2920 118.8671 57.0227 41.2737 177.8098 142 K 3.9606 7.9526 115.0685 56.4439 32.6621 176.2726 143 N 3.9927 7.3596 117.1015 53.4220 37.6804 171.7879 144 E 3.6238 5.9000 114.2548 54.4486 33.5735 175.6084 145 W 4.3055 7.8840 120.3628 56.1495 29.7539 176.6996 146 K 3.7807 8.6847 124.1294 56.7687 32.2526 177.2659 147 K 4.1433 8.5417 122.5033 56.7922 32.0210 176.8693 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 4 S 8.33 4.25 0.00 3.81 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 5 V 7.55 3.80 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 0.74 0.00 0.00 0.92 0.00 0.00 6 V 8.99 4.23 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 0.91 0.00 0.00 0.97 0.00 0.00 7 K 8.07 4.76 0.00 1.81 1.75 0.00 1.87 0.00 0.00 1.81 0.00 0.00 2.87 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.41 1.41 7.81 8 S 8.72 4.21 0.00 3.93 3.99 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 9 E 8.19 4.29 0.00 2.01 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 2.23 2.24 0.00 10 D 7.74 4.68 0.00 2.87 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 11 Y 7.26 4.16 0.00 3.03 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 12 A 7.10 4.32 1.10 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 0.00 0.00 13 L 7.20 4.67 0.00 1.74 1.58 0.87 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 14 P 0.00 4.33 0.00 2.07 2.04 0.00 3.62 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 2.05 2.10 0.00 15 S 8.37 4.85 0.00 3.99 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 16 Y 8.35 4.53 0.00 3.01 2.98 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 17 V 6.92 4.23 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 0.67 0.00 0.00 0.84 0.00 0.00 18 D 8.38 4.64 0.00 2.62 2.54 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.87 4.51 0.00 1.82 1.92 0.00 3.08 0.00 0.00 3.25 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.56 0.00 20 R 8.67 3.52 0.00 1.78 2.06 0.00 3.26 0.00 0.00 3.24 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.48 0.00 21 D 7.95 4.76 0.00 2.83 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 22 Y 7.94 4.82 0.00 2.91 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 23 P 0.00 4.44 0.00 2.26 2.42 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 1.95 2.03 0.00 24 L 6.72 4.62 0.00 1.53 1.68 0.94 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 25 P 0.00 4.64 0.00 2.31 1.82 0.00 4.00 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 1.90 2.12 0.00 26 D 8.78 4.58 0.00 2.91 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 27 V 7.52 4.56 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 0.77 0.00 0.00 1.05 0.00 0.00 28 A 8.26 4.30 1.11 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 0.00 0.00 29 H 8.42 3.41 0.00 2.25 3.18 0.00 5.90 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 V 7.62 4.12 1.92 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 0.80 0.00 0.00 0.61 0.00 0.00 31 K 8.55 4.16 0.00 1.86 1.86 0.00 1.59 0.00 0.00 1.68 0.00 0.00 2.95 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.31 1.40 7.81 32 N 7.92 4.70 0.00 2.69 2.76 0.00 0.00 6.78 7.85 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 33 L 8.22 4.65 0.00 1.58 1.53 0.89 0.89 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 34 S 8.19 4.52 0.00 4.03 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 35 A 8.45 3.95 1.33 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 36 S 8.00 4.13 0.00 4.06 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 37 Q 7.88 3.96 0.00 2.29 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.83 0.00 0.00 0.00 0.00 0.00 2.50 2.38 0.00 38 K 8.62 3.91 0.00 1.93 1.86 0.00 1.66 0.00 0.00 1.64 0.00 0.00 3.10 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.45 1.64 7.81 39 A 7.95 4.00 1.42 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 40 L 8.03 3.94 0.00 1.87 1.88 0.98 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 41 K 8.12 4.03 0.00 1.93 1.86 0.00 1.75 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.68 1.60 7.81 42 E 8.03 4.13 0.00 2.16 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 2.48 2.46 0.00 43 K 8.52 4.01 0.00 1.88 2.00 0.00 1.66 0.00 0.00 1.71 0.00 0.00 2.93 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.50 1.49 7.81 44 E 8.26 4.26 0.00 2.19 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 2.64 2.39 0.00 45 K 8.04 4.25 0.00 1.88 1.88 0.00 1.76 0.00 0.00 1.73 0.00 0.00 3.33 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.53 1.74 7.81 46 A 7.59 4.45 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 47 S 8.39 3.96 0.00 3.81 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 48 W 8.47 4.69 0.00 3.47 3.11 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 49 S 7.99 4.29 0.00 3.92 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 50 S 7.88 4.39 0.00 4.13 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 51 L 7.64 4.51 0.00 2.00 1.64 1.01 0.84 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 52 S 9.13 4.55 0.00 4.03 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 53 I 8.23 3.65 1.87 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 1.64 0.96 0.90 0.00 0.00 54 D 8.15 4.38 0.00 2.72 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 55 E 8.25 4.08 0.00 2.19 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 2.34 2.35 0.00 56 K 8.41 3.94 0.00 1.97 1.81 0.00 1.68 0.00 0.00 1.56 0.00 0.00 2.93 0.00 0.00 3.32 0.00 0.00 0.00 0.00 1.40 1.62 7.81 57 V 8.13 3.63 2.24 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 1.10 0.00 0.00 0.91 0.00 0.00 58 E 8.35 3.96 0.00 2.19 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 2.31 2.36 0.00 59 L 8.03 3.98 0.00 1.90 1.62 0.86 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 60 Y 8.05 4.08 0.00 3.14 3.22 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 61 R 8.16 4.36 0.00 2.02 2.04 0.00 3.45 0.00 0.00 3.33 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 1.76 0.00 62 L 7.44 4.08 0.00 1.72 1.57 0.87 0.64 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 63 K 7.44 3.51 0.00 1.37 0.88 0.00 1.08 0.00 0.00 1.31 0.00 0.00 2.83 0.00 0.00 2.67 0.00 0.00 0.00 0.00 0.62 0.21 7.81 64 F 7.29 5.34 0.00 2.53 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 65 K 9.76 3.72 0.00 1.20 2.21 0.00 1.58 0.00 0.00 1.72 0.00 0.00 2.93 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.44 1.25 7.81 66 E 8.16 5.08 0.00 2.06 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 2.28 2.25 0.00 67 S 8.98 5.14 0.00 4.09 4.05 0.00 0.00 0.00 0.00 0.00 0.00 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 F 9.07 3.96 0.00 3.04 3.22 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 69 A 8.10 4.06 1.33 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 70 E 7.95 4.10 0.00 2.34 2.05 0.00 0.00 0.00 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 2.35 0.00 71 M 8.27 4.23 0.00 2.10 2.11 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.63 0.00 72 N 7.82 4.78 0.00 2.82 2.88 0.00 0.00 7.01 7.24 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 73 R 7.09 4.13 0.00 1.98 2.09 0.00 3.08 0.00 0.00 3.29 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.58 0.00 74 S 8.41 4.54 0.00 4.06 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 75 T 8.13 4.71 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 1.24 0.00 0.00 76 N 8.42 4.66 0.00 2.70 2.66 0.00 0.00 6.42 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 77 E 7.93 3.90 0.00 2.09 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 0.00 2.34 2.35 0.00 78 W 8.36 4.38 0.00 3.67 3.36 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 79 K 6.57 3.21 0.00 1.42 1.39 0.00 1.24 0.00 0.00 1.24 0.00 0.00 2.73 0.00 0.00 2.90 0.00 0.00 0.00 0.00 0.30 0.21 7.81 80 T 7.51 3.77 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 1.18 0.00 0.00 81 V 7.84 3.60 2.31 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 1.16 0.00 0.00 0.98 0.00 0.00 82 V 8.28 3.78 2.34 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 1.10 0.00 0.00 1.20 0.00 0.00 83 G 8.41 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.35 4.10 1.55 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 0.00 0.00 85 A 8.41 4.14 1.51 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 0.00 0.00 86 M 8.35 4.04 0.00 2.14 2.37 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.99 2.62 0.00 87 F 8.27 3.99 0.00 3.18 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 88 F 8.75 4.02 0.00 3.41 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 89 I 8.14 3.97 1.92 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.68 0.93 0.00 0.00 90 G 8.04 3.60 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 F 7.99 3.93 0.00 2.51 3.06 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 0.00 0.00 0.00 92 T 7.91 3.69 4.38 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 1.19 0.00 0.00 93 A 7.61 4.00 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 94 L 7.44 3.86 0.00 1.44 1.50 0.92 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 95 L 7.24 3.88 0.00 1.69 1.59 0.86 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 96 L 7.90 4.01 0.00 1.85 1.73 0.92 0.88 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 97 I 7.96 3.71 2.04 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.08 0.91 0.00 0.00 98 W 8.27 4.21 0.00 3.42 3.34 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 99 E 8.72 3.94 0.00 2.27 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 1.59 2.10 0.00 100 K 7.86 3.98 0.00 1.86 1.84 0.00 1.93 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.47 1.50 7.81 101 H 7.74 4.06 0.00 2.95 3.01 0.00 5.99 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 Y 7.39 4.18 0.00 1.49 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 0.00 0.00 0.00 103 V 7.25 4.04 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 0.71 0.00 0.00 0.89 0.00 0.00 104 Y 7.57 4.63 0.00 3.11 2.72 0.00 0.00 0.00 0.00 0.00 0.00 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 8.40 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 0.00 106 P 0.00 4.44 0.00 2.16 2.02 0.00 3.74 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 1.95 1.92 0.00 107 I 7.81 3.94 1.50 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 1.26 0.51 0.56 0.00 0.00 108 P 0.00 4.28 0.00 2.34 1.95 0.00 3.63 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 2.19 2.08 0.00 109 H 8.62 4.29 0.00 3.45 3.49 0.00 5.65 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 0.00 110 T 7.04 2.65 3.45 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 0.13 0.00 0.00 111 F 7.60 4.54 0.00 3.14 3.10 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 0.00 112 E 8.05 4.19 0.00 2.21 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 2.39 2.45 0.00 113 E 9.00 3.98 0.00 2.09 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 0.00 2.44 2.46 0.00 114 E 8.24 3.94 0.00 2.12 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 2.41 2.37 0.00 115 W 8.34 3.91 0.00 3.60 3.22 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 0.00 116 V 8.36 3.73 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 1.13 0.00 0.00 1.15 0.00 0.00 117 A 8.12 4.01 1.42 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 0.00 118 K 8.00 3.77 0.00 1.59 1.55 0.00 1.43 0.00 0.00 1.31 0.00 0.00 2.79 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.32 1.49 7.81 119 Q 8.32 3.80 0.00 2.07 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.81 0.00 0.00 0.00 0.00 0.00 2.34 2.41 0.00 120 T 8.23 3.96 4.45 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 1.48 0.00 0.00 121 K 7.98 3.62 0.00 1.67 1.83 0.00 1.54 0.00 0.00 1.48 0.00 0.00 2.84 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.47 1.26 7.81 122 R 8.13 3.80 0.00 1.78 1.98 0.00 3.07 0.00 0.00 3.08 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.62 0.00 123 M 8.27 3.98 0.00 1.79 2.25 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.41 0.00 124 L 8.02 4.13 0.00 1.58 1.30 -0.65 0.53 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 0.00 125 D 8.22 4.47 0.00 2.73 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 0.00 126 M 8.12 4.27 0.00 2.14 2.15 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.82 0.00 127 K 7.69 3.97 0.00 1.90 1.91 0.00 1.52 0.00 0.00 1.20 0.00 0.00 2.57 0.00 0.00 2.28 0.00 0.00 0.00 0.00 1.51 1.25 7.81 128 V 8.27 3.49 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 0.88 0.00 0.00 0.88 0.00 0.00 129 A 8.74 4.09 1.51 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 0.00 0.00 130 P 0.00 4.54 0.00 2.24 2.36 0.00 3.83 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 2.03 2.02 0.00 131 I 7.88 4.08 1.92 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 1.44 0.44 0.94 0.00 0.00 132 Q 8.10 4.67 0.00 2.04 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.02 0.00 0.00 0.00 0.00 0.00 2.30 2.40 0.00 133 G 8.45 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 0.00 0.00 0.00 134 F 8.15 4.74 0.00 3.17 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 0.00 135 S 9.31 4.29 0.00 4.21 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 0.00 136 A 8.24 4.29 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 0.00 137 K 8.44 4.53 0.00 2.12 1.95 0.00 1.76 0.00 0.00 1.55 0.00 0.00 2.87 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.45 1.44 7.81 138 W 8.10 4.60 0.00 2.75 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 0.00 139 D 7.50 4.46 0.00 2.34 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 0.00 0.00 0.00 0.00 140 Y 8.48 4.27 0.00 3.09 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 0.00 141 D 8.29 4.53 0.00 2.77 2.70 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 0.00 142 K 7.95 3.96 0.00 1.55 1.70 0.00 1.82 0.00 0.00 1.54 0.00 0.00 2.90 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.39 1.28 7.81 143 N 7.36 3.99 0.00 2.76 2.75 0.00 0.00 6.93 9.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 E 5.90 3.62 0.00 1.73 1.67 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 1.86 1.93 0.00 145 W 7.88 4.31 0.00 3.21 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 0.00 146 K 8.68 3.78 0.00 1.68 1.78 0.00 1.83 0.00 0.00 1.71 0.00 0.00 2.91 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.41 1.43 7.81 147 K 8.54 4.14 0.00 1.72 1.71 0.00 1.74 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.41 1.38 7.81