NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -5 H 4.7082 8.4449 117.8140 55.8798 29.0299 172.3033 -4 H 4.4369 8.2104 120.6050 55.4977 29.3917 174.0358 -3 H 4.7635 9.6298 118.8109 55.7104 31.2206 173.1319 -2 H 4.9713 7.7899 115.3805 53.5197 32.0286 173.1149 -1 H 4.3715 8.4393 118.3336 56.5228 29.1563 174.9588 0 H 4.9209 8.1864 118.5917 54.2481 32.7405 172.9917 1 M 4.4514 8.5428 122.2941 55.6890 33.0134 175.4059 2 K 4.7750 9.4479 124.6151 54.5454 35.7759 175.1568 3 V 4.7568 8.3789 122.7362 61.2476 34.3601 173.9771 4 Y 4.8005 9.0705 128.2370 55.9181 41.9960 173.7723 5 F 5.2759 8.2326 124.2323 56.0628 42.1965 173.7566 6 D 4.6710 9.0184 120.4914 53.4726 45.5171 173.2030 7 D 5.1930 8.3564 119.0237 52.4082 44.6639 175.3495 8 I 4.2496 8.7167 123.8144 59.6032 39.8591 173.9897 9 Y 5.3855 8.3964 124.4667 56.2646 39.9753 175.3179 10 V 4.5719 9.2161 124.0017 61.1598 35.2060 174.0683 11 S 5.3871 8.8112 122.8293 57.0138 64.7673 173.4080 12 T 4.6610 9.2203 114.8132 60.1409 70.6916 175.0800 13 A 4.4533 10.6000 125.8836 52.6787 20.7479 177.3498 14 R 4.7420 7.8355 113.1611 53.9891 33.7429 176.3169 15 Q 4.5353 8.6773 120.4358 58.5630 29.8332 175.7995 16 F 5.4343 8.0573 115.9443 55.7964 41.0427 174.8489 17 E 4.8468 9.4377 122.0810 55.0871 34.5937 173.9523 18 L 5.1643 8.5449 122.2629 53.1068 43.9736 175.9182 19 V 4.4045 8.9720 125.0326 60.9079 33.7107 174.0982 20 D 4.4510 9.0214 129.1492 53.7390 41.6097 175.6094 21 I 4.6540 8.3666 118.6274 60.0769 38.3048 177.4939 22 T 3.6493 8.2354 120.5064 67.3218 68.0863 176.0523 23 D 4.2775 7.8930 120.0117 57.4624 40.6923 178.6578 24 Q 3.9446 7.9489 117.9731 59.0076 28.7182 179.0066 25 V 3.5501 7.9203 119.3275 66.0098 31.4536 177.8957 26 E 3.8865 8.4599 118.7460 59.4319 29.2436 179.3072 27 Q 3.9667 8.2367 118.1561 58.9895 28.7068 179.0505 28 I 3.7649 7.7534 120.7078 64.3342 36.9663 178.3481 29 V 3.5412 7.6162 117.7764 66.2510 31.4367 177.4997 30 E 4.0339 8.3410 118.2132 59.4607 29.1333 179.4489 31 K 3.8625 8.2249 118.7631 59.2146 32.2488 178.5660 32 S 2.7900 7.5932 114.3812 58.9502 62.8062 175.8060 33 G 3.8296 7.4912 108.4822 45.1702 0.0000 173.4539 34 I 3.9696 7.4664 121.1723 60.9873 38.0402 175.9031 35 K 4.3151 9.0813 124.3391 57.4414 33.2979 176.6499 36 N 5.5122 8.2459 115.5791 50.6669 42.9133 173.3740 37 G 4.3593 7.8400 112.2368 46.2436 0.0000 171.4362 38 I 5.1117 8.1919 116.6800 59.2146 41.9137 174.5538 39 C 5.1666 9.2107 123.7364 57.7015 34.1151 172.2353 40 L 5.0087 9.0649 129.9648 53.9797 43.6366 175.0588 41 I 4.9956 8.8784 127.2944 59.5654 39.9792 174.4504 42 F 5.3262 9.3173 129.0598 56.6626 43.0471 173.2713 43 V 4.6286 7.8838 119.2806 58.8775 33.6058 175.9636 44 A 4.5893 7.4475 126.9547 52.5620 19.3724 176.8046 45 H 4.9670 7.6570 115.9990 55.4462 32.6183 174.1391 46 S 4.6120 8.6214 116.0226 58.6910 63.3618 174.7217 47 T 4.6229 7.6940 110.0558 61.2632 70.1872 172.6499 48 A 4.9260 7.9547 121.8883 50.8889 23.1137 174.7853 49 A 4.7381 8.8375 119.5678 51.0324 23.6031 175.0394 50 I 5.0532 8.1827 118.9520 59.9189 39.6843 176.1086 51 V 4.8218 8.9883 118.5524 59.6339 36.6800 174.1734 52 A 5.3112 8.3713 122.1870 51.1886 21.8057 175.1920 53 N 4.7217 9.2203 120.0889 53.3982 43.4764 172.1385 54 E 5.2022 8.9532 119.0698 55.7600 30.6897 177.8672 55 H 4.8232 9.1734 127.0567 55.2153 28.7461 173.0005 56 E 4.7434 8.1881 123.6767 52.9743 33.4357 174.9332 57 R 4.0110 8.8984 125.7210 59.4171 30.1903 179.1241 58 G 3.6071 8.3655 104.7266 47.9006 0.0000 175.2041 59 L 4.1533 8.5310 125.1317 57.3908 42.0075 178.8806 60 M 3.8617 8.2103 118.7529 58.4277 31.8124 178.6388 61 E 3.9524 8.1179 118.5670 59.2887 29.0849 179.0045 62 D 4.3024 8.1696 119.1117 57.4232 40.8330 178.8319 63 I 3.6554 7.9119 120.4407 64.6135 37.0955 178.6102 64 L 3.9699 7.6619 119.1695 57.8007 41.2955 179.7905 65 T 3.6907 7.9954 115.9732 66.2855 68.3552 176.5035 66 K 3.8326 8.3306 121.9058 59.6138 32.2101 178.5744 67 I 3.7352 7.9269 120.2392 64.5018 36.9892 178.4241 68 K 3.8146 7.9935 119.0688 59.6218 31.6254 179.2558 69 E 3.9541 8.1048 117.5831 59.3232 29.4129 178.9455 70 F 4.4066 8.3362 120.2477 61.1797 39.5768 176.6841 71 T 4.0376 8.1182 107.3945 60.7612 70.7622 173.9429 72 E 3.8015 8.5443 122.4149 56.2616 26.6560 173.0874 73 P 4.4083 0.0000 0.0000 65.0299 31.9905 177.7620 74 S 4.4971 7.9066 110.0370 58.2830 63.6616 174.2554 75 R 3.8726 7.5488 122.0687 56.3126 30.7859 176.9875 76 S 4.4795 7.8944 120.6511 57.3371 61.7706 174.5075 77 W 4.5720 7.4797 122.1863 56.4296 30.4867 178.2483 78 K 4.0717 9.0299 120.9921 59.9498 31.5308 179.0571 79 H 4.1887 8.4944 118.0161 59.3129 29.4498 176.3398 80 N 4.8588 7.9021 117.7201 54.4203 38.4538 176.6829 81 L 4.1174 7.7536 120.3607 57.2383 41.6977 178.4825 82 I 4.2161 7.3216 118.2583 61.7518 38.3012 176.0323 83 D 4.4707 6.9541 116.6931 53.3891 43.8788 175.3791 84 D 5.0113 8.7388 128.3150 53.9777 39.6545 176.0144 85 N 4.9943 8.1236 113.6521 52.8865 38.5500 175.6843 86 A 3.9970 8.8968 123.9372 56.6680 18.2370 179.9685 87 H 4.0159 8.3950 112.6084 58.8781 28.3709 177.5249 88 A 3.9466 7.4413 123.3569 55.1268 18.1240 179.3239 89 H 4.3295 7.8840 115.5543 58.4170 28.8475 177.8291 90 L 4.0771 8.0657 120.9930 57.7304 41.3616 179.8445 91 G 3.7435 8.3830 105.5125 47.8822 0.0000 175.5212 92 A 4.0429 8.3377 123.8033 55.1459 18.1268 179.9320 93 T 3.8290 7.9588 113.3548 66.8984 68.6361 176.7549 94 F 4.1082 8.3400 118.5472 60.3845 39.0413 177.4944 95 L 4.2351 8.2274 118.1171 55.0412 42.3166 178.5924 96 G 3.9587 8.2549 104.6209 45.5222 0.0000 173.5948 97 A 4.4583 8.4121 121.2152 52.4791 19.7899 176.5965 98 E 5.3254 7.8915 111.8039 54.9097 33.0151 174.8289 99 R 4.8854 9.1009 118.7121 54.5325 34.9042 174.3365 100 V 4.9911 8.4375 120.5002 61.3055 34.1263 174.6220 101 F 4.9430 9.4177 126.0840 54.9291 42.5485 173.3112 102 P 4.7825 0.0000 0.0000 62.5901 32.9781 175.3220 103 V 4.8219 8.6608 121.9251 61.2109 34.3216 174.3912 104 R 4.8674 9.0756 127.9737 55.3180 33.6329 174.8025 105 E 3.8443 10.5299 126.3591 57.5457 27.7278 176.0639 106 G 3.9481 8.7167 105.0829 45.2073 0.0000 173.9353 107 K 4.5627 7.9096 119.2347 54.1357 35.0278 175.1283 108 L 4.4495 8.3239 123.7011 55.2586 42.6320 176.2014 109 V 4.1657 8.7331 128.1829 62.5021 31.8449 175.1751 110 R 4.8785 8.3608 123.0245 55.0695 32.5053 174.9828 111 G 3.8538 9.7952 109.5722 45.3360 0.0000 174.9247 112 T 3.4695 8.2321 116.8491 65.5707 68.5182 175.4380 113 W 4.7791 7.8856 119.7967 56.4326 29.7301 174.6619 114 Q 4.6382 7.9234 121.3768 54.6515 29.1104 174.1264 115 N 4.9808 9.6852 123.7599 51.3960 42.0569 173.7201 116 I 4.8172 8.3929 122.2030 59.9293 39.4497 174.9016 117 F 5.4052 9.1743 125.3558 55.4246 42.8966 174.0172 118 L 4.6633 9.0485 125.9872 54.8968 43.5210 175.5569 119 V 4.6463 9.1515 127.2402 61.5071 33.0872 173.8205 120 E 4.8207 9.4005 130.8478 55.0683 30.6632 176.0013 121 L 4.5811 8.3037 124.8984 53.8422 43.4930 176.0392 122 D 4.5695 8.3890 119.5900 53.2624 40.7800 175.0049 123 G 4.4548 8.5395 106.5443 43.8182 0.0000 171.9511 124 P 5.0203 0.0000 0.0000 62.0254 32.5471 176.1281 125 R 4.7257 8.7998 120.5865 54.5263 33.3334 176.8905 126 S 4.2307 8.9628 118.0731 60.4631 63.5677 173.6215 127 E 4.6665 7.8845 118.6683 54.6336 31.9724 175.0541 128 R 4.6397 9.5554 124.9558 54.6612 33.1473 175.1046 129 H 5.5242 9.3073 122.4764 54.5806 33.0102 171.9921 130 I 4.7928 8.9229 127.2544 59.8923 39.4832 174.9199 131 T 4.7048 8.9603 125.1705 62.9448 70.0312 173.9139 132 V 4.8610 8.9310 126.5756 61.0267 34.3612 173.6388 133 E 4.8043 9.2774 129.0694 54.3591 32.4295 174.2496 134 I 4.9368 8.7239 128.0559 59.5032 39.9869 174.4245 135 L 5.0184 9.7050 127.9968 52.1639 45.3475 176.5596 136 G 3.9335 7.6955 112.5869 46.1177 0.0000 172.2245 137 E 4.2455 8.1965 118.8056 56.4130 29.7745 175.6663 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 -5 H 8.44 4.71 0.00 3.18 3.30 0.00 5.67 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 -4 H 8.21 4.44 0.00 3.25 3.27 0.00 5.64 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 -3 H 9.63 4.76 0.00 3.06 3.19 0.00 5.64 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -2 H 7.79 4.97 0.00 3.03 3.09 0.00 5.90 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -1 H 8.44 4.37 0.00 3.07 3.19 0.00 5.88 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0 H 8.19 4.92 0.00 3.06 3.10 0.00 5.70 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1 M 8.54 4.45 0.00 2.04 1.96 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.57 0.00 2 K 9.45 4.77 0.00 1.68 1.67 0.00 1.65 0.00 0.00 1.57 0.00 0.00 2.77 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.36 1.45 7.81 3 V 8.38 4.76 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 0.44 0.00 0.00 0.89 0.00 0.00 4 Y 9.07 4.80 0.00 2.96 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 5 F 8.23 5.28 0.00 2.74 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 6 D 9.02 4.67 0.00 2.54 2.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 D 8.36 5.19 0.00 2.21 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 0.00 0.00 0.00 8 I 8.72 4.25 1.80 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.58 0.88 0.00 0.00 9 Y 8.40 5.39 0.00 2.89 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 10 V 9.22 4.57 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 1.02 0.00 0.00 0.97 0.00 0.00 11 S 8.81 5.39 0.00 3.79 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 12 T 9.22 4.66 4.36 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 1.22 0.00 0.00 13 A 10.60 4.45 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 14 R 7.84 4.74 0.00 1.98 1.86 0.00 3.26 0.00 0.00 3.26 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.13 0.00 15 Q 8.68 4.54 0.00 2.07 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.88 0.00 0.00 0.00 0.00 0.00 1.56 1.99 0.00 16 F 8.06 5.43 0.00 2.97 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 17 E 9.44 4.85 0.00 1.90 1.83 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 2.27 2.43 0.00 18 L 8.54 5.16 0.00 1.40 1.38 0.62 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 19 V 8.97 4.40 2.16 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 1.07 0.00 0.00 0.99 0.00 0.00 20 D 9.02 4.45 0.00 2.79 2.58 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.37 4.65 1.82 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 1.37 1.26 0.96 0.00 0.00 22 T 8.24 3.65 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 1.07 0.00 0.00 23 D 7.89 4.28 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 24 Q 7.95 3.94 0.00 2.23 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.91 0.00 0.00 0.00 0.00 0.00 2.43 2.46 0.00 25 V 7.92 3.55 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 0.93 0.00 0.00 0.87 0.00 0.00 26 E 8.46 3.89 0.00 2.20 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 0.00 2.27 2.27 0.00 27 Q 8.24 3.97 0.00 2.29 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.81 0.00 0.00 0.00 0.00 0.00 2.36 2.57 0.00 28 I 7.75 3.76 2.06 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 1.63 0.77 1.09 0.00 0.00 29 V 7.62 3.54 2.22 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 0.79 0.00 0.00 0.92 0.00 0.00 30 E 8.34 4.03 0.00 2.26 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 2.33 2.19 0.00 31 K 8.22 3.86 0.00 2.06 1.95 0.00 1.93 0.00 0.00 1.75 0.00 0.00 3.01 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.45 1.32 7.81 32 S 7.59 2.79 0.00 3.72 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 33 G 7.49 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 0.00 0.00 0.00 34 I 7.47 3.97 1.81 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 1.26 0.50 0.89 0.00 0.00 35 K 9.08 4.32 0.00 1.71 1.81 0.00 1.59 0.00 0.00 1.61 0.00 0.00 2.84 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.36 1.51 7.81 36 N 8.25 5.51 0.00 2.79 2.64 0.00 0.00 6.91 7.58 0.00 0.00 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 G 7.84 4.36 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 0.00 0.00 0.00 38 I 8.19 5.11 1.90 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 1.11 0.90 0.92 0.00 0.00 39 C 9.21 5.17 0.00 2.97 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 40 L 9.06 5.01 0.00 1.80 1.54 1.05 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 41 I 8.88 5.00 1.96 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 1.05 0.76 0.94 0.00 0.00 42 F 9.32 5.33 0.00 3.06 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 43 V 7.88 4.63 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 0.68 0.00 0.00 0.79 0.00 0.00 44 A 7.45 4.59 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 45 H 7.66 4.97 0.00 3.03 3.08 0.00 5.69 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 46 S 8.62 4.61 0.00 4.03 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 47 T 7.69 4.62 4.09 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 0.89 0.00 0.00 48 A 7.95 4.93 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 49 A 8.84 4.74 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 50 I 8.18 5.05 1.92 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 1.29 1.01 1.01 0.00 0.00 51 V 8.99 4.82 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 0.79 0.00 0.00 1.03 0.00 0.00 52 A 8.37 5.31 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 53 N 9.22 4.72 0.00 2.83 2.74 0.00 0.00 6.45 7.19 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 54 E 8.95 5.20 0.00 2.27 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 2.41 2.41 0.00 55 H 9.17 4.82 0.00 3.42 3.37 0.00 5.92 0.00 0.00 0.00 0.00 6.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 E 8.19 4.74 0.00 2.03 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 2.30 2.33 0.00 57 R 8.90 4.01 0.00 1.96 1.99 0.00 3.31 0.00 0.00 3.43 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.81 0.00 58 G 8.37 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.53 4.15 0.00 1.79 1.82 0.88 0.84 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 M 8.21 3.86 0.00 1.96 2.18 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.16 0.00 61 E 8.12 3.95 0.00 2.26 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 2.33 2.22 0.00 62 D 8.17 4.30 0.00 2.81 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 63 I 7.91 3.66 1.89 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 1.44 0.76 0.82 0.00 0.00 64 L 7.66 3.97 0.00 1.61 1.62 0.98 1.20 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 65 T 8.00 3.69 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 1.15 0.00 0.00 66 K 8.33 3.83 0.00 1.83 1.90 0.00 1.51 0.00 0.00 1.60 0.00 0.00 2.94 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.36 1.45 7.81 67 I 7.93 3.74 2.00 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.62 1.04 0.00 0.00 68 K 7.99 3.81 0.00 1.82 1.60 0.00 1.78 0.00 0.00 1.65 0.00 0.00 2.89 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.46 1.36 7.81 69 E 8.10 3.95 0.00 2.07 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 2.32 2.44 0.00 70 F 8.34 4.41 0.00 2.87 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 71 T 8.12 4.04 4.37 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 1.44 0.00 0.00 72 E 8.54 3.80 0.00 2.48 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 2.39 2.53 0.00 73 P 0.00 4.41 0.00 2.07 1.97 0.00 3.68 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.15 0.00 74 S 7.91 4.50 0.00 3.96 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 75 R 7.55 3.87 0.00 1.46 1.38 0.00 2.61 0.00 0.00 2.25 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.97 0.00 76 S 7.89 4.48 0.00 3.78 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 77 W 7.48 4.57 0.00 3.46 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 78 K 9.03 4.07 0.00 1.86 1.93 0.00 1.75 0.00 0.00 1.79 0.00 0.00 2.93 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.66 1.52 7.81 79 H 8.49 4.19 0.00 3.20 3.34 0.00 5.86 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 N 7.90 4.86 0.00 3.04 2.92 0.00 0.00 6.98 7.82 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 81 L 7.75 4.12 0.00 1.76 1.74 0.94 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 82 I 7.32 4.22 1.90 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 1.39 0.51 0.87 0.00 0.00 83 D 6.95 4.47 0.00 2.64 2.30 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 0.00 84 D 8.74 5.01 0.00 2.86 2.77 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 85 N 8.12 4.99 0.00 2.74 2.98 0.00 0.00 5.97 7.47 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 86 A 8.90 4.00 1.44 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 87 H 8.39 4.02 0.00 3.57 3.83 0.00 5.47 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 A 7.44 3.95 1.18 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 0.00 0.00 89 H 7.88 4.33 0.00 3.25 3.23 0.00 5.91 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 L 8.07 4.08 0.00 1.66 1.51 -0.40 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 91 G 8.38 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 92 A 8.34 4.04 1.44 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 93 T 7.96 3.83 4.54 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 1.14 0.00 0.00 94 F 8.34 4.11 0.00 3.24 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 95 L 8.23 4.24 0.00 1.74 1.77 0.97 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 96 G 8.25 3.96 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 0.00 0.00 0.00 97 A 8.41 4.46 1.03 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 0.00 0.00 98 E 7.89 5.33 0.00 2.29 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 0.00 2.28 2.44 0.00 99 R 9.10 4.89 0.00 1.99 2.00 0.00 3.24 0.00 0.00 3.14 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.86 0.00 100 V 8.44 4.99 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 0.86 0.00 0.00 0.99 0.00 0.00 101 F 9.42 4.94 0.00 2.93 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 0.00 102 P 0.00 4.78 0.00 2.11 1.98 0.00 3.84 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 2.12 2.07 0.00 103 V 8.66 4.82 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 1.13 0.00 0.00 0.94 0.00 0.00 104 R 9.08 4.87 0.00 1.83 1.69 0.00 3.29 0.00 0.00 3.17 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.58 0.00 105 E 10.53 3.84 0.00 2.03 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 2.26 2.37 0.00 106 G 8.72 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 0.00 107 K 7.91 4.56 0.00 1.86 1.86 0.00 1.30 0.00 0.00 1.60 0.00 0.00 2.87 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.32 7.81 108 L 8.32 4.45 0.00 1.60 1.57 0.87 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 109 V 8.73 4.17 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 0.84 0.00 0.00 0.95 0.00 0.00 110 R 8.36 4.88 0.00 2.14 2.17 0.00 3.34 0.00 0.00 3.11 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.64 0.00 111 G 9.80 3.85 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 0.00 0.00 0.00 112 T 8.23 3.47 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 -0.18 0.00 0.00 113 W 7.89 4.78 0.00 3.61 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 0.00 114 Q 7.92 4.64 0.00 2.19 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.11 6.71 0.00 0.00 0.00 0.00 0.00 2.49 2.44 0.00 115 N 9.69 4.98 0.00 2.87 2.32 0.00 0.00 6.75 8.00 0.00 0.00 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 I 8.39 4.82 1.65 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.43 0.86 0.00 0.00 117 F 9.17 5.41 0.00 2.96 2.90 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 0.00 118 L 9.05 4.66 0.00 1.81 1.60 1.01 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 119 V 9.15 4.65 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 0.92 0.00 0.00 0.99 0.00 0.00 120 E 9.40 4.82 0.00 2.08 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 2.21 2.44 0.00 121 L 8.30 4.58 0.00 1.68 1.68 1.03 1.21 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 0.00 122 D 8.39 4.57 0.00 2.43 2.43 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 0.00 123 G 8.54 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 0.00 0.00 0.00 0.00 124 P 0.00 5.02 0.00 2.08 2.23 0.00 3.29 0.00 0.00 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.83 0.00 125 R 8.80 4.73 0.00 1.73 1.78 0.00 3.25 0.00 0.00 3.18 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.66 0.00 126 S 8.96 4.23 0.00 3.97 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 0.00 127 E 7.88 4.67 0.00 1.84 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 2.15 2.29 0.00 128 R 9.56 4.64 0.00 1.86 1.84 0.00 2.89 0.00 0.00 2.89 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.66 0.00 129 H 9.31 5.52 0.00 3.39 3.22 0.00 5.65 0.00 0.00 0.00 0.00 6.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 I 8.92 4.79 1.86 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.36 0.92 0.00 0.00 131 T 8.96 4.70 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 1.39 0.00 0.00 132 V 8.93 4.86 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 1.04 0.00 0.00 0.93 0.00 0.00 133 E 9.28 4.80 0.00 1.86 1.64 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 1.80 1.47 0.00 134 I 8.72 4.94 1.93 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 1.11 0.35 0.94 0.00 0.00 135 L 9.70 5.02 0.00 1.58 1.40 0.93 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 136 G 7.70 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 0.00 137 E 8.20 4.25 0.00 2.14 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 2.22 0.00