NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 13 A 4.2291 8.1227 123.6120 53.0619 21.6875 179.6363 14 E 3.0806 9.5646 117.7400 55.7704 31.1234 175.4689 15 A 3.9809 9.4580 121.2994 55.3113 19.7146 180.9563 16 G 3.5957 7.4801 102.4792 47.6940 0.0000 174.9898 17 I 3.8937 7.3802 120.2512 63.8807 37.4718 177.0187 18 T 3.8189 6.8437 115.3829 63.8669 68.9504 174.5864 19 G 3.6359 7.5429 111.9758 44.6183 0.0000 171.1808 20 T 4.7600 7.5888 116.7534 61.6616 70.3028 174.5472 21 W 4.9984 9.0758 125.0454 55.0521 33.7976 173.8455 22 Y 5.5900 9.3432 119.4281 56.4638 41.6954 174.6822 23 N 5.8563 8.8652 119.5995 49.9697 40.4494 175.2168 24 Q 4.1934 8.7044 115.6616 58.1829 28.6937 176.8576 25 L 4.2704 8.0862 117.4594 55.1865 42.3862 177.3418 26 G 4.0628 8.2289 106.8769 45.0855 0.0000 173.7753 27 S 4.7238 8.8473 116.2771 58.3995 64.6187 173.2936 28 T 5.0681 8.5637 117.6263 61.9002 72.3840 173.1083 29 F 4.9974 8.8290 126.4511 56.5866 43.2386 173.0273 30 I 4.7342 8.3638 126.5246 59.5464 39.9287 175.1071 31 V 4.6717 8.3485 118.9153 59.8277 36.6879 174.3556 32 T 4.7165 8.5715 118.3390 61.7232 71.8891 172.7965 33 A 4.8302 8.8440 129.1885 50.2760 20.3398 176.5761 34 G 4.0325 9.4730 110.5588 44.9417 0.0000 174.7288 35 A 4.2957 8.4920 124.3278 54.7235 18.6609 179.1599 36 D 4.7048 7.9150 114.2324 54.2332 41.2627 177.5670 37 G 3.0373 7.7987 105.6288 45.3248 0.0000 173.1131 38 A 5.0407 7.7074 121.1363 50.6865 21.2858 176.6603 39 L 5.3094 8.8210 120.0788 53.1583 45.3714 175.9772 40 T 4.9539 8.9952 112.8813 59.7005 72.7585 174.5466 41 G 3.9543 7.0720 108.8232 46.3708 0.0000 171.3395 42 T 5.2378 7.5119 108.9697 60.1533 72.8605 172.4912 43 Y 4.9984 9.3130 123.6890 55.8283 42.6555 173.7680 44 E 5.4683 8.9839 126.5527 53.4642 32.5771 174.5443 45 S 5.0253 9.4124 121.9373 57.7386 63.3586 173.6590 46 A 4.3941 8.8568 129.6413 53.1333 18.8547 177.0077 47 V 4.3772 7.4492 108.0005 60.2022 35.9201 175.5973 48 G 3.5620 8.4761 108.4225 44.9142 0.0000 173.5844 49 N 4.5475 7.9024 115.3807 51.5958 37.2658 174.0033 50 A 4.9349 7.4628 122.4760 50.5306 22.6637 175.6520 51 E 4.6391 9.5563 120.7116 55.9070 33.2180 176.8563 52 S 3.8188 8.6338 119.3483 58.3944 61.4547 168.6395 53 R 5.1212 8.3968 116.5238 55.2460 32.0086 175.5227 54 Y 4.7701 9.1852 119.6369 55.9867 41.8543 175.2170 55 V 4.4380 8.4898 122.2500 62.7638 32.5217 175.1158 56 L 5.4379 8.7118 126.2371 53.4075 44.2126 175.1037 57 T 4.7862 8.2524 113.4821 61.4128 71.5100 173.0991 58 G 4.7231 8.5860 111.6546 46.5214 0.0000 172.0900 59 R 5.6730 8.6455 117.4355 55.0465 34.6992 174.0637 60 Y 5.2282 8.8404 118.5670 55.4198 42.4549 174.0116 61 D 4.5552 8.9515 120.3418 53.8174 40.6407 176.6415 62 S 4.4585 8.1706 120.5839 58.7846 63.9700 174.4401 63 A 4.6724 8.0189 123.2902 50.0876 18.4544 173.6553 64 P 4.8160 0.0000 0.0000 60.7586 32.8130 177.1546 65 A 4.1872 8.3020 122.0856 52.6965 18.7320 177.1888 66 T 4.4991 8.4223 110.9204 61.7718 69.4037 174.3109 67 D 5.1888 7.7870 123.4531 52.5920 41.9503 175.1318 68 G 3.9869 8.4007 104.6946 46.4393 0.0000 174.0910 69 S 4.5247 8.0575 115.0313 57.1328 64.2341 174.7985 70 G 4.2754 8.2980 109.8437 45.7463 0.0000 172.7416 71 T 4.8324 8.8646 116.7526 61.6436 70.3143 174.8979 72 A 4.8580 8.7329 128.9423 52.2085 20.1055 175.8330 73 L 4.8995 8.9433 119.9134 55.6424 44.5830 173.8190 74 G 4.6564 9.1059 104.9754 45.8050 0.0000 172.2534 75 W 5.7114 8.5370 117.1151 55.7582 32.2414 173.3881 76 T 5.3047 9.2748 116.7563 61.9091 72.3770 173.3986 77 V 4.6871 8.7176 123.6445 61.1365 34.7532 173.7578 78 A 4.5732 8.3777 129.6838 49.4707 20.3111 177.9085 79 W 4.2919 8.3176 126.4256 55.4237 27.9814 176.2195 80 K 5.2785 7.8622 118.2808 54.7845 35.2333 174.6964 81 N 4.8458 9.0295 122.4480 52.3782 39.5109 174.2111 82 N 4.2523 8.4575 113.9738 55.4800 38.9825 175.4036 83 Y 4.5137 7.3741 115.4781 59.1506 39.1906 175.7090 84 R 4.7499 8.6655 116.7475 54.8333 34.4679 174.0703 85 N 5.0744 8.4421 117.2684 53.0335 39.6857 173.5187 86 A 4.2667 9.1687 128.5980 51.7849 19.8390 176.6120 87 H 4.1355 8.5901 114.0348 55.9270 26.9162 173.1270 88 S 5.2249 7.3357 112.2452 57.7310 67.0470 174.6856 89 A 5.0628 9.1076 121.1741 50.8104 22.8478 175.2665 90 T 4.9840 8.8166 117.7976 61.7241 72.2036 173.2900 91 T 4.8945 8.4181 115.0798 59.6006 72.1477 172.5966 92 W 4.8956 8.8430 125.0307 54.7272 31.8642 174.5715 93 S 4.9549 8.5036 119.3717 56.8658 64.7098 172.9547 94 G 4.5024 8.5921 113.5782 46.5224 0.0000 171.7390 95 Q 5.2565 8.5737 117.6645 54.9800 32.4471 173.2735 96 Y 4.9837 9.2293 122.9935 56.3886 40.8685 174.2905 97 V 4.1915 8.4044 126.6269 61.1657 34.3323 175.6049 98 G 3.9499 7.9220 117.8813 43.4192 0.0000 169.6609 99 G 3.6392 9.1148 103.6545 43.7691 0.0000 173.1085 100 A 4.1635 8.7497 121.5713 54.9053 18.1283 178.5745 101 E 4.5655 7.7320 113.8443 54.0775 29.0513 174.9444 102 A 4.4599 7.9984 129.1212 53.1792 19.6932 176.9990 103 R 5.3954 8.8585 116.7356 55.4832 33.8660 173.7904 104 I 4.9630 8.8669 119.8027 59.7080 40.6586 174.3203 105 N 5.4473 9.1735 125.1039 51.8890 40.8234 174.2975 106 T 5.2821 8.9583 112.4515 60.4968 73.3754 172.4377 107 Q 4.9186 8.9752 119.8468 53.8740 33.2039 174.7106 108 W 5.4279 8.4377 118.4043 54.7176 32.4229 173.7636 109 L 5.2220 8.6903 120.1711 52.9142 44.8903 175.2604 110 L 4.9855 9.3855 126.5292 53.7712 44.4560 174.8775 111 T 5.1141 8.7833 123.7073 61.9838 71.0156 173.9353 112 S 5.1415 8.8078 122.3199 56.6092 65.3669 174.1977 113 G 3.9410 8.7336 111.4075 46.3514 0.0000 173.0832 114 T 4.7849 8.2931 113.9507 59.8492 72.5888 172.9009 115 T 4.3560 7.9747 110.9605 60.2954 70.3665 175.4240 116 E 3.9518 8.8198 121.2078 59.6214 29.7054 179.7082 117 A 4.0584 8.1200 120.3459 54.9675 18.7488 177.6464 118 N 4.6957 8.1345 110.6083 53.0037 39.1044 176.8218 119 A 4.1243 8.0257 124.2514 54.2158 18.5852 180.4116 120 W 4.3482 8.3879 112.1171 58.6716 28.0274 176.7393 121 K 4.1405 6.7477 117.5466 56.1686 32.1207 177.3637 122 S 4.2078 7.9440 116.1678 60.7338 63.5321 173.3033 123 T 5.1002 7.6325 117.6161 61.7337 70.7156 173.4265 124 L 4.8674 9.0932 126.9117 53.1367 44.3204 175.9338 125 V 4.4404 7.8709 120.6582 60.2797 34.5184 174.9380 126 G 3.1568 6.3474 108.0022 45.6811 0.0000 171.0797 127 H 5.3285 8.0501 113.9658 54.0398 31.6149 172.6602 128 D 5.2686 9.1732 120.0945 52.9225 45.4763 174.6289 129 T 5.1436 8.9928 118.0397 61.9163 71.8345 172.9110 130 F 5.6238 9.4551 125.6726 56.0619 41.7524 174.9678 131 T 5.4055 9.4356 112.4208 60.1096 72.1792 174.7280 132 K 3.7958 8.8008 119.8538 56.9456 32.6769 177.2136 133 V 4.5192 7.6354 118.0085 60.6127 34.0232 175.2053 134 K 4.2089 8.1559 122.2364 56.9789 32.4594 175.9052 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 13 A 8.12 4.23 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 9.56 3.08 0.00 2.40 1.72 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 2.37 2.41 0.00 15 A 9.46 3.98 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 16 G 7.48 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 17 I 7.38 3.89 1.51 0.00 0.00 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.42 -0.36 0.54 0.00 0.00 18 T 6.84 3.82 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 1.14 0.00 0.00 19 G 7.54 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 20 T 7.59 4.76 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 0.83 0.00 0.00 21 W 9.08 5.00 0.00 3.29 3.29 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 22 Y 9.34 5.59 0.00 2.96 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 23 N 8.87 5.86 0.00 2.42 1.67 0.00 0.00 6.83 6.98 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 24 Q 8.70 4.19 0.00 2.21 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 7.04 0.00 0.00 0.00 0.00 0.00 2.35 2.35 0.00 25 L 8.09 4.27 0.00 1.88 1.81 1.01 1.05 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 26 G 8.23 4.06 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 0.00 0.00 0.00 27 S 8.85 4.72 0.00 4.08 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 28 T 8.56 5.07 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 1.06 0.00 0.00 29 F 8.83 5.00 0.00 2.29 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 0.00 0.00 0.00 0.00 30 I 8.36 4.73 1.68 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.48 0.74 0.00 0.00 31 V 8.35 4.67 1.16 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 0.09 0.00 0.00 32 T 8.57 4.72 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 1.14 0.00 0.00 33 A 8.84 4.83 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 G 9.47 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 0.00 0.00 0.00 35 A 8.49 4.30 1.32 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 0.00 0.00 36 D 7.91 4.70 0.00 2.65 2.64 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 37 G 7.80 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 0.00 0.00 0.00 38 A 7.71 5.04 1.28 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 0.00 0.00 39 L 8.82 5.31 0.00 1.72 1.43 1.12 0.06 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 40 T 9.00 4.95 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 1.20 0.00 0.00 41 G 7.07 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 42 T 7.51 5.24 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 1.19 0.00 0.00 43 Y 9.31 5.00 0.00 3.01 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 E 8.98 5.47 0.00 2.09 1.80 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 2.30 2.42 0.00 45 S 9.41 5.03 0.00 4.14 3.75 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 46 A 8.86 4.39 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 V 7.45 4.38 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 0.81 0.00 0.00 0.88 0.00 0.00 48 G 8.48 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 7.90 4.55 0.00 2.59 2.62 0.00 0.00 6.59 7.93 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 50 A 7.46 4.93 1.07 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 0.00 0.00 51 E 9.56 4.64 0.00 1.92 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.15 0.00 52 S 8.63 3.82 0.00 3.75 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 53 R 8.40 5.12 0.00 1.73 1.87 0.00 3.21 0.00 0.00 3.22 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.77 0.00 54 Y 9.19 4.77 0.00 2.92 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 55 V 8.49 4.44 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 0.75 0.00 0.00 0.93 0.00 0.00 56 L 8.71 5.44 0.00 2.07 1.79 0.72 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 57 T 8.25 4.79 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 1.26 0.00 0.00 58 G 8.59 4.72 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 0.00 0.00 0.00 59 R 8.65 5.67 0.00 1.77 1.79 0.00 3.29 0.00 0.00 3.24 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.74 0.00 60 Y 8.84 5.23 0.00 3.10 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 61 D 8.95 4.56 0.00 2.83 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 62 S 8.17 4.46 0.00 3.98 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 0.00 63 A 8.02 4.67 1.22 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 0.00 0.00 64 P 0.00 4.82 0.00 2.28 2.19 0.00 3.51 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.05 0.00 65 A 8.30 4.19 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.42 4.50 4.26 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 1.24 0.00 0.00 67 D 7.79 5.19 0.00 2.77 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 68 G 8.40 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 0.00 0.00 0.00 69 S 8.06 4.52 0.00 3.98 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 70 G 8.30 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 0.00 0.00 0.00 71 T 8.86 4.83 4.56 0.00 0.00 0.00 0.00 0.00 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 72 A 8.73 4.86 1.30 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 0.00 0.00 73 L 8.94 4.90 0.00 1.97 1.96 1.22 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 74 G 9.11 4.66 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 0.00 0.00 0.00 75 W 8.54 5.71 0.00 3.56 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 76 T 9.27 5.30 4.30 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 1.22 0.00 0.00 77 V 8.72 4.69 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 -0.16 0.00 0.00 0.89 0.00 0.00 78 A 8.38 4.57 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 79 W 8.32 4.29 0.00 3.30 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 80 K 7.86 5.28 0.00 1.92 1.73 0.00 1.83 0.00 0.00 1.80 0.00 0.00 3.07 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.37 1.47 7.81 81 N 9.03 4.85 0.00 2.70 2.50 0.00 0.00 6.75 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 82 N 8.46 4.25 0.00 2.13 2.55 0.00 0.00 6.60 7.27 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 83 Y 7.37 4.51 0.00 3.13 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 84 R 8.67 4.75 0.00 2.04 1.98 0.00 3.26 0.00 0.00 3.27 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.65 0.00 85 N 8.44 5.07 0.00 2.65 2.60 0.00 0.00 6.97 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 86 A 9.17 4.27 1.28 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 0.00 0.00 87 H 8.59 4.14 0.00 3.29 3.30 0.00 5.65 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 S 7.34 5.22 0.00 3.99 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 89 A 9.11 5.06 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 90 T 8.82 4.98 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 -0.34 0.00 0.00 91 T 8.42 4.89 4.17 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 1.17 0.00 0.00 92 W 8.84 4.90 0.00 1.78 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 0.00 0.00 0.00 93 S 8.50 4.95 0.00 3.83 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 94 G 8.59 4.50 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 0.00 0.00 0.00 95 Q 8.57 5.26 0.00 2.26 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.11 6.80 0.00 0.00 0.00 0.00 0.00 2.28 2.34 0.00 96 Y 9.23 4.98 0.00 3.00 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 97 V 8.40 4.19 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 0.90 0.00 0.00 98 G 7.92 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 99 G 9.11 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 0.00 100 A 8.75 4.16 1.32 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 0.00 0.00 101 E 7.73 4.57 0.00 2.09 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 2.18 2.29 0.00 102 A 8.00 4.46 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.86 5.40 0.00 2.07 2.16 0.00 2.79 0.00 0.00 3.23 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.85 0.00 104 I 8.87 4.96 1.74 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 -0.36 1.00 0.00 0.00 105 N 9.17 5.45 0.00 2.77 2.77 0.00 0.00 6.12 6.70 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 0.00 106 T 8.96 5.28 4.50 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 1.38 0.00 0.00 107 Q 8.98 4.92 0.00 1.90 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.83 6.66 0.00 0.00 0.00 0.00 0.00 2.22 2.35 0.00 108 W 8.44 5.43 0.00 2.58 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 0.00 0.00 0.00 109 L 8.69 5.22 0.00 1.53 1.54 0.88 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 110 L 9.39 4.99 0.00 1.53 1.70 0.97 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 111 T 8.78 5.11 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 1.20 0.00 0.00 112 S 8.81 5.14 0.00 3.67 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 0.00 113 G 8.73 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 0.00 114 T 8.29 4.78 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 1.25 0.00 0.00 115 T 7.97 4.36 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 0.00 116 E 8.82 3.95 0.00 2.07 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 0.00 2.42 2.34 0.00 117 A 8.12 4.06 1.34 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 0.00 0.00 118 N 8.13 4.70 0.00 2.74 2.68 0.00 0.00 6.88 7.08 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 0.00 119 A 8.03 4.12 1.36 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 0.00 120 W 8.39 4.35 0.00 3.55 3.21 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 0.00 121 K 6.75 4.14 0.00 1.18 0.74 0.00 0.71 0.00 0.00 1.38 0.00 0.00 2.63 0.00 0.00 2.91 0.00 0.00 0.00 0.00 0.30 0.81 7.81 122 S 7.94 4.21 0.00 4.15 4.12 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 0.00 123 T 7.63 5.10 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 0.00 124 L 9.09 4.87 0.00 1.80 1.74 0.96 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 125 V 7.87 4.44 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 0.64 0.00 0.00 0.69 0.00 0.00 126 G 6.35 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 0.00 0.00 0.00 127 H 8.05 5.33 0.00 3.15 3.08 0.00 5.67 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 D 9.17 5.27 0.00 2.86 2.21 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 0.00 129 T 8.99 5.14 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 1.31 0.00 0.00 130 F 9.46 5.62 0.00 2.96 3.21 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 0.00 131 T 9.44 5.41 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 1.38 0.00 0.00 132 K 8.80 3.80 0.00 1.52 1.65 0.00 1.35 0.00 0.00 1.03 0.00 0.00 2.60 0.00 0.00 2.77 0.00 0.00 0.00 0.00 0.30 0.34 7.81 133 V 7.64 4.52 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 0.79 0.00 0.00 0.93 0.00 0.00 134 K 8.16 4.21 0.00 1.60 0.74 0.00 1.31 0.00 0.00 0.61 0.00 0.00 2.60 0.00 0.00 2.62 0.00 0.00 0.00 0.00 0.70 1.08 7.81