NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 L 4.4459 8.1693 120.7667 54.3489 42.8550 174.9131 2 N 4.9564 8.5020 114.1203 51.0686 40.4045 173.7461 3 I 3.8327 8.4226 117.7407 63.2341 39.2000 178.9340 4 G 3.6981 8.0299 108.7422 48.2188 0.0000 175.3868 5 D 4.4395 7.8605 119.3415 57.0180 40.9560 177.8607 6 L 4.1098 7.5604 118.4289 56.7911 41.8057 177.3202 7 L 4.4157 7.4630 117.8158 54.2079 43.1332 177.0757 8 G 3.9867 8.2773 104.7928 46.2451 0.0000 173.5073 *14 D 4.5133 8.3127 117.5281 53.3488 42.4447 175.2137 15 Q 4.5625 7.8356 119.7431 55.1512 31.3095 174.9629 16 G 4.0064 8.8293 111.2926 46.5988 0.0000 171.9546 17 C 4.9764 7.9257 111.3887 53.2021 46.3150 172.6860 18 S 4.7297 8.4124 115.1123 57.1111 63.1878 174.5477 19 R 4.5762 8.4322 123.2830 55.7201 31.2414 175.4081 20 T 4.4910 7.6866 107.8700 59.6620 71.3518 173.2862 21 C 4.1944 8.4883 121.5952 56.7756 41.5030 173.1214 22 E 4.5679 8.9676 125.0524 55.4416 31.7462 176.6477 23 S 5.3383 7.9951 112.9568 57.7765 63.5913 172.8403 24 Q 4.2811 9.1239 128.0929 55.3153 32.8020 174.8693 25 F 4.0364 7.9293 123.0781 58.7075 36.4639 177.3704 26 C 4.4203 8.1783 117.3293 59.5605 40.6482 175.4848 27 T 4.2181 7.9319 106.2118 61.1715 69.5330 174.1589 28 I 4.2127 7.5291 123.9695 59.3777 37.0713 175.8133 29 A 4.0231 8.7489 129.2196 54.7069 18.1791 178.1603 30 P 4.3552 0.0000 0.0000 64.8589 31.5041 176.9349 31 L 4.2917 6.9842 117.4091 54.2957 42.8606 176.4087 32 L 4.4297 7.8406 121.5926 56.1654 43.1565 176.3025 33 R 4.6341 9.2033 124.0646 54.7188 34.1935 173.5277 34 Y 4.9660 9.0607 125.7410 56.6750 42.1334 175.3234 35 G 3.6662 8.7822 115.1783 46.5861 0.0000 174.7307 36 K 4.3493 9.1527 119.0670 56.1196 32.9179 176.8218 37 Y 4.5293 8.7045 114.8341 58.1523 40.4032 175.1948 38 C 4.6766 9.0851 118.7474 56.3955 40.5036 171.7242 39 G 4.6714 8.6406 111.9651 44.2354 0.0000 172.4125 40 I 3.9188 7.9737 124.7820 62.1691 37.6186 175.9624 41 L 3.7896 8.9036 123.6583 55.6093 38.7458 173.8926 42 Y 4.7012 7.8539 118.6208 56.2142 41.4292 173.3152 43 S 4.2568 7.7144 120.3239 56.7456 66.3658 173.0898 44 G 3.4131 7.2792 110.2776 45.2829 0.0000 174.2935 45 C 4.6639 8.5632 118.3168 55.4949 41.6572 171.8256 46 P 4.4530 0.0000 0.0000 64.7408 31.2981 176.7471 47 G 4.0335 8.9943 110.9738 45.3987 0.0000 173.5411 48 E 4.0074 7.9288 119.7458 56.1263 29.6659 176.9207 49 R 4.0862 8.5176 124.7882 55.3878 30.8418 174.4575 50 P 4.8283 0.0000 0.0000 63.1681 31.9063 177.2290 51 C 4.3986 9.0020 117.6370 58.7269 35.4020 172.8625 52 D 4.4146 7.5781 117.0398 51.6516 41.6428 176.2811 53 A 3.9987 8.5389 120.0834 55.4673 18.3652 179.1767 54 L 3.8989 8.1206 118.2433 58.6655 42.1294 178.5605 55 D 4.6242 9.1590 117.7377 57.4316 41.1708 178.0971 56 A 3.9999 8.0186 121.0561 54.8854 18.3900 179.0011 57 C 4.2502 8.1687 115.1038 60.4991 39.4057 175.6496 58 C 4.2954 8.1648 117.7455 60.0257 34.3624 175.7605 59 M 3.3671 7.9968 119.8472 58.4400 31.6029 178.4939 60 V 3.5274 7.5453 118.0405 66.1962 31.6928 177.3151 61 H 4.0864 8.2359 117.9269 59.4436 29.7608 176.6125 62 D 4.3746 8.4116 120.9338 58.0570 40.6701 178.8857 63 H 4.2153 7.9661 116.2535 58.6355 28.4888 176.8508 64 C 4.1864 8.2677 119.9220 59.7998 39.8317 175.5103 65 V 3.5229 7.9133 119.9501 66.1495 30.8333 177.5040 66 D 4.5240 7.9363 117.7131 56.2977 41.1003 177.2195 67 T 4.3851 8.0119 107.9335 61.4828 70.0299 174.5553 68 H 4.8303 7.8430 118.8563 56.1235 29.1785 173.6034 69 N 4.2179 8.7010 108.7386 54.5714 36.6399 174.3432 70 D 4.1378 7.8700 112.7049 55.3336 38.5967 173.6330 71 D 4.7652 7.5132 119.9536 53.0534 40.5830 176.2835 72 Y 4.2290 8.5842 125.1751 60.1767 38.2094 176.9310 73 L 4.6004 7.9993 118.2113 54.4661 42.1553 176.1551 74 N 4.4867 7.7557 118.1770 53.5386 39.8679 175.8385 75 T 3.9252 8.4986 118.9152 65.0552 68.9822 176.5373 76 M 4.0078 8.0115 120.9879 58.3279 32.0950 178.9681 77 C 4.2055 8.3509 116.4206 60.4096 37.2080 176.2360 78 N 4.3619 8.2960 117.7074 56.3964 38.1464 177.5173 79 E 4.0113 8.8306 120.4385 59.3628 29.5040 179.0457 80 N 4.3268 8.4910 116.9313 56.1507 38.6121 177.1164 81 L 3.9307 7.9367 121.6118 58.1346 42.2994 178.7874 82 L 3.9487 7.8074 118.8485 58.1049 41.3869 179.5949 83 S 4.1199 7.8922 113.3937 61.8678 63.1132 175.8939 84 C 4.4132 8.3399 120.8369 59.8411 38.7344 175.4482 85 I 3.6258 8.1957 121.7882 64.7027 36.4827 178.0749 86 D 4.4649 7.9952 117.9324 56.2217 40.6862 177.8120 87 R 4.4831 7.4360 116.4186 54.5993 31.1248 176.4677 88 V 3.6936 7.0163 120.3520 63.1895 31.9842 175.0671 89 S 4.4085 8.4795 119.2789 58.0682 64.9962 174.3037 90 G 3.8511 8.8257 106.8112 44.1575 0.0000 173.2070 91 A 4.0163 8.2312 121.3963 52.5511 18.7228 177.1310 92 T 4.6066 8.0240 115.8811 59.6689 69.9817 173.9099 93 F 4.5153 8.3945 117.8829 55.8245 38.6038 174.3942 94 P 4.1555 0.0000 0.0000 65.8806 31.1664 177.5255 95 G 3.8141 8.0892 103.3226 45.4206 0.0000 172.7825 96 N 3.8932 7.2803 118.7376 53.3940 37.9223 174.9219 97 K 4.1216 8.3362 125.3350 57.8953 32.6999 178.4564 98 C 4.6219 8.1074 116.6983 56.0549 39.3855 173.0113 99 N 4.7519 8.4450 120.3333 52.6787 39.8816 175.3490 100 V 3.7433 8.6348 127.9760 66.4486 31.6211 177.8522 101 G 3.7312 8.1158 104.4007 48.0532 0.0000 174.9881 102 Q 3.9658 8.3354 121.8621 59.1919 29.1059 178.5247 103 T 3.8503 8.4083 117.0023 66.3936 68.4399 176.3873 104 A 3.8873 8.1919 123.2400 55.5975 18.3157 179.6736 105 S 3.9972 8.0279 111.2311 61.3436 62.4085 176.5845 106 V 3.5618 7.6251 120.4868 65.9615 31.2366 178.0154 107 I 3.6316 7.7143 119.4477 64.4053 36.9189 178.0890 108 R 3.9583 8.2595 119.9411 59.6900 29.7246 178.5499 109 G 3.6317 8.1070 105.1615 47.8753 0.0000 175.8253 110 V 3.7148 7.6660 120.0518 65.8563 31.6056 178.3193 111 I 3.8045 8.1506 120.0051 64.3170 36.9555 178.2414 112 E 4.0549 8.6036 119.9666 59.6987 29.1366 179.5820 113 T 3.9607 7.6811 114.3155 66.4969 68.5282 176.7865 114 A 3.8326 8.0213 122.6322 54.8534 18.4590 179.8808 115 V 3.6325 7.9966 117.2815 65.8170 31.6023 178.0879 116 F 4.0224 8.2471 120.1679 61.3441 39.3242 177.0173 117 A 4.1722 8.9801 121.2580 55.1305 17.9298 179.7377 118 G 3.6273 7.9417 103.4283 47.9813 0.0000 175.7152 119 K 4.1228 7.6348 119.1603 58.7930 32.1797 179.0637 120 I 3.8798 7.2999 118.8173 62.9353 37.1838 176.4548 121 L 4.3966 7.8618 123.9768 54.7338 41.8531 176.0898 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 L 8.17 4.45 0.00 1.68 1.53 0.92 0.56 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 2 N 8.50 4.96 0.00 2.79 2.89 0.00 0.00 7.00 6.78 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 3 I 8.42 3.83 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 1.35 1.32 0.91 0.00 0.00 4 G 8.03 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 0.00 0.00 0.00 0.00 5 D 7.86 4.44 0.00 2.85 2.76 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 6 L 7.56 4.11 0.00 1.71 1.73 0.92 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 7 L 7.46 4.42 0.00 1.59 1.60 0.93 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 8 G 8.28 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 *14 D 8.31 4.51 0.00 2.70 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 15 Q 7.84 4.56 0.00 1.96 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.59 6.91 0.00 0.00 0.00 0.00 0.00 2.22 2.25 0.00 16 G 8.83 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 17 C 7.93 4.98 0.00 2.94 2.93 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 18 S 8.41 4.73 0.00 3.67 3.43 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 19 R 8.43 4.58 0.00 1.75 1.83 0.00 3.17 0.00 0.00 3.25 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.51 0.00 20 T 7.69 4.49 4.21 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 1.19 0.00 0.00 21 C 8.49 4.19 0.00 2.31 1.23 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 22 E 8.97 4.57 0.00 1.79 1.82 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 2.54 2.39 0.00 23 S 8.00 5.34 0.00 3.88 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 24 Q 9.12 4.28 0.00 2.02 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.28 0.00 0.00 0.00 0.00 0.00 1.74 2.11 0.00 25 F 7.93 4.04 0.00 3.39 3.01 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 26 C 8.18 4.42 0.00 3.00 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 27 T 7.93 4.22 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 1.23 0.00 0.00 28 I 7.53 4.21 1.97 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.81 0.84 0.00 0.00 29 A 8.75 4.02 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 30 P 0.00 4.36 0.00 2.11 2.14 0.00 3.61 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.93 0.00 31 L 6.98 4.29 0.00 1.37 0.91 0.06 0.61 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 32 L 7.84 4.43 0.00 1.99 1.62 1.00 0.84 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 33 R 9.20 4.63 0.00 1.49 0.89 0.00 2.94 0.00 0.00 2.49 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 1.49 0.00 34 Y 9.06 4.97 0.00 3.11 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 35 G 8.78 3.67 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 0.00 0.00 0.00 36 K 9.15 4.35 0.00 1.26 1.25 0.00 1.72 0.00 0.00 1.40 0.00 0.00 2.97 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.43 1.20 7.81 37 Y 8.70 4.53 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 38 C 9.09 4.68 0.00 3.51 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 39 G 8.64 4.67 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 0.00 0.00 0.00 40 I 7.97 3.92 1.88 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.61 0.83 0.00 0.00 41 L 8.90 3.79 0.00 1.86 1.82 0.94 0.88 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 42 Y 7.85 4.70 0.00 3.02 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 43 S 7.71 4.26 0.00 3.84 3.52 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 44 G 7.28 3.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 C 8.56 4.66 0.00 2.85 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 46 P 0.00 4.45 0.00 2.04 2.05 0.00 3.78 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 2.18 2.14 0.00 47 G 8.99 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 48 E 7.93 4.01 0.00 2.08 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 2.43 2.48 0.00 49 R 8.52 4.09 0.00 1.80 1.86 0.00 3.26 0.00 0.00 3.25 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.68 0.00 50 P 0.00 4.83 0.00 2.14 2.01 0.00 3.76 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.98 0.00 51 C 9.00 4.40 0.00 2.68 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 D 7.58 4.41 0.00 3.04 3.01 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 53 A 8.54 4.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 L 8.12 3.90 0.00 1.79 1.84 0.84 0.49 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 55 D 9.16 4.62 0.00 3.32 3.03 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 56 A 8.02 4.00 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 57 C 8.17 4.25 0.00 3.20 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 58 C 8.16 4.30 0.00 3.34 3.39 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 59 M 8.00 3.37 0.00 1.84 0.83 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 2.19 0.00 60 V 7.55 3.53 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 1.02 0.00 0.00 0.94 0.00 0.00 61 H 8.24 4.09 0.00 3.33 3.46 0.00 5.66 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 62 D 8.41 4.37 0.00 2.92 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 63 H 7.97 4.22 0.00 3.22 3.30 0.00 5.63 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 C 8.27 4.19 0.00 3.07 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 65 V 7.91 3.52 1.79 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 0.21 0.00 0.00 0.70 0.00 0.00 66 D 7.94 4.52 0.00 2.73 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 67 T 8.01 4.39 4.16 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 1.23 0.00 0.00 68 H 7.84 4.83 0.00 3.33 3.25 0.00 5.96 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 69 N 8.70 4.22 0.00 2.82 2.88 0.00 0.00 7.23 8.06 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 70 D 7.87 4.14 0.00 2.91 2.68 0.00 0.00 0.00 0.00 0.00 0.00 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 D 7.51 4.77 0.00 2.80 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 Y 8.58 4.23 0.00 3.03 3.05 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 73 L 8.00 4.60 0.00 1.82 1.71 1.01 1.04 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 7.76 4.49 0.00 2.83 2.63 0.00 0.00 6.97 7.10 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 75 T 8.50 3.93 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 76 M 8.01 4.01 0.00 2.04 2.23 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.62 0.00 77 C 8.35 4.21 0.00 3.08 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 78 N 8.30 4.36 0.00 2.86 2.91 0.00 0.00 7.13 7.13 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 79 E 8.83 4.01 0.00 2.09 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 2.44 0.00 80 N 8.49 4.33 0.00 2.96 2.88 0.00 0.00 6.64 7.32 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 81 L 7.94 3.93 0.00 1.90 1.81 0.93 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 82 L 7.81 3.95 0.00 1.95 1.72 0.94 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 83 S 7.89 4.12 0.00 4.10 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 84 C 8.34 4.41 0.00 3.14 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 85 I 8.20 3.63 1.98 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.87 0.89 0.00 0.00 86 D 8.00 4.46 0.00 2.84 2.73 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 0.00 87 R 7.44 4.48 0.00 1.78 1.94 0.00 3.46 0.00 0.00 3.15 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.60 0.00 88 V 7.02 3.69 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 0.81 0.00 0.00 1.00 0.00 0.00 89 S 8.48 4.41 0.00 3.97 3.79 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 90 G 8.83 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 91 A 8.23 4.02 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 92 T 8.02 4.61 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 1.07 0.00 0.00 93 F 8.39 4.52 0.00 3.21 3.05 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 94 P 0.00 4.16 0.00 2.10 2.19 0.00 3.81 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 2.08 2.14 0.00 95 G 8.09 3.81 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 0.00 0.00 0.00 96 N 7.28 3.89 0.00 1.44 2.13 0.00 0.00 7.14 6.67 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 97 K 8.34 4.12 0.00 1.74 1.80 0.00 1.74 0.00 0.00 1.67 0.00 0.00 3.00 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.39 1.57 7.81 98 C 8.11 4.62 0.00 3.35 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 99 N 8.44 4.75 0.00 2.75 2.82 0.00 0.00 6.59 7.71 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 0.00 100 V 8.63 3.74 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 1.08 0.00 0.00 1.02 0.00 0.00 101 G 8.12 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 0.00 0.00 0.00 0.00 102 Q 8.34 3.97 0.00 2.27 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.77 0.00 0.00 0.00 0.00 0.00 2.36 2.40 0.00 103 T 8.41 3.85 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 0.94 0.00 0.00 104 A 8.19 3.89 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 0.00 105 S 8.03 4.00 0.00 4.08 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 0.00 106 V 7.63 3.56 2.20 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 1.03 0.00 0.00 1.01 0.00 0.00 107 I 7.71 3.63 1.94 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 1.38 0.62 0.88 0.00 0.00 108 R 8.26 3.96 0.00 1.97 2.04 0.00 3.09 0.00 0.00 3.26 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.66 0.00 109 G 8.11 3.63 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 0.00 0.00 0.00 110 V 7.67 3.71 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 1.06 0.00 0.00 0.92 0.00 0.00 111 I 8.15 3.80 1.86 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.86 0.94 0.00 0.00 112 E 8.60 4.05 0.00 2.13 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 2.34 2.48 0.00 113 T 7.68 3.96 4.43 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 1.24 0.00 0.00 114 A 8.02 3.83 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 0.00 115 V 8.00 3.63 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 1.03 0.00 0.00 1.00 0.00 0.00 116 F 8.25 4.02 0.00 3.38 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 0.00 117 A 8.98 4.17 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 G 7.94 3.63 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 0.00 0.00 0.00 119 K 7.63 4.12 0.00 1.72 1.73 0.00 1.63 0.00 0.00 1.62 0.00 0.00 3.01 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.42 1.59 7.81 120 I 7.30 3.88 1.83 0.00 0.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.65 0.88 0.00 0.00 121 L 7.86 4.40 0.00 1.74 1.57 0.94 0.71 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 * Residues marked with a * may have inaccurate shift predictions.