NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 M 4.1232 8.3049 120.3375 54.7830 34.2731 176.0187 6 F 4.3865 7.7286 127.8006 55.8189 38.0953 173.2652 7 D 4.8147 10.0979 127.3858 54.3014 44.1577 175.3627 8 S 5.2042 8.3490 114.3838 56.7222 66.3122 173.0429 9 I 5.0008 9.0920 124.6077 59.4190 40.7182 174.0168 10 L 4.5264 8.9086 129.7488 53.1820 43.9116 175.0850 11 V 4.4834 8.9154 127.9134 62.0597 33.3771 174.7375 12 I 5.5996 9.2471 128.2825 58.4104 40.7310 173.2590 13 C 4.6096 8.3441 122.7984 58.6654 32.8581 174.1799 14 T 4.1370 8.7501 109.7276 65.6861 68.9229 177.3006 15 G 3.3189 7.9613 107.8563 46.1113 0.0000 172.7271 16 N 4.1869 8.4228 116.7753 53.5102 37.5449 174.2253 17 I 4.5411 7.5498 107.6510 59.6755 38.8650 174.4493 18 C 4.8449 7.1527 116.1876 61.4123 31.6522 176.2483 19 R 3.8300 7.7325 118.1553 59.5687 29.8173 179.2820 20 S 3.9594 7.8020 113.4668 61.0310 63.0568 174.4804 21 P 4.1887 0.0000 0.0000 65.1746 31.0001 178.7056 22 I 3.8772 7.3911 118.3208 64.2066 37.1094 178.5960 23 G 3.3410 8.1977 107.0372 47.5414 0.0000 175.1610 24 E 3.9781 8.7742 122.5735 59.3773 29.7034 179.3300 25 R 4.0732 7.8844 117.4245 58.9361 29.9625 179.0262 26 L 4.0101 8.1061 118.9441 57.9723 41.6750 179.6199 27 L 4.0759 8.1195 118.8006 57.7745 41.2440 179.8110 28 R 3.9549 8.1807 118.1375 59.1940 29.7894 178.7252 29 R 3.9853 7.7154 117.3815 59.6525 30.0549 177.8942 30 L 4.4444 7.4705 116.8907 55.3908 43.4762 177.0841 31 L 4.8137 8.1640 118.7151 52.0148 41.7612 175.2810 32 P 4.5199 0.0000 0.0000 64.1358 31.8849 177.6744 33 S 4.5298 7.9798 110.5643 58.3319 63.7169 173.8166 34 K 4.5718 7.4357 120.5842 54.7932 34.1894 176.4780 35 K 4.2599 8.2986 123.4653 56.3239 32.8793 175.7952 36 I 5.0544 8.4249 128.6153 59.8680 39.8626 174.5750 37 N 5.4289 9.2835 124.1202 50.7483 43.2813 173.1916 38 S 5.5211 8.5887 111.6639 58.1186 66.2615 172.8170 39 A 4.7940 8.1678 121.3605 51.5178 22.8895 174.9983 40 G 4.3988 8.9414 105.3347 44.6862 0.0000 174.6291 41 V 3.8899 8.6600 117.2311 62.3982 32.1416 176.5219 42 G 4.3328 7.9000 107.7777 45.2796 0.0000 173.2825 43 A 4.3086 8.0847 120.2306 51.8326 20.0233 179.7159 44 L 4.1500 8.3932 121.9080 52.8913 40.5018 175.5562 45 V 3.9900 7.7726 122.3567 64.0206 31.9905 176.1265 46 D 4.7214 8.9984 126.3777 54.6544 39.4513 173.9796 47 H 4.5472 7.9725 117.5479 55.4636 30.0259 175.2641 48 T 4.6342 8.4597 116.8451 61.4869 68.3984 173.3580 49 A 4.3468 8.5104 125.4660 51.5777 19.2213 177.2278 50 D 4.4377 9.0825 120.3912 54.1827 42.2517 177.1041 51 E 3.8818 9.0383 126.0581 59.8861 29.5888 179.5924 52 S 3.7502 8.7712 114.9487 61.0377 62.6091 176.5677 53 A 4.1605 7.7761 123.2400 55.2829 18.1949 179.5859 54 I 3.6928 8.0004 118.5675 64.3616 37.0943 178.7529 55 R 3.8530 8.0800 119.3179 59.4012 29.8003 179.5456 56 V 3.5222 7.8336 118.4809 64.5660 31.2295 178.1726 57 A 3.9204 7.9556 121.4094 55.1151 18.3216 179.3849 58 E 3.9531 8.3245 116.9379 59.4521 29.3500 179.3439 59 K 3.8205 7.8140 118.5631 59.1946 32.0676 177.3666 60 N 4.7893 7.2614 113.8570 52.3847 38.6973 175.4789 61 G 3.8671 8.3596 108.0431 45.8534 0.0000 173.2426 62 L 4.6331 8.0023 121.2552 52.9184 43.6569 175.1268 63 C 4.6104 8.6215 125.7225 58.0545 32.3178 172.9474 64 L 4.6169 8.3244 125.3267 54.2995 41.8968 176.4215 65 K 4.0397 7.7163 118.9241 57.7847 32.4220 177.4649 66 G 3.9645 8.8547 110.7338 45.2168 0.0000 173.1463 67 H 4.4660 7.4553 118.6808 56.2116 30.7934 174.7224 68 R 4.4274 7.7681 123.4323 54.2316 32.9273 174.7714 69 G 3.8529 9.1346 114.7177 47.3238 0.0000 172.1873 70 T 5.0356 9.7767 121.3278 61.3892 72.7324 173.0968 71 K 4.5845 8.6569 127.3691 55.9065 33.1165 176.0431 72 F 4.5032 8.8756 131.0629 58.3498 40.1856 174.5252 73 T 4.4560 7.1780 114.3182 58.5682 71.9221 174.7429 74 S 3.9438 8.4875 117.4249 61.5677 62.9275 176.1780 75 A 4.0572 7.7284 123.8123 54.7977 18.2233 179.1716 76 L 3.9046 7.8205 118.6665 58.2376 42.1763 179.0300 77 A 4.1861 7.7193 120.4630 55.1048 18.0374 179.4676 78 R 3.9720 7.6175 116.3711 58.9805 30.1414 177.6522 79 Q 4.2578 7.9335 115.6158 55.1306 29.3570 174.8449 80 Y 4.7533 7.5205 117.5594 56.2673 41.2404 175.3730 81 D 4.7816 8.5936 122.0905 56.0135 42.0394 176.6531 82 L 4.7518 7.8926 120.4898 53.7375 45.7543 173.8572 83 L 5.1227 8.8681 126.3066 52.9429 44.5918 175.3305 84 L 5.0354 8.7477 123.3385 53.1786 44.4782 176.0423 85 V 5.0697 8.4125 117.2683 59.2008 34.5195 177.0927 86 M 4.1996 8.6292 122.3036 57.4871 33.3092 176.4454 87 E 5.0349 8.0541 116.2995 53.9355 33.3584 176.1092 88 Y 4.1219 9.3420 120.7346 61.6385 37.5327 179.6361 89 S 4.1534 8.2491 114.1932 61.9711 62.7231 176.1638 90 H 4.5790 8.0082 121.0161 58.0305 28.3223 177.5865 91 L 3.9387 8.0036 121.1645 57.8765 41.5789 179.1470 92 E 4.0661 8.1399 118.4333 58.9669 29.4968 178.5934 93 Q 4.0761 7.7317 117.8815 58.6434 28.6652 178.4765 94 I 3.7597 7.9463 121.1660 64.5141 36.9334 178.5186 95 S 3.9972 7.8176 114.8108 61.7003 62.7060 176.5327 96 R 4.0811 7.8110 120.2081 59.0330 29.9268 177.9536 97 I 4.2683 7.9650 118.2825 62.1464 39.1227 176.1989 98 A 4.7268 8.7160 123.1156 49.0631 18.5039 174.1499 99 P 4.3281 0.0000 0.0000 65.1874 31.9520 178.3854 100 E 4.2258 8.1953 114.3515 57.4053 29.9255 177.3605 101 A 4.5780 8.0813 120.7674 52.6893 19.7415 178.7303 102 R 3.9891 7.7704 116.9151 59.4106 29.8601 178.2260 103 G 3.9569 8.1014 103.2763 45.8659 0.0000 173.5870 104 K 4.8133 8.2452 120.1172 56.7699 34.3139 175.3217 105 T 5.0324 7.7475 116.7928 62.9572 70.3403 173.8311 106 M 4.9133 8.8386 124.2215 53.3012 37.3263 174.4858 107 L 4.4326 8.3483 119.8763 54.8684 42.4934 178.1614 108 F 3.9020 9.4164 126.1442 60.4874 40.2215 176.1670 109 G 4.2716 7.9891 105.9564 44.7933 0.0000 174.9946 110 H 3.6952 7.8685 122.4170 58.4472 29.6980 175.8942 111 W 4.5820 7.3861 115.4842 56.7162 29.2884 175.9569 112 L 4.6018 7.4191 118.9935 53.2398 42.6727 176.4694 113 D 4.4594 8.8206 121.5853 57.3582 40.9034 176.9750 114 S 4.6567 7.8348 111.7365 56.8971 63.5968 173.7228 115 K 4.4666 8.5347 125.8709 57.2407 32.9479 175.6955 116 E 4.3070 7.9926 119.9966 55.4873 30.5810 175.8918 117 I 4.2356 8.1481 128.3423 59.4498 37.5360 174.1494 118 P 4.4364 0.0000 0.0000 62.2158 32.4088 175.8392 119 D 4.4923 8.4712 121.6051 53.1366 41.4902 174.4040 120 P 4.2668 0.0000 0.0000 62.9254 32.1917 175.0637 121 Y 4.6158 8.1223 121.4160 59.7145 38.8082 176.6225 122 R 3.8172 8.7808 124.2098 56.5866 27.9534 175.9388 123 M 4.4257 8.1491 118.6028 53.8625 33.5497 176.0016 124 S 4.5614 8.2506 115.2241 58.0822 65.4935 174.6234 125 D 4.4565 8.6061 121.1900 57.4354 40.4479 178.8225 126 E 4.4922 8.4960 118.8333 58.6338 29.7062 178.8922 127 A 4.0341 7.6605 122.2335 55.0092 18.3297 179.6404 128 F 3.9516 8.1585 116.5602 60.5915 38.8496 177.5147 129 D 4.4725 8.7096 119.1169 57.4885 40.6387 178.9753 130 S 4.1396 8.1624 113.3775 61.4948 62.4208 176.2831 131 V 3.5488 8.0981 121.3703 66.0181 31.1397 177.1353 132 Y 3.9308 8.4704 119.6929 60.8472 38.5554 178.0082 133 Q 4.0412 8.3255 120.2870 59.2275 29.0768 178.2299 134 L 4.0041 7.9549 119.9416 57.9313 41.6487 179.5542 135 L 4.0546 8.0936 119.0692 57.6083 41.4702 179.3229 136 E 3.8109 8.0756 119.4594 59.2502 29.5414 178.6429 137 Q 3.9714 8.4187 119.7459 59.1517 29.1085 177.9877 138 A 4.1059 8.4256 122.0934 55.2712 18.4416 179.8328 139 S 4.1168 8.5243 113.7675 61.7149 62.9780 176.9581 140 K 3.9781 8.1513 121.1377 59.7202 31.7083 179.6656 141 R 4.1295 7.7678 119.2630 58.3965 29.9557 179.1220 142 W 4.1627 8.4168 118.7169 59.6319 28.7446 178.4508 143 A 4.1069 8.0848 120.1854 55.0785 17.8357 179.1290 144 E 3.9900 8.2156 117.1942 59.4271 29.5265 179.8564 145 K 3.8592 7.6709 118.2399 58.9609 31.9214 178.4882 146 L 5.0155 7.8341 117.4063 54.9597 42.7809 177.1917 147 G 3.7391 7.8334 113.6183 45.8475 0.0000 173.2259 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 M 8.30 4.12 0.00 1.65 1.94 0.00 0.00 0.00 0.00 0.00 -0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 2.19 0.00 6 F 7.73 4.39 0.00 3.21 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 10.10 4.81 0.00 2.80 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 8 S 8.35 5.20 0.00 3.93 3.62 0.00 0.00 0.00 0.00 0.00 0.00 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 I 9.09 5.00 1.88 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.91 0.80 0.00 0.00 10 L 8.91 4.53 0.00 0.80 1.32 0.40 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 11 V 8.92 4.48 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 0.85 0.00 0.00 1.01 0.00 0.00 12 I 9.25 5.60 1.60 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.71 0.55 0.00 0.00 13 C 8.34 4.61 0.00 2.86 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 14 T 8.75 4.14 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 1.20 0.00 0.00 15 G 7.96 3.32 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 0.00 16 N 8.42 4.19 0.00 2.81 2.85 0.00 0.00 7.11 7.94 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 17 I 7.55 4.54 1.93 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.76 0.95 0.00 0.00 18 C 7.15 4.84 0.00 2.98 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 19 R 7.73 3.83 0.00 1.72 1.75 0.00 3.02 0.00 0.00 3.54 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.58 0.00 20 S 7.80 3.96 0.00 4.04 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 21 P 0.00 4.19 0.00 2.04 1.70 0.00 3.60 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 2.01 2.03 0.00 22 I 7.39 3.88 1.97 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.83 0.87 0.00 0.00 23 G 8.20 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 0.00 0.00 0.00 24 E 8.77 3.98 0.00 2.00 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 0.00 2.34 2.52 0.00 25 R 7.88 4.07 0.00 1.92 2.00 0.00 3.38 0.00 0.00 3.20 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.96 0.00 26 L 8.11 4.01 0.00 1.92 1.77 0.68 0.48 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 27 L 8.12 4.08 0.00 1.91 1.75 0.92 0.73 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 28 R 8.18 3.95 0.00 2.06 2.01 0.00 3.18 0.00 0.00 3.13 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.88 0.00 29 R 7.72 3.99 0.00 2.15 2.14 0.00 3.31 0.00 0.00 3.27 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.74 0.00 30 L 7.47 4.44 0.00 1.77 1.73 0.97 0.92 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 31 L 8.16 4.81 0.00 1.64 1.58 0.96 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 32 P 0.00 4.52 0.00 2.06 2.14 0.00 3.74 0.00 0.00 4.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.05 0.00 33 S 7.98 4.53 0.00 3.98 3.98 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 34 K 7.44 4.57 0.00 1.67 1.96 0.00 1.74 0.00 0.00 1.69 0.00 0.00 2.94 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.44 1.40 7.81 35 K 8.30 4.26 0.00 1.89 1.72 0.00 1.49 0.00 0.00 1.57 0.00 0.00 2.58 0.00 0.00 2.33 0.00 0.00 0.00 0.00 1.56 1.46 7.81 36 I 8.42 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 1.39 0.85 0.99 0.00 0.00 37 N 9.28 5.43 0.00 2.61 2.69 0.00 0.00 6.37 7.17 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 38 S 8.59 5.52 0.00 3.83 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 39 A 8.17 4.79 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 0.00 0.00 0.00 0.00 0.00 40 G 8.94 4.40 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 0.00 41 V 8.66 3.89 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 0.42 0.00 0.00 0.96 0.00 0.00 42 G 7.90 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 0.00 0.00 0.00 0.00 43 A 8.08 4.31 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 44 L 8.39 4.15 0.00 1.59 1.20 0.81 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 45 V 7.77 3.99 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 0.79 0.00 0.00 0.97 0.00 0.00 46 D 9.00 4.72 0.00 2.90 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 47 H 7.97 4.55 0.00 3.29 3.23 0.00 5.64 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 T 8.46 4.63 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 1.23 0.00 0.00 49 A 8.51 4.35 1.24 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 0.00 0.00 0.00 50 D 9.08 4.44 0.00 2.86 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 51 E 9.04 3.88 0.00 2.05 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 2.32 2.37 0.00 52 S 8.77 3.75 0.00 2.95 2.63 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 53 A 7.78 4.16 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.00 3.69 1.98 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 1.53 0.74 0.90 0.00 0.00 55 R 8.08 3.85 0.00 1.93 1.87 0.00 3.06 0.00 0.00 3.15 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.56 0.00 56 V 7.83 3.52 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 1.10 0.00 0.00 0.96 0.00 0.00 57 A 7.96 3.92 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.32 3.95 0.00 2.08 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 2.32 2.31 0.00 59 K 7.81 3.82 0.00 1.73 1.98 0.00 1.74 0.00 0.00 1.63 0.00 0.00 2.97 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.36 1.45 7.81 60 N 7.26 4.79 0.00 2.15 2.68 0.00 0.00 7.07 7.51 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 61 G 8.36 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 0.00 0.00 0.00 62 L 8.00 4.63 0.00 1.74 1.82 1.00 0.95 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 63 C 8.62 4.61 0.00 2.98 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 64 L 8.32 4.62 0.00 1.80 1.66 0.97 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 65 K 7.72 4.04 0.00 1.76 1.76 0.00 1.75 0.00 0.00 1.72 0.00 0.00 3.04 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.45 7.81 66 G 8.85 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 67 H 7.46 4.47 0.00 3.27 3.28 0.00 5.91 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 R 7.77 4.43 0.00 1.74 1.65 0.00 3.28 0.00 0.00 3.36 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.59 0.00 69 G 9.13 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 70 T 9.78 5.04 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 1.21 0.00 0.00 71 K 8.66 4.58 0.00 1.75 1.70 0.00 1.90 0.00 0.00 1.64 0.00 0.00 2.87 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.42 1.50 7.81 72 F 8.88 4.50 0.00 3.02 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 73 T 7.18 4.46 4.08 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 0.00 0.00 1.12 0.00 0.00 74 S 8.49 3.94 0.00 4.01 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 0.00 75 A 7.73 4.06 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 76 L 7.82 3.90 0.00 1.68 1.58 1.09 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 77 A 7.72 4.19 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 78 R 7.62 3.97 0.00 1.85 2.04 0.00 3.24 0.00 0.00 3.22 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.68 0.00 79 Q 7.93 4.26 0.00 1.78 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.40 0.00 0.00 0.00 0.00 0.00 2.27 2.36 0.00 80 Y 7.52 4.75 0.00 2.98 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 81 D 8.59 4.78 0.00 2.87 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 82 L 7.89 4.75 0.00 1.69 1.53 0.50 -0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 83 L 8.87 5.12 0.00 1.62 1.45 1.03 0.40 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 84 L 8.75 5.04 0.00 1.50 1.53 -0.29 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 85 V 8.41 5.07 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 0.90 0.00 0.00 0.91 0.00 0.00 86 M 8.63 4.20 0.00 1.88 2.12 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.63 0.00 87 E 8.05 5.03 0.00 1.63 1.69 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 2.20 2.18 0.00 88 Y 9.34 4.12 0.00 3.01 2.96 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 89 S 8.25 4.15 0.00 4.02 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 90 H 8.01 4.58 0.00 3.40 3.24 0.00 5.65 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 91 L 8.00 3.94 0.00 1.86 1.74 0.98 0.58 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 92 E 8.14 4.07 0.00 2.09 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 2.38 2.47 0.00 93 Q 7.73 4.08 0.00 2.30 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.59 0.00 0.00 0.00 0.00 0.00 2.39 2.40 0.00 94 I 7.95 3.76 1.97 0.00 0.00 0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.00 0.99 0.00 0.00 95 S 7.82 4.00 0.00 4.02 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 96 R 7.81 4.08 0.00 1.97 2.16 0.00 3.26 0.00 0.00 3.24 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.68 0.00 97 I 7.96 4.27 2.17 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.85 1.03 0.00 0.00 98 A 8.72 4.73 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 99 P 0.00 4.33 0.00 2.21 2.15 0.00 3.62 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.29 0.00 100 E 8.20 4.23 0.00 1.96 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 2.33 2.38 0.00 101 A 8.08 4.58 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 0.00 102 R 7.77 3.99 0.00 2.00 2.07 0.00 3.15 0.00 0.00 3.18 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.72 0.00 103 G 8.10 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 0.00 104 K 8.25 4.81 0.00 2.09 2.08 0.00 1.48 0.00 0.00 1.75 0.00 0.00 2.89 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.51 1.46 7.81 105 T 7.75 5.03 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 1.14 0.00 0.00 106 M 8.84 4.91 0.00 1.92 1.92 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.45 0.00 107 L 8.35 4.43 0.00 1.50 1.46 0.33 0.63 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 0.00 108 F 9.42 3.90 0.00 2.95 3.09 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 0.00 109 G 7.99 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 0.00 0.00 0.00 0.00 110 H 7.87 3.70 0.00 2.96 2.47 0.00 5.94 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 W 7.39 4.58 0.00 3.05 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 0.00 112 L 7.42 4.60 0.00 1.90 1.61 1.02 0.99 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 0.00 113 D 8.82 4.46 0.00 2.67 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 0.00 114 S 7.83 4.66 0.00 3.84 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 0.00 115 K 8.53 4.47 0.00 1.73 1.70 0.00 1.63 0.00 0.00 1.57 0.00 0.00 2.77 0.00 0.00 2.53 0.00 0.00 0.00 0.00 1.63 1.40 7.81 116 E 7.99 4.31 0.00 1.99 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 2.27 2.45 0.00 117 I 8.15 4.24 1.80 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.95 0.82 0.00 0.00 118 P 0.00 4.44 0.00 1.88 1.96 0.00 3.62 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.07 0.00 119 D 8.47 4.49 0.00 2.77 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 0.00 120 P 0.00 4.27 0.00 0.49 1.53 0.00 3.68 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.60 0.00 121 Y 8.12 4.62 0.00 2.89 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 0.00 122 R 8.78 3.82 0.00 1.86 1.94 0.00 3.05 0.00 0.00 3.04 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.50 0.00 123 M 8.15 4.43 0.00 2.02 2.16 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.80 2.47 0.00 124 S 8.25 4.56 0.00 4.16 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 0.00 125 D 8.61 4.46 0.00 2.73 2.78 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 0.00 126 E 8.50 4.49 0.00 2.19 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 0.00 2.40 2.20 0.00 127 A 7.66 4.03 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 0.00 128 F 8.16 3.95 0.00 3.23 3.17 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 0.00 129 D 8.71 4.47 0.00 2.91 2.78 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 0.00 130 S 8.16 4.14 0.00 3.93 4.04 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 0.00 131 V 8.10 3.55 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 0.91 0.00 0.00 0.90 0.00 0.00 132 Y 8.47 3.93 0.00 3.28 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 0.00 133 Q 8.33 4.04 0.00 2.30 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.58 0.00 0.00 0.00 0.00 0.00 2.40 2.47 0.00 134 L 7.95 4.00 0.00 1.92 1.72 0.92 0.71 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 0.00 135 L 8.09 4.05 0.00 1.59 1.53 0.74 0.46 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 0.00 136 E 8.08 3.81 0.00 1.71 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 2.32 2.30 0.00 137 Q 8.42 3.97 0.00 2.17 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.58 0.00 0.00 0.00 0.00 0.00 2.38 2.40 0.00 138 A 8.43 4.11 1.66 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 0.00 139 S 8.52 4.12 0.00 4.15 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 0.00 140 K 8.15 3.98 0.00 1.96 1.86 0.00 1.68 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.48 1.67 7.81 141 R 7.77 4.13 0.00 1.79 1.75 0.00 3.17 0.00 0.00 3.26 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.71 0.00 142 W 8.42 4.16 0.00 3.37 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 0.00 143 A 8.08 4.11 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 0.00 144 E 8.22 3.99 0.00 2.00 1.85 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 2.26 2.46 0.00 145 K 7.67 3.86 0.00 1.81 1.74 0.00 1.05 0.00 0.00 1.16 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.62 0.21 7.81 146 L 7.83 5.02 0.00 1.72 1.78 0.95 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 147 G 7.83 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