NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 P 4.3928 0.0000 0.0000 62.6864 33.4370 177.3945 2 R 3.9101 7.9993 118.5074 56.6153 30.0269 174.4267 3 R 4.4854 7.6266 112.0344 57.5551 32.8862 176.1433 4 R 4.1928 7.6289 122.2224 54.1120 27.8324 176.1507 5 V 3.8985 7.5638 115.4841 61.4999 33.2622 175.9285 6 I 4.3098 7.7519 115.3123 60.1028 39.8303 173.0808 7 G 4.2102 8.4955 108.3413 44.7835 0.0000 173.1124 8 Q 4.6345 8.4626 113.1682 54.9926 31.1246 174.9025 9 R 4.0124 8.7071 118.0589 56.3795 30.0187 175.8795 10 K 4.6012 8.3010 118.8542 54.7158 34.7379 175.2536 11 I 4.7231 7.6314 111.6128 58.5482 40.4561 175.5007 12 L 4.0705 8.3527 121.4163 54.0698 41.9423 175.5957 13 P 4.4424 0.0000 0.0000 62.1349 32.2084 175.0622 14 D 4.4732 8.4872 117.9193 53.6335 40.9417 175.0517 15 P 4.4471 0.0000 0.0000 64.9330 31.2364 176.7185 16 K 4.5287 9.2135 118.5307 56.0980 33.4837 175.4353 17 F 4.7401 8.9498 115.2291 59.4105 46.5698 175.7197 18 G 4.1179 8.5084 104.8114 45.1433 0.0000 173.3042 19 S 4.3778 8.0914 115.4379 57.4866 63.4821 174.5942 20 E 3.9979 8.8655 127.2939 59.5205 29.2031 179.1902 21 L 3.9315 7.7942 118.4823 57.8480 41.6894 179.0424 22 L 3.6275 7.5838 119.3989 57.9631 41.7375 178.6871 23 A 3.9955 8.0395 120.1943 55.5140 18.2058 179.6197 24 K 3.9282 8.1023 116.6333 59.5812 31.9620 179.3855 25 F 4.3001 8.5669 121.3758 61.2936 39.2015 177.7086 26 V 3.4163 8.1137 112.3223 64.3216 31.1374 178.0872 27 N 4.2230 7.5252 114.8768 56.6413 38.5097 177.0591 28 I 3.6949 7.4209 119.6272 63.9419 37.1699 177.3737 29 L 4.1396 6.9783 119.6275 55.5734 42.6445 176.5775 30 M 4.1177 7.5859 118.6155 55.9537 32.9396 175.2922 31 V 4.4111 7.9115 120.3903 61.1720 34.3300 173.7243 32 D 4.4365 9.7135 118.2626 54.7165 38.5866 173.9391 33 G 3.9428 7.9770 103.6852 47.2276 0.0000 176.5244 34 K 4.4327 7.9953 119.5550 54.2315 30.3364 176.2587 35 K 3.9046 7.9527 124.0448 59.5321 32.9300 177.5420 36 S 4.3755 8.4408 116.3978 61.8337 62.5871 176.9608 37 T 4.1116 7.8171 110.1964 64.1736 69.0735 176.1194 38 A 4.0554 7.8273 124.5706 55.0089 18.0353 179.0542 39 E 3.7185 8.3821 115.5594 59.9197 29.3246 179.4831 40 S 4.3683 7.8399 114.7665 61.3564 62.5333 176.1819 41 I 4.1796 7.8938 120.9642 62.3418 37.0323 178.2265 42 V 3.5940 7.2893 119.4342 65.8819 31.7311 177.3193 43 Y 4.2853 7.6117 116.3739 61.3043 37.8290 178.4999 44 S 4.2185 8.0138 112.4499 61.3090 62.4327 176.0814 45 A 4.1062 7.7064 123.4114 54.7342 17.7745 178.6301 46 L 4.2523 8.2895 117.0881 56.2214 42.2097 177.9398 47 E 4.2343 8.1867 119.2309 59.7860 30.1145 177.8078 48 T 3.9393 7.8516 109.6692 64.7677 68.5629 175.9940 49 L 3.9187 8.0375 122.9257 57.8548 42.0954 178.5032 50 A 4.0222 7.5672 119.7768 55.3506 18.1134 179.3887 51 Q 3.8625 7.8984 116.3015 59.4399 29.4111 178.0985 52 R 4.0106 7.8715 118.4441 58.6102 30.1923 177.4182 53 S 4.5535 8.0737 112.8162 58.2808 64.0375 177.1033 54 G 3.9949 8.3539 109.3421 46.3008 0.0000 174.9648 55 K 4.2551 7.8697 119.9784 57.4362 29.6635 177.9485 56 S 3.5482 7.8892 114.9874 58.7741 62.9411 169.7999 57 E 4.5389 8.5806 112.9752 58.2722 31.9418 178.2522 58 L 3.9560 8.2539 118.3368 57.9504 41.8871 178.5116 59 E 4.3166 8.1051 113.4319 56.4437 29.9648 177.8515 60 A 4.0011 7.8271 123.7520 55.3957 18.2961 179.6637 61 F 3.7649 7.8171 119.4962 61.8069 39.4449 176.3028 62 E 3.8341 8.6243 117.1251 60.2333 29.0195 178.6469 63 V 3.4239 8.1845 118.4531 66.8902 31.7295 177.9196 64 A 4.0238 7.8411 119.8236 55.1390 18.1666 179.1841 65 L 3.9086 7.7819 118.4746 57.3565 41.9607 177.7994 66 E 4.2235 8.0901 117.5094 57.3819 29.6723 177.6711 67 N 4.5227 7.4927 114.5688 56.7605 39.0139 176.5713 68 V 3.7093 8.0858 118.2359 66.4738 31.9359 176.0308 69 R 3.6362 7.4029 118.6361 54.5962 29.3194 173.7148 70 P 5.0111 0.0000 0.0000 62.3119 33.3433 175.2583 71 T 4.5218 8.5493 113.1799 64.6440 70.6837 174.8501 72 V 4.7423 7.3226 111.0737 59.7707 36.4286 174.5800 73 E 4.4910 8.7922 118.7305 55.6096 31.2494 174.0625 74 V 4.8915 8.2786 110.2851 59.9274 35.4553 175.4831 75 K 4.4341 9.3107 126.0495 54.2719 33.9176 175.1423 76 S 4.1416 8.7383 123.0554 59.5254 62.9157 174.6053 77 R 4.2907 8.7013 121.2522 57.1487 31.9010 177.0192 78 R 4.1932 7.6386 110.8365 56.5574 26.7971 175.2452 79 V 3.6679 7.0226 118.8927 62.4325 32.8470 175.6728 80 G 3.7850 7.4832 115.5136 44.1299 0.0000 172.1514 81 G 4.0878 8.9258 112.2883 45.6303 0.0000 171.9263 82 S 4.7798 7.7800 113.9434 56.8963 67.0575 175.5774 83 T 3.9984 8.8414 120.7679 65.3411 68.6805 174.5392 84 Y 3.5713 8.0656 117.8299 58.4726 35.6008 171.9736 85 Q 4.1197 7.7333 118.1405 55.9612 29.6561 175.2847 86 V 4.2582 7.9720 123.2759 60.9035 33.3031 172.9984 87 P 5.0802 0.0000 0.0000 62.5279 32.4013 175.5128 88 V 4.6093 8.6047 122.1232 59.8498 35.5118 173.7764 89 E 4.9018 8.5698 120.3916 54.8208 30.4652 176.9572 90 V 3.9162 8.0481 124.9496 61.6377 32.6213 176.2851 91 R 4.3546 8.4251 121.4456 55.0716 31.5445 175.2258 92 P 4.9837 0.0000 0.0000 60.5058 29.3166 174.9290 93 V 4.2296 6.9832 118.4237 60.9248 36.6517 174.9037 94 R 3.9442 8.3292 120.0213 60.0227 30.1249 179.8716 95 R 2.8948 7.9035 111.1782 55.2092 32.4971 177.8371 96 N 3.9382 8.2725 114.7905 55.6479 38.7004 176.2179 97 A 4.1097 8.2061 124.4146 54.7702 18.4498 179.0510 98 L 3.2236 7.7148 115.9000 57.8408 41.5489 179.2807 99 A 4.1139 7.5897 119.8952 55.9055 18.2235 179.7549 100 M 4.0937 8.6524 117.7245 58.5853 32.1249 178.8629 101 R 3.7963 8.3246 119.4495 59.2528 30.1752 178.5537 102 W 4.4258 8.4402 118.9519 59.8301 28.9385 178.3603 103 I 3.7473 8.0234 119.7288 64.7435 36.5280 178.7529 104 V 3.6227 8.7170 119.3221 65.5273 31.1637 176.8652 105 E 4.2786 8.7126 116.6957 57.0320 30.0949 176.9764 106 A 4.4063 8.0526 119.9212 54.6682 19.7419 179.0725 107 A 4.0462 7.8284 119.3956 54.9876 18.1902 179.7998 108 R 3.9166 7.6562 117.0444 58.8899 30.1785 177.8235 109 K 4.3884 7.4363 115.2287 55.3554 32.5709 176.6443 110 R 4.2895 7.1235 120.0466 55.7524 31.3353 176.5328 111 G 4.2886 8.2868 109.8624 44.2166 0.0000 172.4082 112 D 4.8930 7.5343 122.8187 54.4039 40.6596 178.1675 113 K 4.3776 8.5514 124.8460 57.6914 34.6998 176.7433 114 S 4.3708 8.1883 114.0190 58.4241 65.2511 173.9428 115 M 4.1638 8.6435 125.6462 58.5118 31.9019 178.3986 116 A 4.0027 7.9152 120.7225 55.1317 18.5558 179.3119 117 L 3.9302 7.9093 116.5212 58.3260 41.7941 179.8279 118 R 4.0539 8.5792 117.9810 59.4899 29.9547 178.6934 119 L 4.0504 8.3106 120.2374 58.0670 42.1439 178.6459 120 A 4.2135 8.3808 120.7983 55.3713 17.3164 178.8074 121 N 4.4896 8.5393 113.6501 54.8358 38.7135 176.8512 122 E 4.0274 7.6685 119.0985 58.7041 30.2733 177.8422 123 L 3.7173 8.3184 120.3049 58.6788 42.0598 179.1937 124 S 4.2648 8.1981 112.0982 60.7302 62.8161 175.2297 125 D 4.4279 7.5319 121.2390 57.0614 40.8633 177.8814 126 A 4.0862 8.5301 121.6391 54.4140 18.0933 179.0836 127 A 3.9295 7.1368 118.0263 54.5878 18.6802 178.9314 128 E 4.3160 7.6362 113.0089 61.0213 30.1050 178.5279 129 N 3.8885 8.5225 114.7374 55.3286 35.1331 173.7343 130 K 4.3377 8.0623 122.8468 57.6094 33.8299 176.1328 131 G 4.2070 7.7853 110.3222 45.5232 0.0000 174.1810 132 T 3.9283 8.1038 113.8185 66.7268 68.4986 176.2295 133 A 3.9564 7.5744 122.2043 55.7490 18.5574 180.0228 134 V 3.7711 7.8410 109.6945 64.4749 31.5847 178.6180 135 K 3.9557 7.8525 118.9010 58.8916 31.9583 178.7410 136 K 3.5911 8.1930 120.4732 59.0346 31.6883 178.7150 137 R 3.8305 7.5067 118.7873 58.4722 30.3705 176.4574 138 E 4.4777 7.7258 118.6262 55.3418 29.3411 175.6297 139 D 4.7748 7.3319 119.3296 55.8221 47.3800 178.7715 140 V 3.5554 7.7436 119.1069 66.1521 31.5734 177.5543 141 H 4.4168 7.7290 115.1795 57.7938 28.9398 177.4742 142 R 4.1217 7.8031 118.2391 59.2423 30.3709 177.9387 143 M 4.1280 8.4604 118.2122 58.3434 31.9577 176.2303 144 A 4.6391 8.1456 120.6627 51.6813 21.3188 176.7924 145 E 3.7381 8.6967 117.6623 57.0047 28.0184 174.5931 146 A 4.7271 7.4880 117.5467 53.4209 25.3232 178.5983 147 N 4.6353 8.3647 109.5370 53.8794 38.8470 177.2592 148 K 3.8051 8.0348 121.5973 59.3232 32.2630 178.0459 149 A 4.3376 8.1991 119.4230 53.7948 18.2773 177.2640 150 F 4.6675 8.3466 114.7416 56.8393 39.6830 175.8826 151 A 4.2240 7.5501 127.9838 52.6092 18.0657 178.3178 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 P 0.00 4.39 0.00 2.19 2.25 0.00 3.73 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 1.88 1.96 0.00 2 R 8.00 3.91 0.00 1.87 1.99 0.00 3.18 0.00 0.00 3.25 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.68 0.00 3 R 7.63 4.49 0.00 1.89 1.90 0.00 3.09 0.00 0.00 3.15 7.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.59 0.00 4 R 7.63 4.19 0.00 1.77 1.91 0.00 3.31 0.00 0.00 3.22 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.71 0.00 5 V 7.56 3.90 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 0.86 0.00 0.00 0.93 0.00 0.00 6 I 7.75 4.31 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 1.34 0.46 0.97 0.00 0.00 7 G 8.50 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 0.00 0.00 0.00 0.00 8 Q 8.46 4.63 0.00 2.13 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.93 0.00 0.00 0.00 0.00 0.00 2.07 2.08 0.00 9 R 8.71 4.01 0.00 1.94 1.98 0.00 2.99 0.00 0.00 3.22 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.65 0.00 10 K 8.30 4.60 0.00 1.74 1.76 0.00 1.69 0.00 0.00 1.76 0.00 0.00 3.02 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.35 1.39 7.81 11 I 7.63 4.72 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 1.30 0.66 0.91 0.00 0.00 12 L 8.35 4.07 0.00 1.67 1.66 0.93 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 13 P 0.00 4.44 0.00 2.18 2.16 0.00 3.78 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.97 0.00 14 D 8.49 4.47 0.00 2.94 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 15 P 0.00 4.45 0.00 2.29 2.24 0.00 3.91 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.09 0.00 16 K 9.21 4.53 0.00 1.28 1.38 0.00 1.34 0.00 0.00 0.61 0.00 0.00 2.69 0.00 0.00 2.84 0.00 0.00 0.00 0.00 0.76 1.02 7.81 17 F 8.95 4.74 0.00 3.27 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 18 G 8.51 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 0.00 0.00 0.00 19 S 8.09 4.38 0.00 3.80 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 20 E 8.87 4.00 0.00 2.00 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 2.40 2.34 0.00 21 L 7.79 3.93 0.00 1.54 1.48 0.98 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 22 L 7.58 3.63 0.00 1.29 1.47 0.35 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 23 A 8.04 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 24 K 8.10 3.93 0.00 2.04 1.90 0.00 1.69 0.00 0.00 1.58 0.00 0.00 3.11 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.69 7.81 25 F 8.57 4.30 0.00 3.15 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 26 V 8.11 3.42 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 0.77 0.00 0.00 0.98 0.00 0.00 27 N 7.53 4.22 0.00 2.80 2.86 0.00 0.00 7.10 7.26 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 28 I 7.42 3.69 1.84 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.72 0.81 0.00 0.00 29 L 6.98 4.14 0.00 1.10 1.52 0.74 0.83 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 30 M 7.59 4.12 0.00 1.92 2.00 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 2.70 2.51 0.00 31 V 7.91 4.41 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 0.77 0.00 0.00 0.91 0.00 0.00 32 D 9.71 4.44 0.00 2.78 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 33 G 7.98 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 34 K 8.00 4.43 0.00 1.85 1.74 0.00 1.66 0.00 0.00 1.57 0.00 0.00 2.96 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.36 1.57 7.81 35 K 7.95 3.90 0.00 1.82 1.81 0.00 1.77 0.00 0.00 1.84 0.00 0.00 2.96 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.53 1.53 7.81 36 S 8.44 4.38 0.00 3.91 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 37 T 7.82 4.11 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 1.22 0.00 0.00 38 A 7.83 4.06 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 39 E 8.38 3.72 0.00 2.67 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 0.00 2.70 2.56 0.00 40 S 7.84 4.37 0.00 4.24 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 41 I 7.89 4.18 1.85 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 1.42 1.17 0.93 0.00 0.00 42 V 7.29 3.59 1.65 0.00 0.00 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 0.82 0.00 0.00 43 Y 7.61 4.29 0.00 3.16 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 44 S 8.01 4.22 0.00 4.12 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 45 A 7.71 4.11 1.49 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 0.00 0.00 46 L 8.29 4.25 0.00 2.10 1.91 1.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 47 E 8.19 4.23 0.00 2.50 2.09 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 2.32 2.41 0.00 48 T 7.85 3.94 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 1.30 0.00 0.00 49 L 8.04 3.92 0.00 2.01 1.89 0.94 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 50 A 7.57 4.02 1.60 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 51 Q 7.90 3.86 0.00 2.10 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.87 0.00 0.00 0.00 0.00 0.00 2.39 2.38 0.00 52 R 7.87 4.01 0.00 2.01 2.00 0.00 3.30 0.00 0.00 3.29 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.66 0.00 53 S 8.07 4.55 0.00 4.10 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 54 G 8.35 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 55 K 7.87 4.26 0.00 1.76 1.81 0.00 1.88 0.00 0.00 1.64 0.00 0.00 2.89 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.71 1.53 7.81 56 S 7.89 3.55 0.00 3.97 3.86 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 57 E 8.58 4.54 0.00 2.12 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 2.58 2.59 0.00 58 L 8.25 3.96 0.00 1.78 1.75 0.97 1.04 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 59 E 8.11 4.32 0.00 2.16 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 2.35 2.32 0.00 60 A 7.83 4.00 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 61 F 7.82 3.76 0.00 2.96 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 62 E 8.62 3.83 0.00 2.11 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 2.45 2.38 0.00 63 V 8.18 3.42 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 0.85 0.00 0.00 0.95 0.00 0.00 64 A 7.84 4.02 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 65 L 7.78 3.91 0.00 1.12 1.64 0.66 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 66 E 8.09 4.22 0.00 2.30 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 2.32 2.35 0.00 67 N 7.49 4.52 0.00 2.99 2.84 0.00 0.00 6.88 7.56 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 68 V 8.09 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 1.14 0.00 0.00 1.00 0.00 0.00 69 R 7.40 3.64 0.00 1.95 1.84 0.00 3.37 0.00 0.00 3.29 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.71 0.00 70 P 0.00 5.01 0.00 2.39 2.52 0.00 3.84 0.00 0.00 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.10 0.00 71 T 8.55 4.52 4.48 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 1.27 0.00 0.00 72 V 7.32 4.74 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 0.83 0.00 0.00 0.94 0.00 0.00 73 E 8.79 4.49 0.00 2.13 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 2.21 2.29 0.00 74 V 8.28 4.89 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 0.67 0.00 0.00 0.92 0.00 0.00 75 K 9.31 4.43 0.00 1.75 1.68 0.00 1.67 0.00 0.00 1.66 0.00 0.00 2.86 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.32 1.38 7.81 76 S 8.74 4.14 0.00 3.79 3.80 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 77 R 8.70 4.29 0.00 2.15 2.02 0.00 3.54 0.00 0.00 3.26 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.65 0.00 78 R 7.64 4.19 0.00 1.87 1.95 0.00 3.40 0.00 0.00 3.02 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.66 0.00 79 V 7.02 3.67 1.84 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 0.68 0.00 0.00 0.89 0.00 0.00 80 G 7.48 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 0.00 0.00 0.00 81 G 8.93 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 0.00 0.00 0.00 0.00 82 S 7.78 4.78 0.00 4.06 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 83 T 8.84 4.00 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 1.21 0.00 0.00 84 Y 8.07 3.57 0.00 3.01 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 85 Q 7.73 4.12 0.00 2.10 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.81 0.00 0.00 0.00 0.00 0.00 2.15 2.22 0.00 86 V 7.97 4.26 2.14 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 1.09 0.00 0.00 1.15 0.00 0.00 87 P 0.00 5.08 0.00 2.14 2.04 0.00 3.84 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.16 0.00 88 V 8.60 4.61 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 0.76 0.00 0.00 0.95 0.00 0.00 89 E 8.57 4.90 0.00 1.87 1.94 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 2.27 2.38 0.00 90 V 8.05 3.92 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 0.78 0.00 0.00 0.94 0.00 0.00 91 R 8.43 4.35 0.00 1.89 1.88 0.00 3.13 0.00 0.00 3.34 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.65 0.00 92 P 0.00 4.98 0.00 2.04 2.03 0.00 3.73 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 2.03 2.11 0.00 93 V 6.98 4.23 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 0.58 0.00 0.00 0.95 0.00 0.00 94 R 8.33 3.94 0.00 1.87 2.04 0.00 3.08 0.00 0.00 3.08 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.55 0.00 95 R 7.90 2.89 0.00 2.11 1.70 0.00 3.28 0.00 0.00 3.47 8.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.91 0.00 96 N 8.27 3.94 0.00 2.99 3.04 0.00 0.00 5.80 7.46 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 97 A 8.21 4.11 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 98 L 7.71 3.22 0.00 1.26 0.13 0.84 0.48 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 99 A 7.59 4.11 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 0.00 100 M 8.65 4.09 0.00 2.38 2.34 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.75 2.62 0.00 101 R 8.32 3.80 0.00 1.68 1.73 0.00 3.00 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 1.59 1.63 0.00 102 W 8.44 4.43 0.00 3.48 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 0.00 103 I 8.02 3.75 2.24 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.86 1.02 0.00 0.00 104 V 8.72 3.62 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 0.93 0.00 0.00 0.59 0.00 0.00 105 E 8.71 4.28 0.00 1.95 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 0.00 2.33 2.51 0.00 106 A 8.05 4.41 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 0.00 107 A 7.83 4.05 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 0.00 108 R 7.66 3.92 0.00 1.93 2.15 0.00 3.29 0.00 0.00 3.21 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.71 0.00 109 K 7.44 4.39 0.00 1.93 1.82 0.00 1.77 0.00 0.00 1.64 0.00 0.00 2.98 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.57 1.59 7.81 110 R 7.12 4.29 0.00 1.82 2.06 0.00 3.37 0.00 0.00 3.49 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.57 0.00 111 G 8.29 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 0.00 0.00 0.00 0.00 112 D 7.53 4.89 0.00 2.67 1.73 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 0.00 113 K 8.55 4.38 0.00 1.69 1.58 0.00 1.77 0.00 0.00 1.64 0.00 0.00 2.98 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.33 1.33 7.81 114 S 8.19 4.37 0.00 3.90 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 0.00 115 M 8.64 4.16 0.00 2.17 2.05 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.65 0.00 116 A 7.92 4.00 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 0.00 117 L 7.91 3.93 0.00 1.71 1.75 0.96 0.94 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 0.00 118 R 8.58 4.05 0.00 1.94 2.18 0.00 3.27 0.00 0.00 3.16 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.75 0.00 119 L 8.31 4.05 0.00 2.02 1.80 1.07 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 120 A 8.38 4.21 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 0.00 121 N 8.54 4.49 0.00 2.87 2.87 0.00 0.00 6.86 7.72 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 0.00 122 E 7.67 4.03 0.00 2.22 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 2.29 2.56 0.00 123 L 8.32 3.72 0.00 1.86 1.66 0.73 0.68 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 0.00 124 S 8.20 4.26 0.00 3.94 3.91 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 0.00 125 D 7.53 4.43 0.00 3.24 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 0.00 126 A 8.53 4.09 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 0.00 127 A 7.14 3.93 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 0.00 128 E 7.64 4.32 0.00 2.16 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 2.20 2.33 0.00 129 N 8.52 3.89 0.00 2.86 3.29 0.00 0.00 6.64 7.37 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 0.00 130 K 8.06 4.34 0.00 1.81 1.83 0.00 1.55 0.00 0.00 1.70 0.00 0.00 3.26 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.38 1.52 7.81 131 G 7.79 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 0.00 0.00 0.00 0.00 132 T 8.10 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 1.19 0.00 0.00 133 A 7.57 3.96 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 0.00 134 V 7.84 3.77 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 0.88 0.00 0.00 0.99 0.00 0.00 135 K 7.85 3.96 0.00 1.98 1.95 0.00 1.47 0.00 0.00 1.53 0.00 0.00 3.12 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.36 1.39 7.81 136 K 8.19 3.59 0.00 1.26 0.77 0.00 1.17 0.00 0.00 1.17 0.00 0.00 2.86 0.00 0.00 2.68 0.00 0.00 0.00 0.00 0.30 0.21 7.81 137 R 7.51 3.83 0.00 1.92 2.09 0.00 3.10 0.00 0.00 3.41 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.77 0.00 138 E 7.73 4.48 0.00 2.03 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.44 0.00 139 D 7.33 4.77 0.00 2.76 2.50 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 0.00 140 V 7.74 3.56 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 1.00 0.00 0.00 0.75 0.00 0.00 141 H 7.73 4.42 0.00 3.23 3.34 0.00 5.90 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 R 7.80 4.12 0.00 1.84 1.95 0.00 3.35 0.00 0.00 3.14 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.59 0.00 143 M 8.46 4.13 0.00 2.06 2.01 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.56 0.00 144 A 8.15 4.64 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 0.00 145 E 8.70 3.74 0.00 2.11 2.14 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 2.21 2.30 0.00 146 A 7.49 4.73 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 0.00 147 N 8.36 4.64 0.00 2.82 2.74 0.00 0.00 6.78 9.28 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 0.00 148 K 8.03 3.81 0.00 1.87 1.86 0.00 1.66 0.00 0.00 1.67 0.00 0.00 3.01 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.47 1.44 7.81 149 A 8.20 4.34 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 0.00 150 F 8.35 4.67 0.00 3.06 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 0.00 151 A 7.55 4.22 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