NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.1663 8.1727 122.0484 56.2700 34.1002 173.9936 2 V 4.5654 8.1575 127.1214 60.6252 32.4501 174.5009 3 F 4.4274 9.8535 128.8609 57.6693 40.1535 174.8370 4 E 4.3070 9.0652 121.0837 55.4991 31.1123 176.7443 5 R 3.4715 9.0578 120.5964 61.0145 29.9859 179.4247 6 C 4.3587 8.0308 115.3825 59.5815 39.7708 175.7410 7 E 3.9139 8.1217 120.8218 59.1667 29.3059 178.4499 8 L 3.4307 8.0373 120.0905 57.8634 42.0895 178.4695 9 A 3.9276 7.8028 120.6848 55.5711 18.1898 179.9382 10 R 3.9005 8.0484 116.2550 59.4764 30.2240 179.4263 11 T 3.8403 7.8224 115.5958 66.7084 68.4835 176.6838 12 L 3.8495 8.1402 121.2472 57.4106 41.5013 179.5060 13 K 3.8731 8.0952 119.5605 59.7395 31.9963 179.1682 14 R 3.9395 8.0066 116.9914 58.8440 29.9817 178.0853 15 L 4.3632 7.4224 116.1115 54.2568 41.6995 177.0345 16 G 3.8652 7.9874 107.0493 46.8572 0.0000 175.0873 17 M 3.9231 7.8180 121.3151 56.4114 32.3841 175.7845 18 D 4.3846 8.0272 117.9454 55.7217 41.0971 175.8393 19 G 3.9456 9.6011 116.0568 45.4273 0.0000 171.4633 20 Y 4.1909 8.2391 122.0710 58.7569 38.9329 176.3305 21 R 3.6171 9.0691 126.5844 57.2652 27.8268 177.2524 22 G 3.8262 8.2720 103.4972 45.6648 0.0000 174.0642 23 I 4.0300 7.6568 122.2020 59.4510 38.1133 175.9811 24 S 4.6442 8.2923 120.7952 57.8857 65.0181 174.8341 25 L 4.2252 8.5716 124.3186 58.4940 41.8514 179.2181 26 A 4.1268 8.1390 120.2044 55.2498 18.2137 179.2902 27 N 4.4100 8.0087 115.0945 56.3440 38.5740 177.6702 28 W 4.2823 7.9469 119.8842 60.0687 29.0476 178.5510 29 M 4.1367 8.4673 118.8487 58.4963 31.4406 177.9762 30 C 3.1852 7.9235 118.6302 59.0160 43.6469 175.3177 31 L 4.0183 8.2598 121.9021 58.3167 41.7759 178.8237 32 A 4.1073 8.5048 120.9578 54.9112 18.2725 179.3963 33 K 2.9950 8.2429 118.1441 59.4739 32.0711 179.1907 34 W 4.3100 7.7237 117.3689 59.2162 29.0346 178.3747 35 E 4.3708 8.4541 118.8691 58.6408 29.5011 177.7203 36 S 4.5414 7.9210 109.4473 56.5043 64.5878 174.3814 37 G 3.6808 8.3121 108.8598 46.9987 0.0000 173.6670 38 Y 3.6501 7.7734 113.2698 58.4561 35.6941 168.6334 39 N 5.2012 7.7632 119.5532 52.1809 39.3018 176.0334 40 T 4.0244 8.9812 117.6394 64.1592 69.0645 175.8988 41 R 4.4734 8.2777 119.3330 55.7429 30.7370 176.2561 42 A 4.3074 7.8305 121.9062 52.7112 19.2911 177.0572 43 T 5.0911 8.3481 111.1537 60.0788 72.3828 173.0596 44 N 4.8796 8.7381 122.2194 52.3307 42.2880 172.4127 45 Y 4.7375 8.7519 127.9209 57.2962 40.8784 173.8802 46 N 4.7994 8.3408 124.5510 50.9783 38.8495 174.9772 47 A 3.7260 8.3512 127.1181 54.9309 18.8704 179.1663 48 G 3.8212 8.1303 103.7430 48.1682 0.0000 173.7480 49 D 4.7618 7.5328 114.9767 51.8351 40.0833 175.4846 50 R 3.8829 8.1074 116.3757 56.8382 28.2455 175.8604 51 S 4.9763 7.4925 111.0629 56.9647 66.5711 172.7153 52 T 5.1053 8.7533 115.9141 61.9517 72.5977 172.8255 53 D 5.3976 8.9354 125.6293 53.3214 43.0283 175.0899 54 Y 4.9827 9.2695 121.1364 57.4006 41.6858 177.3922 55 G 4.4659 8.8813 111.5493 45.8917 0.0000 173.6334 56 I 3.8268 8.2626 116.8153 62.7436 37.8245 177.0185 57 F 4.8433 8.0343 115.5433 56.2871 39.9183 175.3700 58 Q 3.5417 8.1326 118.5660 57.0668 26.5012 173.8760 59 A 4.4307 8.5586 120.4245 51.9194 20.4863 177.7085 60 N 5.4088 9.2797 121.8023 53.1319 39.8834 175.9561 61 S 4.9596 9.2613 121.5320 60.4392 63.2057 175.5219 62 R 3.7784 8.5682 121.5482 58.6917 30.3011 177.8037 63 Y 4.2863 7.6951 113.0606 58.0458 41.4998 176.8211 64 W 4.4228 8.7073 119.4182 57.6337 30.3704 173.5447 65 C 5.9044 7.8723 110.1210 52.5609 45.6135 171.7550 66 N 5.0696 9.0177 119.3626 51.9415 40.1950 174.5214 67 D 4.8419 8.5167 122.8223 52.2307 40.5425 177.9494 68 G 4.0871 8.3602 109.4273 46.0211 0.0000 174.7956 69 K 4.3731 7.9176 115.9424 56.7197 33.0297 176.0491 70 T 4.5609 7.6923 117.1617 61.6244 69.2462 172.9684 71 P 4.2394 0.0000 0.0000 63.7900 32.0796 176.3141 72 G 3.8780 8.3821 107.9961 46.4194 0.0000 173.2130 73 A 4.4846 7.6126 120.5703 50.5599 20.6336 177.1668 74 V 4.4299 8.0152 119.3462 61.1192 35.3897 175.3666 75 N 4.9066 8.0123 118.5992 51.3741 38.5126 174.4095 76 A 3.7903 8.9296 124.4818 54.6983 19.0048 178.8247 77 A 4.4439 8.1189 115.9237 52.0718 19.8008 176.5059 78 H 4.2028 7.9827 112.6347 56.4601 26.8182 174.1393 79 L 4.8187 7.3058 117.4103 52.9148 46.5303 176.3705 80 S 4.6895 8.3709 115.3065 57.9689 63.3123 176.0446 81 C 4.0907 8.7137 124.5099 59.6768 40.5870 176.4009 82 S 3.9232 7.7557 114.6000 61.2568 61.6895 175.9364 83 A 4.1259 7.8743 122.3428 54.2528 18.0185 177.8830 84 L 4.5383 7.7413 116.7342 54.8161 41.7511 177.4792 85 L 5.0548 7.9535 116.7650 54.5483 42.4997 176.7195 86 Q 4.4140 7.8079 117.7039 55.1735 29.6933 175.9082 87 D 4.3891 8.5156 119.6943 57.1089 41.1181 176.7499 88 N 4.5739 8.0393 118.2301 53.2063 39.1501 174.5161 89 I 4.2906 8.4512 119.0946 61.0427 38.0530 177.0331 90 A 3.9305 8.4343 125.1385 56.0832 18.1804 180.2892 91 D 4.3241 8.0866 116.5019 57.3368 40.9089 178.6976 92 A 4.1030 7.9812 120.9952 55.0788 18.3517 179.7257 93 V 3.3775 8.1417 116.8794 66.0058 31.6198 178.1375 94 A 3.8207 8.0631 120.3411 55.0350 18.1991 179.5258 95 A 3.9792 8.2319 119.1397 55.2334 18.5797 179.7376 96 A 4.1080 8.1739 119.4556 55.2045 18.0986 180.0647 97 K 3.8042 7.8115 116.5870 59.3690 32.3686 179.2266 98 R 4.0954 7.9434 119.0388 59.3494 30.1368 178.5637 99 V 2.7736 7.4526 117.9253 65.9406 31.1988 178.0696 100 V 3.9211 7.4865 108.3354 62.8785 31.6003 177.8821 101 R 4.1946 7.6634 116.9068 56.9119 30.5291 176.3909 102 D 4.7448 7.4391 119.5770 52.5151 41.9621 175.3392 103 P 4.2442 0.0000 0.0000 66.3223 31.2362 177.9289 104 Q 4.0030 8.1950 117.3226 56.4101 30.0383 177.4104 105 G 3.6961 8.0271 107.3277 46.0348 0.0000 175.8165 106 I 3.5584 7.7580 119.9349 63.3547 37.9304 177.8858 107 R 4.2384 7.4181 117.5593 57.8370 30.0149 177.4832 108 A 4.0435 7.6547 120.8323 54.2144 18.6554 177.6002 109 W 4.6431 8.0905 117.0828 55.4890 29.5937 177.4033 110 V 3.7332 8.7307 123.9939 66.0335 31.0142 177.5856 111 A 4.1077 8.3246 120.0090 54.7238 18.0833 179.3162 112 W 4.0099 8.4753 127.2364 60.6772 30.5866 178.4365 113 R 3.7498 8.1942 116.4488 59.4115 29.6657 178.3804 114 N 4.4852 7.9943 115.4512 55.2403 38.5385 176.1750 115 R 4.3872 7.5664 112.8053 55.4823 30.3677 174.9839 116 C 4.4982 7.3320 115.0475 58.1663 43.4521 174.3282 117 Q 3.1101 6.7301 120.5514 56.9424 28.6706 175.5375 118 N 4.1729 8.6071 122.1908 54.6642 36.1454 173.8099 119 R 4.5309 7.2776 114.3069 54.0575 33.5888 175.7092 120 D 4.5727 8.4839 118.9642 54.0569 40.3390 175.7691 121 V 4.6148 8.1690 118.8779 61.3342 32.3603 178.3132 122 R 4.0485 8.2352 122.2806 59.4869 29.5781 178.7294 123 Q 4.0424 8.1030 115.7804 59.2818 28.3964 177.9531 124 Y 4.2232 8.0120 118.0888 59.8342 38.3742 176.5399 125 V 4.3404 7.7913 110.8574 60.5879 33.1209 175.2633 126 Q 4.1317 8.0160 122.2084 57.4548 29.0813 176.4445 127 G 3.9615 8.9295 112.8725 46.0591 0.0000 174.3426 128 C 4.4451 8.0819 115.8201 56.6469 40.5956 173.9581 129 G 3.8594 8.1347 107.2847 46.7708 0.0000 174.1978 130 V 4.0098 7.8795 118.0682 61.0856 32.0975 175.8314 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 K 8.17 4.17 0.00 1.79 1.66 0.00 1.24 0.00 0.00 0.90 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.85 1.08 7.81 2 V 8.16 4.57 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 0.91 0.00 0.00 0.95 0.00 0.00 3 F 9.85 4.43 0.00 2.86 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 4 E 9.07 4.31 0.00 1.97 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 2.31 2.25 0.00 5 R 9.06 3.47 0.00 1.99 1.93 0.00 3.32 0.00 0.00 3.40 7.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.85 0.00 6 C 8.03 4.36 0.00 3.01 3.12 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 7 E 8.12 3.91 0.00 2.07 2.26 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 2.68 2.44 0.00 8 L 8.04 3.43 0.00 1.27 1.32 -0.23 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 9 A 7.80 3.93 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 10 R 8.05 3.90 0.00 1.88 1.99 0.00 3.14 0.00 0.00 3.17 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.66 0.00 11 T 7.82 3.84 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 1.22 0.00 0.00 12 L 8.14 3.85 0.00 1.69 1.56 0.93 0.38 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 13 K 8.10 3.87 0.00 1.95 1.92 0.00 1.65 0.00 0.00 1.65 0.00 0.00 3.15 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.44 1.50 7.81 14 R 8.01 3.94 0.00 1.93 1.97 0.00 3.21 0.00 0.00 3.22 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.84 0.00 15 L 7.42 4.36 0.00 1.65 1.56 0.88 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 16 G 7.99 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 17 M 7.82 3.92 0.00 1.29 1.96 0.00 0.00 0.00 0.00 0.00 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.20 0.00 18 D 8.03 4.38 0.00 2.67 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 G 9.60 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 20 Y 8.24 4.19 0.00 3.37 3.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 R 9.07 3.62 0.00 1.91 1.85 0.00 3.30 0.00 0.00 2.86 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 1.42 0.00 22 G 8.27 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 I 7.66 4.03 1.73 0.00 0.00 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.62 -0.37 0.00 0.00 24 S 8.29 4.64 0.00 4.10 4.02 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 25 L 8.57 4.23 0.00 2.00 1.80 0.97 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 26 A 8.14 4.13 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 N 8.01 4.41 0.00 2.72 2.74 0.00 0.00 6.96 7.55 0.00 0.00 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 W 7.95 4.28 0.00 3.57 3.10 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 29 M 8.47 4.14 0.00 2.19 2.33 0.00 0.00 0.00 0.00 0.00 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.91 0.00 30 C 7.92 3.19 0.00 2.48 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 31 L 8.26 4.02 0.00 1.87 1.91 0.73 -0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 32 A 8.50 4.11 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 33 K 8.24 2.99 0.00 1.87 1.63 0.00 0.61 0.00 0.00 1.10 0.00 0.00 2.60 0.00 0.00 2.27 0.00 0.00 0.00 0.00 1.08 0.35 7.81 34 W 7.72 4.31 0.00 3.39 3.30 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 35 E 8.45 4.37 0.00 2.06 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 0.00 2.62 2.51 0.00 36 S 7.92 4.54 0.00 4.10 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 37 G 8.31 3.68 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 0.00 0.00 0.00 38 Y 7.77 3.65 0.00 3.25 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 39 N 7.76 5.20 0.00 2.85 2.88 0.00 0.00 6.99 6.74 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 40 T 8.98 4.02 4.47 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 1.49 0.00 0.00 41 R 8.28 4.47 0.00 1.98 2.04 0.00 3.19 0.00 0.00 3.24 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.59 0.00 42 A 7.83 4.31 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 43 T 8.35 5.09 4.07 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 1.32 0.00 0.00 44 N 8.74 4.88 0.00 3.08 2.67 0.00 0.00 6.75 7.59 0.00 0.00 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 Y 8.75 4.74 0.00 2.99 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 46 N 8.34 4.80 0.00 2.60 2.57 0.00 0.00 6.64 6.86 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 47 A 8.35 3.73 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 48 G 8.13 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 D 7.53 4.76 0.00 2.70 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 50 R 8.11 3.88 0.00 2.02 2.17 0.00 3.10 0.00 0.00 3.18 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.54 0.00 51 S 7.49 4.98 0.00 3.82 3.88 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 0.00 0.00 0.00 52 T 8.75 5.11 4.18 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 0.67 0.00 0.00 53 D 8.94 5.40 0.00 2.75 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 54 Y 9.27 4.98 0.00 2.91 2.89 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 0.00 0.00 0.00 55 G 8.88 4.47 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 0.00 56 I 8.26 3.83 1.72 0.00 0.00 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 1.83 0.30 0.00 0.00 57 F 8.03 4.84 0.00 3.22 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 58 Q 8.13 3.54 0.00 2.56 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.83 0.00 0.00 0.00 0.00 0.00 2.55 2.78 0.00 59 A 8.56 4.43 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 60 N 9.28 5.41 0.00 3.13 3.11 0.00 0.00 6.97 7.63 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 61 S 9.26 4.96 0.00 4.05 4.47 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 62 R 8.57 3.78 0.00 1.58 1.71 0.00 2.69 0.00 0.00 2.86 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.98 0.00 63 Y 7.70 4.29 0.00 2.01 1.87 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 64 W 8.71 4.42 0.00 3.59 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 65 C 7.87 5.90 0.00 3.16 3.22 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 66 N 9.02 5.07 0.00 2.76 2.68 0.00 0.00 7.11 8.22 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 67 D 8.52 4.84 0.00 2.86 2.70 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 68 G 8.36 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 69 K 7.92 4.37 0.00 1.94 1.94 0.00 1.61 0.00 0.00 1.73 0.00 0.00 3.00 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.43 1.48 7.81 70 T 7.69 4.56 4.23 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 1.15 0.00 0.00 71 P 0.00 4.24 0.00 2.01 1.98 0.00 3.79 0.00 0.00 3.89 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 72 G 8.38 3.88 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 0.00 0.00 0.00 0.00 0.00 0.00 73 A 7.61 4.48 1.25 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 0.00 0.00 0.00 74 V 8.02 4.43 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 0.70 0.00 0.00 0.87 0.00 0.00 75 N 8.01 4.91 0.00 2.75 2.58 0.00 0.00 6.75 8.76 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 76 A 8.93 3.79 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 A 8.12 4.44 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 H 7.98 4.20 0.00 3.29 3.35 0.00 5.81 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 L 7.31 4.82 0.00 1.69 1.51 1.00 0.80 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 80 S 8.37 4.69 0.00 3.83 3.69 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 81 C 8.71 4.09 0.00 2.18 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 82 S 7.76 3.92 0.00 3.83 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 A 7.87 4.13 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 84 L 7.74 4.54 0.00 1.95 1.81 1.15 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 85 L 7.95 5.05 0.00 1.78 1.70 1.12 0.92 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 86 Q 7.81 4.41 0.00 2.25 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.47 7.10 0.00 0.00 0.00 0.00 0.00 2.36 2.50 0.00 87 D 8.52 4.39 0.00 2.62 2.66 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 88 N 8.04 4.57 0.00 2.69 2.75 0.00 0.00 6.95 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 89 I 8.45 4.29 1.80 0.00 0.00 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.48 1.06 0.00 0.00 90 A 8.43 3.93 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 91 D 8.09 4.32 0.00 2.75 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 92 A 7.98 4.10 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 93 V 8.14 3.38 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 0.80 0.00 0.00 0.86 0.00 0.00 94 A 8.06 3.82 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 95 A 8.23 3.98 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 A 8.17 4.11 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 K 7.81 3.80 0.00 1.62 1.43 0.00 1.30 0.00 0.00 0.87 0.00 0.00 2.27 0.00 0.00 2.49 0.00 0.00 0.00 0.00 0.30 0.93 7.81 98 R 7.94 4.10 0.00 2.01 2.15 0.00 3.30 0.00 0.00 3.23 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 2.03 0.00 99 V 7.45 2.77 1.81 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 -0.20 0.00 0.00 -0.67 0.00 0.00 100 V 7.49 3.92 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 1.09 0.00 0.00 1.47 0.00 0.00 101 R 7.66 4.19 0.00 2.04 2.04 0.00 3.24 0.00 0.00 3.40 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 2.15 0.00 102 D 7.44 4.74 0.00 2.99 2.60 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 0.00 103 P 0.00 4.24 0.00 2.15 2.20 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 1.98 2.01 0.00 104 Q 8.19 4.00 0.00 2.07 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.94 0.00 0.00 0.00 0.00 0.00 2.43 2.33 0.00 105 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 0.00 106 I 7.76 3.56 0.95 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.18 -0.77 0.00 0.00 107 R 7.42 4.24 0.00 2.08 2.03 0.00 3.24 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 1.96 1.54 0.00 108 A 7.65 4.04 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 W 8.09 4.64 0.00 3.48 3.26 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 0.00 110 V 8.73 3.73 2.18 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 1.10 0.00 0.00 1.00 0.00 0.00 111 A 8.32 4.11 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 W 8.48 4.01 0.00 3.48 3.49 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 0.00 113 R 8.19 3.75 0.00 2.05 2.00 0.00 3.68 0.00 0.00 3.63 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 2.15 0.00 114 N 7.99 4.49 0.00 2.56 2.73 0.00 0.00 6.84 7.81 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 0.00 115 R 7.57 4.39 0.00 1.09 1.27 0.00 2.63 0.00 0.00 2.86 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.50 0.00 116 C 7.33 4.50 0.00 1.69 2.65 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 0.00 0.00 0.00 0.00 117 Q 6.73 3.11 0.00 0.93 1.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.51 6.82 0.00 0.00 0.00 0.00 0.00 2.18 2.19 0.00 118 N 8.61 4.17 0.00 2.80 2.82 0.00 0.00 6.90 7.66 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 0.00 119 R 7.28 4.53 0.00 1.79 1.79 0.00 3.19 0.00 0.00 3.08 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.36 0.00 120 D 8.48 4.57 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 0.00 121 V 8.17 4.61 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 1.03 0.00 0.00 122 R 8.24 4.05 0.00 1.95 2.16 0.00 3.27 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 1.70 1.80 0.00 123 Q 8.10 4.04 0.00 2.03 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 7.12 0.00 0.00 0.00 0.00 0.00 2.17 1.73 0.00 124 Y 8.01 4.22 0.00 3.24 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 0.00 125 V 7.79 4.34 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 1.01 0.00 0.00 1.05 0.00 0.00 126 Q 8.02 4.13 0.00 2.14 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.84 0.00 0.00 0.00 0.00 0.00 2.34 2.43 0.00 127 G 8.93 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 0.00 128 C 8.08 4.45 0.00 3.09 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 0.00 129 G 8.13 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 0.00 0.00 0.00 130 V 7.88 4.01 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 0.79 0.00 0.00 0.96 0.00 0.00