NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3806 8.2893 120.3493 55.5227 32.0810 174.0295 2 N 4.4831 8.0564 121.2250 50.4752 37.8986 171.2463 3 E 3.9712 9.3418 125.3668 56.9799 29.3257 178.3908 4 L 4.4217 8.1477 124.6853 53.3383 40.6568 175.9962 5 E 4.5265 8.0263 123.2634 53.5675 32.1118 175.8230 6 G 3.7893 8.1316 112.5075 45.1784 0.0000 172.2113 7 Y 4.7447 8.8425 117.1808 56.0906 40.1795 176.8333 8 V 4.0738 8.5749 123.7018 63.4442 32.5364 177.5413 9 T 4.2150 8.1608 117.2841 66.0564 68.8507 174.9576 10 K 4.4102 7.9488 120.1097 56.5918 32.6492 177.2111 11 A 4.2934 8.2074 123.6863 53.5173 18.9223 182.1289 12 Q 3.4254 7.7839 111.8538 57.9502 31.6203 180.1372 13 S 4.0907 7.9977 110.7567 59.9194 63.1836 174.2854 14 F 4.2476 8.5411 119.8797 56.4944 39.8968 174.5092 15 R 4.5681 8.3611 121.7000 54.7113 32.2287 174.3290 16 F 5.6677 8.7102 123.0513 55.7940 43.9256 173.5405 17 A 4.7012 8.5531 120.5371 50.5225 22.5149 175.2082 18 I 4.8274 8.8499 122.7782 59.4789 40.3783 175.0039 19 V 4.5900 8.6549 125.4851 61.1997 34.4268 174.6179 20 V 5.3825 8.7867 120.5131 58.3525 35.3970 174.6001 21 A 5.6904 8.4445 125.4529 50.5475 19.5918 177.8569 22 R 4.2450 9.0600 121.6837 58.8205 30.7154 176.6561 23 F 4.0730 8.1828 119.9243 59.7328 39.8441 174.1835 24 N 4.3220 8.4323 123.3554 54.3340 36.2788 176.0333 25 E 4.5223 8.0191 121.5573 59.2990 29.3894 177.6018 26 F 3.9912 8.3479 118.7281 60.9520 39.4403 176.3946 27 V 4.1283 8.4386 117.1227 65.0413 32.0925 177.5520 28 T 3.8640 8.0108 109.0700 65.0909 68.2729 175.3725 29 R 4.0539 8.5242 122.0198 59.3684 29.9963 178.1778 30 R 3.8122 7.9797 116.7917 59.3081 30.1438 178.1717 31 L 3.8310 8.2958 120.1555 58.6442 41.9661 178.7366 32 M 3.8642 8.5752 117.7669 58.8448 32.1615 177.6604 33 E 4.0775 8.7313 119.1052 59.6150 29.5483 179.8748 34 G 3.4883 8.4221 105.4748 47.7041 0.0000 175.3276 35 A 3.6581 7.8091 124.0487 54.8614 18.4800 178.8188 36 L 4.0721 8.2940 118.7047 58.6320 41.9948 178.3014 37 D 4.4059 8.6020 117.6421 58.1397 41.1741 178.8519 38 T 3.8878 8.0011 115.9247 66.9430 68.2062 176.0615 39 F 4.3037 7.5894 118.0132 60.7547 39.2366 177.4209 40 K 4.1730 8.1738 117.1929 59.7125 31.7694 179.0784 41 K 3.8265 8.5245 118.5242 59.2323 32.5291 176.8586 42 Y 4.3258 8.5760 117.3832 58.4656 38.6149 176.0702 43 S 3.8656 8.2567 111.3469 58.8412 63.5047 172.8229 44 V 3.9743 7.8892 120.3393 62.1054 31.7113 175.7475 45 N 4.7239 8.3020 120.7538 53.6668 40.7056 174.0742 46 E 4.5125 9.0553 126.0498 56.4557 30.7628 174.5649 47 D 4.2889 8.8663 114.0567 59.7586 40.1438 173.9513 48 I 3.5608 6.5085 109.1804 58.4749 39.3936 174.4426 49 D 4.6366 8.7645 124.5277 54.0264 42.2008 175.4087 50 V 4.6276 8.3718 116.5660 59.5756 33.8876 175.0780 51 V 4.2798 8.8769 126.8602 60.9375 33.3405 174.3964 52 W 5.2109 8.8589 128.1647 55.9115 30.2285 176.1922 53 V 4.7214 9.1389 118.0692 58.8685 34.9421 174.9396 54 P 4.3614 0.0000 0.0000 65.4943 32.1352 176.4208 55 G 4.5627 8.2201 108.3898 42.4463 0.0000 173.0835 56 A 3.9499 8.6573 122.7568 55.3820 18.3434 179.4795 57 Y 3.8998 8.3408 116.0947 61.1795 38.8297 178.0917 58 E 4.1109 8.6330 119.2463 59.4549 29.5275 179.3362 59 L 3.9874 7.7365 118.8624 58.7662 41.7136 179.0861 60 G 3.6779 7.8359 101.3173 49.2964 0.0000 175.6068 61 V 3.6570 7.7092 112.0513 63.9057 32.1328 178.5877 62 T 3.8391 7.7843 114.6071 66.6800 68.2611 176.2722 63 A 3.8926 8.6156 122.6024 55.6713 18.3873 179.4281 64 Q 3.8497 8.4014 118.1421 59.9908 29.2760 178.7604 65 A 4.0139 8.8305 122.1255 54.6684 18.0676 179.1063 66 L 4.1546 8.2423 117.9108 57.8198 42.3541 180.2453 67 G 3.8108 8.9347 105.7440 47.9815 0.0000 176.0693 68 K 4.1860 8.1829 120.3954 58.2948 32.3817 178.9898 69 S 4.3462 8.3464 114.1980 58.7163 62.6511 175.1470 70 G 3.9502 7.8840 109.4778 46.3040 0.0000 174.7243 71 K 3.8063 7.7871 119.2711 58.0960 32.2176 176.8719 72 Y 4.7834 7.4044 114.2385 56.5715 40.4032 174.8997 73 H 4.8333 9.0901 118.2694 57.4413 30.0639 175.7528 74 A 4.9546 7.8589 118.0308 50.7397 22.6957 175.1042 75 I 4.9303 8.8780 115.6380 58.9254 40.7869 174.6513 76 V 4.6329 8.8875 125.5877 60.1152 33.8773 174.0969 77 C 5.0920 9.0925 123.0206 57.8932 30.5211 172.7980 78 L 5.5195 8.0520 123.5319 52.1064 44.9195 175.8043 79 G 4.2614 8.0614 107.3116 46.2984 0.0000 171.9421 80 A 5.1948 8.5687 121.4848 50.5109 22.1467 176.2639 81 V 4.2750 9.1652 123.2257 59.9024 33.5575 175.1835 82 V 4.2700 8.4548 119.5713 60.6447 32.5783 177.6931 83 K 3.5588 8.4969 127.3539 56.7256 29.1211 176.9835 84 G 3.7840 8.5530 113.2374 47.3059 0.0000 171.5742 85 D 4.6212 7.8015 117.0570 54.6135 43.4529 177.6649 86 T 4.2666 8.4680 114.7770 61.3220 70.7407 176.0823 87 S 4.9152 8.5567 117.0407 60.1757 62.5807 175.2943 88 H 3.8780 7.9162 122.4502 60.1124 29.4345 175.3214 89 Y 4.1679 8.1625 120.4483 61.4029 38.5469 177.7012 90 D 4.2031 8.4889 118.1986 58.0672 41.0426 178.6673 91 A 3.8504 8.3172 120.1332 55.9535 18.2925 179.4531 92 V 3.6160 8.4123 115.5955 66.0100 31.6243 178.3465 93 V 3.4707 8.0652 117.9385 66.4069 31.1951 177.8593 94 N 4.2414 8.8024 116.2179 56.3490 38.3623 177.2401 95 S 3.9442 8.1654 116.1712 62.0846 62.9897 176.3764 96 A 3.9730 8.6325 123.8104 55.4106 18.0038 179.1033 97 S 4.2760 8.7397 110.4192 61.8289 62.4595 176.5266 98 S 4.1150 8.9045 116.0596 61.6430 62.0927 176.2056 99 G 3.6539 8.6008 108.6692 48.1953 0.0000 175.3526 100 V 3.6524 7.9892 121.0675 65.8374 31.4317 177.4265 101 L 3.9311 8.1857 119.9578 57.6038 41.7937 178.7483 102 S 4.0755 8.7281 114.8778 62.0356 63.0047 176.5113 103 A 4.1335 8.6436 123.2258 55.4323 17.9807 179.5172 104 G 4.3072 8.2336 102.9994 47.8065 0.0000 175.5022 105 L 4.0261 7.8499 120.1679 57.5957 41.8040 179.0858 106 N 4.5110 8.6576 115.6455 56.4016 38.6202 177.3941 107 S 4.3857 8.8022 114.5748 58.9733 63.3666 175.3796 108 G 3.9729 8.0692 109.4595 45.6836 0.0000 172.8503 109 V 4.5526 7.7687 120.1017 59.8715 34.2436 173.2392 110 P 4.5488 0.0000 0.0000 63.2067 32.3175 174.7810 111 C 5.2049 8.5897 122.2178 57.8928 30.7333 173.7785 112 V 3.7558 8.9038 125.8420 62.4539 32.2959 175.4301 113 F 4.4771 8.9878 131.7032 56.4938 37.7878 175.5096 114 G 4.1745 8.7381 118.5648 44.1437 0.0000 170.7710 115 V 4.8108 6.3957 116.9556 59.5857 34.4344 177.2571 116 L 4.4182 8.9009 125.7394 54.1462 42.8917 177.1696 117 T 5.3497 7.9102 112.1962 60.2797 68.0820 173.0311 118 C 4.2720 8.1284 119.2965 60.3396 30.2733 174.6211 119 D 4.5268 9.0031 120.2249 55.9115 39.5028 176.6852 120 N 4.7281 9.5356 116.2885 51.9190 39.4966 175.8767 121 M 3.9804 8.8231 119.6281 59.2076 32.1845 177.8208 122 D 4.3609 8.2225 117.2888 57.7676 41.0162 178.1601 123 Q 4.0072 8.7776 116.8999 58.9775 29.0399 178.5968 124 A 4.1595 7.7231 120.5072 55.5310 18.3616 179.4591 125 I 3.7793 8.0406 118.1989 65.1671 37.2204 178.2755 126 N 4.4286 8.0721 116.4308 56.1606 38.4177 177.4716 127 R 4.0742 8.6959 119.0350 57.4675 30.8557 176.7983 128 A 4.4785 7.5803 123.6198 51.5233 18.3875 177.4858 129 G 3.9143 8.9463 105.7973 45.9539 0.0000 173.9750 130 G 4.2540 7.7775 111.0820 43.9859 0.0000 175.4051 131 K 4.1763 8.2763 120.1357 58.1999 32.5467 177.2390 132 A 4.4761 8.0005 121.5139 51.8156 20.1266 178.4159 133 G 3.7388 8.8607 104.8833 45.1896 0.0000 172.9084 134 N 5.8147 8.0973 119.4012 50.0974 41.5044 175.5654 135 K 4.1592 8.1855 131.2626 58.9841 32.3286 177.9839 136 G 3.7382 8.2380 104.9353 48.1234 0.0000 174.8401 137 A 3.7732 8.3548 123.2955 54.5839 18.0287 179.2765 138 E 3.7345 7.9891 116.7582 59.8207 29.3128 179.8481 139 S 3.9916 8.5233 114.8662 61.5191 62.8513 176.4496 140 A 3.4253 7.5833 123.1078 54.9119 17.9427 179.0420 141 L 3.3483 7.4958 118.5582 58.6858 42.0223 179.4662 142 T 3.6826 7.9449 115.3550 66.3964 68.3032 176.1034 143 A 3.8875 8.1076 122.9652 55.9182 18.2451 179.0752 144 I 3.6001 7.5370 117.5720 64.7363 37.1158 177.7214 145 E 3.8240 8.4158 119.3083 59.9553 29.4508 179.4746 146 M 3.8266 8.4423 118.2722 58.4710 31.8042 178.0688 147 A 3.8549 7.9225 119.6206 55.3764 18.7648 178.8958 148 S 4.2391 7.9852 110.6527 61.6096 62.3854 176.3154 149 L 4.0136 8.2717 123.0014 58.6344 41.7730 179.0420 150 F 4.4641 8.8455 117.5478 59.2340 39.8669 174.8009 151 E 5.1557 7.9052 118.3381 52.8608 28.6371 173.8011 152 H 4.8596 7.8257 129.0920 56.8129 32.4131 174.6294 153 H 4.4809 9.0268 113.7430 57.1729 28.9907 175.1081 154 L 3.4292 6.8208 121.3356 54.1033 42.6136 174.1283 155 K 4.1221 7.5205 120.9756 56.8120 32.7226 176.0090 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 M 8.29 4.38 0.00 1.98 2.09 0.00 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.60 0.00 2 N 8.06 4.48 0.00 2.91 2.79 0.00 0.00 6.33 6.77 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 3 E 9.34 3.97 0.00 1.97 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 2.31 2.33 0.00 4 L 8.15 4.42 0.00 1.68 1.83 0.96 0.94 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 5 E 8.03 4.53 0.00 1.79 1.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.17 0.00 6 G 8.13 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 0.00 0.00 0.00 7 Y 8.84 4.74 0.00 2.97 2.88 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 8 V 8.57 4.07 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 0.96 0.00 0.00 0.88 0.00 0.00 9 T 8.16 4.22 4.31 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 1.25 0.00 0.00 10 K 7.95 4.41 0.00 1.95 1.89 0.00 1.72 0.00 0.00 1.74 0.00 0.00 3.36 0.00 0.00 3.61 0.00 0.00 0.00 0.00 1.62 1.86 7.81 11 A 8.21 4.29 1.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 Q 7.78 3.43 0.00 2.32 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.84 6.85 0.00 0.00 0.00 0.00 0.00 2.42 2.38 0.00 13 S 8.00 4.09 0.00 3.62 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 F 8.54 4.25 0.00 2.64 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 0.00 0.00 0.00 0.00 15 R 8.36 4.57 0.00 1.83 1.64 0.00 3.11 0.00 0.00 3.18 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.76 0.00 16 F 8.71 5.67 0.00 2.48 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 17 A 8.55 4.70 0.11 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 0.00 0.00 18 I 8.85 4.83 1.74 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.90 0.74 0.00 0.00 19 V 8.65 4.59 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.86 0.00 0.00 20 V 8.79 5.38 1.74 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 0.31 0.00 0.00 -0.58 0.00 0.00 21 A 8.44 5.69 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 22 R 9.06 4.25 0.00 1.98 2.03 0.00 3.13 0.00 0.00 3.10 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.37 0.00 23 F 8.18 4.07 0.00 3.33 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 24 N 8.43 4.32 0.00 3.26 3.06 0.00 0.00 6.72 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 25 E 8.02 4.52 0.00 2.30 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 0.00 2.36 2.28 0.00 26 F 8.35 3.99 0.00 3.10 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 27 V 8.44 4.13 2.28 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 0.97 0.00 0.00 1.15 0.00 0.00 28 T 8.01 3.86 4.35 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 1.35 0.00 0.00 29 R 8.52 4.05 0.00 2.17 1.99 0.00 3.37 0.00 0.00 3.26 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.92 0.00 30 R 7.98 3.81 0.00 2.07 1.93 0.00 3.25 0.00 0.00 3.19 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.50 0.00 31 L 8.30 3.83 0.00 1.87 1.72 0.89 0.87 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 32 M 8.58 3.86 0.00 2.11 1.81 0.00 0.00 0.00 0.00 0.00 2.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.60 0.00 33 E 8.73 4.08 0.00 2.16 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 2.36 2.61 0.00 34 G 8.42 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 0.00 0.00 0.00 35 A 7.81 3.66 1.26 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 0.00 0.00 36 L 8.29 4.07 0.00 2.00 1.71 1.02 1.13 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 37 D 8.60 4.41 0.00 2.79 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 38 T 8.00 3.89 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 0.83 0.00 0.00 39 F 7.59 4.30 0.00 3.35 3.08 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 0.00 40 K 8.17 4.17 0.00 2.01 1.94 0.00 1.79 0.00 0.00 1.79 0.00 0.00 2.99 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.58 1.68 7.81 41 K 8.52 3.83 0.00 1.92 2.30 0.00 1.95 0.00 0.00 1.79 0.00 0.00 3.03 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.46 1.50 7.81 42 Y 8.58 4.33 0.00 3.33 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 43 S 8.26 3.87 0.00 4.12 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 44 V 7.89 3.97 2.41 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 0.90 0.00 0.00 1.32 0.00 0.00 45 N 8.30 4.72 0.00 2.75 2.75 0.00 0.00 6.94 7.53 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 46 E 9.06 4.51 0.00 2.04 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 0.00 2.13 2.23 0.00 47 D 8.87 4.29 0.00 2.77 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 48 I 6.51 3.56 1.71 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.57 0.52 0.00 0.00 49 D 8.76 4.64 0.00 2.61 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 50 V 8.37 4.63 1.77 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 0.60 0.00 0.00 0.91 0.00 0.00 51 V 8.88 4.28 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 1.07 0.00 0.00 0.86 0.00 0.00 52 W 8.86 5.21 0.00 3.24 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 53 V 9.14 4.72 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 0.84 0.00 0.00 1.08 0.00 0.00 54 P 0.00 4.36 0.00 2.21 2.37 0.00 3.72 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.05 0.00 55 G 8.22 4.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 A 8.66 3.95 1.26 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 0.00 0.00 57 Y 8.34 3.90 0.00 3.01 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 E 8.63 4.11 0.00 2.40 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 0.00 2.42 2.50 0.00 59 L 7.74 3.99 0.00 1.73 1.69 0.78 0.91 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 60 G 7.84 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 61 V 7.71 3.66 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 0.82 0.00 0.00 1.04 0.00 0.00 62 T 7.78 3.84 4.37 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 1.21 0.00 0.00 63 A 8.62 3.89 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 64 Q 8.40 3.85 0.00 2.22 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.71 0.00 0.00 0.00 0.00 0.00 2.38 2.50 0.00 65 A 8.83 4.01 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 66 L 8.24 4.15 0.00 1.75 1.70 0.71 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 67 G 8.93 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 68 K 8.18 4.19 0.00 1.95 1.92 0.00 1.73 0.00 0.00 1.77 0.00 0.00 3.09 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.50 1.48 7.81 69 S 8.35 4.35 0.00 4.08 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 70 G 7.88 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 0.00 0.00 0.00 71 K 7.79 3.81 0.00 0.79 1.21 0.00 1.59 0.00 0.00 1.57 0.00 0.00 2.80 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.24 1.37 7.81 72 Y 7.40 4.78 0.00 2.93 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 73 H 9.09 4.83 0.00 2.85 3.47 0.00 5.89 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 A 7.86 4.95 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 I 8.88 4.93 1.78 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.28 0.77 0.00 0.00 76 V 8.89 4.63 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 0.96 0.00 0.00 0.83 0.00 0.00 77 C 9.09 5.09 0.00 2.68 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 78 L 8.05 5.52 0.00 1.39 1.40 0.79 0.69 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 79 G 8.06 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 0.00 0.00 0.00 0.00 80 A 8.57 5.19 1.26 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 0.00 0.00 81 V 9.17 4.28 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 0.87 0.00 0.00 0.89 0.00 0.00 82 V 8.45 4.27 2.32 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 0.76 0.00 0.00 1.06 0.00 0.00 83 K 8.50 3.56 0.00 0.79 1.33 0.00 0.92 0.00 0.00 1.54 0.00 0.00 2.80 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.09 0.67 7.81 84 G 8.55 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 85 D 7.80 4.62 0.00 2.63 2.41 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 86 T 8.47 4.27 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 1.24 0.00 0.00 87 S 8.56 4.92 0.00 4.27 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 88 H 7.92 3.88 0.00 3.29 3.44 0.00 5.62 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 Y 8.16 4.17 0.00 3.11 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 90 D 8.49 4.20 0.00 2.91 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 91 A 8.32 3.85 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 92 V 8.41 3.62 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 0.94 0.00 0.00 1.01 0.00 0.00 93 V 8.07 3.47 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 0.91 0.00 0.00 0.11 0.00 0.00 94 N 8.80 4.24 0.00 2.84 2.79 0.00 0.00 7.05 7.61 0.00 0.00 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 S 8.17 3.94 0.00 3.70 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 A 8.63 3.97 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 97 S 8.74 4.28 0.00 3.75 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 98 S 8.90 4.11 0.00 3.82 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 99 G 8.60 3.65 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 0.00 0.00 0.00 100 V 7.99 3.65 2.46 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 1.10 0.00 0.00 1.03 0.00 0.00 101 L 8.19 3.93 0.00 1.84 1.72 0.89 0.77 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 0.00 102 S 8.73 4.08 0.00 3.99 3.93 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 0.00 103 A 8.64 4.13 1.38 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 0.00 0.00 0.00 104 G 8.23 4.31 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 0.00 105 L 7.85 4.03 0.00 1.81 1.76 0.95 1.04 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 0.00 106 N 8.66 4.51 0.00 2.70 2.90 0.00 0.00 7.19 8.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 S 8.80 4.39 0.00 4.03 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 0.00 108 G 8.07 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 0.00 0.00 0.00 109 V 7.77 4.55 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 1.07 0.00 0.00 1.12 0.00 0.00 110 P 0.00 4.55 0.00 1.95 1.73 0.00 3.71 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.38 0.00 111 C 8.59 5.20 0.00 2.95 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 0.00 112 V 8.90 3.76 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 0.86 0.00 0.00 0.87 0.00 0.00 113 F 8.99 4.48 0.00 3.06 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 0.00 114 G 8.74 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 V 6.40 4.81 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 -0.76 0.00 0.00 0.72 0.00 0.00 116 L 8.90 4.42 0.00 1.63 1.66 0.95 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 117 T 7.91 5.35 4.32 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 1.27 0.00 0.00 118 C 8.13 4.27 0.00 2.97 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 0.00 119 D 9.00 4.53 0.00 2.68 2.51 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 0.00 120 N 9.54 4.73 0.00 2.88 2.91 0.00 0.00 6.77 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 0.00 121 M 8.82 3.98 0.00 2.12 2.12 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 2.65 2.61 0.00 122 D 8.22 4.36 0.00 2.74 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 Q 8.78 4.01 0.00 2.15 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.70 0.00 0.00 0.00 0.00 0.00 2.41 2.64 0.00 124 A 7.72 4.16 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 0.00 125 I 8.04 3.78 2.05 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.56 1.02 0.00 0.00 126 N 8.07 4.43 0.00 2.99 2.87 0.00 0.00 7.02 7.78 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 0.00 127 R 8.70 4.07 0.00 1.90 1.97 0.00 3.28 0.00 0.00 3.18 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.81 0.00 128 A 7.58 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 0.00 129 G 8.95 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 0.00 0.00 0.00 130 G 7.78 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 0.00 0.00 0.00 0.00 131 K 8.28 4.18 0.00 1.83 1.95 0.00 1.59 0.00 0.00 1.71 0.00 0.00 3.04 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.65 1.39 7.81 132 A 8.00 4.48 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 0.00 133 G 8.86 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 0.00 134 N 8.10 5.81 0.00 2.75 2.60 0.00 0.00 6.78 6.35 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 0.00 135 K 8.19 4.16 0.00 1.83 1.75 0.00 1.84 0.00 0.00 1.73 0.00 0.00 3.20 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.46 1.36 7.81 136 G 8.24 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 0.00 137 A 8.35 3.77 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 0.00 138 E 7.99 3.73 0.00 2.11 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 2.26 2.43 0.00 139 S 8.52 3.99 0.00 3.85 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 0.00 140 A 7.58 3.43 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 L 7.50 3.35 0.00 1.43 1.64 0.71 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 142 T 7.94 3.68 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 143 A 8.11 3.89 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 0.00 0.00 144 I 7.54 3.60 1.92 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.51 0.92 0.00 0.00 145 E 8.42 3.82 0.00 1.93 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 2.24 2.31 0.00 146 M 8.44 3.83 0.00 1.65 2.12 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 2.48 2.69 0.00 147 A 7.92 3.85 1.14 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 0.00 0.00 148 S 7.99 4.24 0.00 3.82 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 0.00 149 L 8.27 4.01 0.00 1.86 2.02 0.99 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 150 F 8.85 4.46 0.00 3.43 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 0.00 151 E 7.91 5.16 0.00 2.25 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 2.40 2.37 0.00 152 H 7.83 4.86 0.00 3.37 3.68 0.00 5.71 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 153 H 9.03 4.48 0.00 3.33 3.73 0.00 5.96 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 L 6.82 3.43 0.00 1.76 1.61 0.85 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 155 K 7.52 4.12 0.00 1.83 1.69 0.00 1.53 0.00 0.00 1.73 0.00 0.00 3.13 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.28 1.52 7.81