NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 45 E 4.3119 8.4293 116.7301 55.7805 32.2861 175.8621 46 N 4.6173 7.7677 115.4725 52.1598 38.3615 173.8999 47 L 4.2407 8.5611 117.4420 56.9332 42.6918 180.1862 48 Y 3.8869 8.1229 119.5088 60.5221 38.8655 177.0741 49 F 4.0416 9.2020 122.0196 61.5168 39.4312 177.1071 50 Q 4.0381 8.0541 117.5082 59.1466 28.5053 178.6590 51 S 4.0382 7.7885 113.7616 61.5929 62.3369 175.9473 52 M 3.8641 8.1873 123.6875 59.0194 31.8722 178.9063 53 R 3.7578 7.8819 121.1721 61.4673 29.4745 180.4906 54 N 4.4609 8.4026 117.7290 55.9811 38.5644 177.1019 55 F 3.9901 8.3446 122.2566 61.4947 39.4615 177.2210 56 S 3.7616 8.4017 114.7846 61.7676 62.8069 176.7834 57 E 3.8813 8.1699 121.1063 59.0952 28.8435 179.0205 58 D 4.1746 7.5658 117.5760 57.2759 41.5940 178.0262 59 V 2.0000 6.8104 118.5123 65.2892 30.9712 178.0822 60 L 4.0236 7.6097 118.7203 57.4574 41.4214 179.5180 61 G 3.7315 7.8106 105.3507 47.6709 0.0000 175.6675 62 W 4.5023 7.5819 120.6870 59.4459 29.1270 178.0541 63 R 4.1986 7.7554 114.1577 58.0331 29.3423 178.1348 64 E 4.2528 8.1597 119.5658 58.1315 30.4193 176.8748 65 S 4.7532 7.2395 110.4674 55.7697 65.7334 175.2064 66 F 3.4227 8.6936 124.1604 61.2219 38.9598 177.1835 67 D 4.0877 7.9144 118.2223 57.2771 40.4049 178.6273 68 L 4.0073 7.5087 118.0077 57.4011 41.9317 178.9610 69 L 3.7102 7.5575 119.8534 58.1859 41.8358 179.2346 70 L 3.5520 7.0892 117.1293 57.1674 41.4181 179.0302 71 S 4.3826 7.7815 113.4705 58.6213 63.3185 173.7715 72 S 4.6802 7.3575 118.0448 56.3672 63.6747 174.2853 73 K 3.9027 8.8890 128.7369 59.9704 31.9355 178.5660 74 N 4.5773 8.3267 116.3146 56.0514 38.5680 177.4870 75 G 2.0870 8.2198 107.2318 47.3808 0.0000 175.9470 76 V 3.4377 7.8281 121.5439 65.2832 31.5869 177.9140 77 A 3.9634 7.9561 120.3867 55.0338 18.2191 179.5541 78 A 4.0717 8.0692 119.5162 55.3299 18.4815 179.6774 79 F 3.6814 8.3625 119.5513 61.3134 39.3426 176.8280 80 H 3.8706 8.5654 118.0497 59.1630 29.4913 176.9493 81 A 4.0096 7.7024 120.9247 55.1940 18.5689 179.0438 82 F 4.3391 8.4322 118.9464 61.6375 39.4774 177.4058 83 L 3.5418 8.0542 118.8273 57.3612 41.2293 179.5564 84 K 4.0923 8.0313 120.1937 59.0298 31.7382 179.3049 85 T 3.4614 7.1518 108.6075 64.0227 68.5467 175.3148 86 E 4.1603 7.0904 117.9450 54.6037 30.0167 175.5016 87 F 3.8345 7.1368 116.7423 58.9025 37.4251 175.9209 88 S 4.9648 8.1069 111.0327 57.3642 63.7350 175.3927 89 E 3.9511 8.0512 121.1331 58.9554 29.1793 178.3555 90 E 4.1754 8.2216 118.7626 59.4856 29.5174 178.7379 91 N 4.3973 8.1146 117.5757 56.0684 38.5235 177.1021 92 L 4.0366 7.7959 121.2179 58.1355 42.4123 178.2507 93 E 3.9708 8.3842 118.7289 59.5586 29.4029 179.2092 94 F 2.9493 7.9963 120.2616 60.6720 39.3953 176.6983 95 W 3.7358 8.0511 127.8291 60.5800 30.4070 177.9351 96 L 3.8930 8.3075 118.6189 57.6090 41.0849 179.1572 97 A 3.9055 7.7690 120.7306 55.4388 18.2493 179.5037 98 C 3.8141 7.4814 115.0652 62.7319 27.8299 176.1352 99 E 3.6246 7.1568 119.1784 59.3415 29.3900 179.0504 100 E 4.0316 7.9817 118.5518 59.1915 29.5617 178.9197 101 F 4.0163 8.2328 121.4308 61.1303 39.4438 176.8441 102 K 4.0394 7.9724 116.6028 58.1128 32.4507 177.5879 103 K 4.1233 7.5249 118.3276 57.4203 32.5312 177.0318 104 I 3.8892 7.2770 121.0692 61.0329 37.4301 175.9164 105 R 4.2889 8.3005 123.4415 57.2281 31.7568 177.6077 106 S 4.2217 7.7562 112.1059 57.7341 64.1866 174.4997 107 A 3.9810 8.5236 130.8238 55.5695 18.3606 180.1637 108 T 3.9037 7.8228 107.8878 64.9013 68.9808 176.8708 109 K 4.0914 8.1375 121.2965 58.8353 32.0302 179.3890 110 L 3.9592 8.1246 119.3653 57.8298 41.5868 179.3840 111 A 4.1518 8.0513 120.8963 55.0139 18.4218 179.9293 112 S 4.1459 8.3116 112.8204 61.7491 63.2825 176.6474 113 R 4.0197 8.3107 122.7996 58.8293 29.7848 178.1372 114 A 4.1807 8.9676 120.9644 55.7049 18.3685 179.2001 115 H 4.2117 8.4554 114.5878 59.2365 28.8681 178.0181 116 Q 4.0714 8.1606 119.2419 59.1461 28.5331 178.9942 117 I 3.8799 8.0483 120.8204 64.2220 37.0316 178.1655 118 F 4.2549 8.6799 121.5812 61.7122 39.1171 177.1985 119 E 3.9499 8.4081 116.5478 59.0416 29.3901 178.5794 120 E 3.8452 8.1126 119.3960 57.9353 29.7026 177.7902 121 F 4.8641 8.1990 114.9119 55.9672 41.5730 176.6957 122 I 3.8920 7.4005 119.4696 62.3222 39.0234 176.1230 123 C 3.8946 7.1648 114.4266 57.0855 30.1129 172.8726 124 S 4.2522 8.3848 115.3986 60.2625 62.1783 173.7537 125 E 3.7213 8.8248 124.1359 56.9871 27.4721 174.6325 126 A 4.0256 7.8174 121.6413 51.5868 18.7744 177.2566 127 P 4.3341 0.0000 0.0000 65.1453 31.7908 176.5536 128 K 4.7074 7.9443 118.8987 55.4403 32.3842 176.3675 129 E 4.1054 8.2157 120.7531 56.5673 30.3823 176.9594 130 V 4.0967 8.2065 120.3269 60.3302 33.4389 176.4510 131 N 4.5903 8.6584 122.5527 52.3374 37.4172 174.0186 132 I 4.6779 7.5298 116.1185 57.6668 41.1719 176.0123 133 D 4.6869 8.2730 121.4779 52.9953 41.6851 176.7624 134 H 4.1147 8.6834 118.8209 59.2590 29.6920 176.7080 135 E 3.9409 8.1757 120.6590 59.7836 29.5903 178.8973 136 T 3.9037 8.3956 115.7486 66.4507 68.3980 176.8478 137 R 3.9607 7.9744 120.8961 59.3256 30.2115 178.1818 138 E 3.9173 8.5102 119.6594 59.0071 29.6090 178.4528 139 L 3.9179 8.1699 120.6163 58.4254 42.0524 179.0041 140 T 3.7458 8.0194 115.5661 66.7814 68.2527 176.2751 141 R 3.2676 7.9753 119.0251 59.8457 30.2510 178.0657 142 M 4.1410 7.9571 118.0374 58.2093 31.4688 178.3860 143 N 4.3017 8.2158 116.6230 56.0885 38.4066 177.0791 144 L 3.9374 7.1623 118.9511 56.8008 41.5976 178.8799 145 Q 4.2423 7.5517 118.2003 57.9917 29.9460 177.0381 146 T 4.4597 7.2854 112.3586 59.4060 67.4651 171.1423 147 A 4.1597 8.4157 125.4414 51.5789 19.3130 177.2676 148 T 4.6458 8.1958 112.2716 59.2810 71.7269 174.5888 149 A 4.0342 8.4902 123.2953 54.5012 18.5440 178.1863 150 T 4.6289 7.7353 105.4447 61.3262 69.3312 175.9530 151 C 3.6584 7.9931 123.9905 62.6675 31.5839 175.1096 152 F 4.8857 7.8433 115.0640 57.2353 38.8871 176.8995 153 D 4.3886 8.0093 121.4619 57.5812 40.7824 178.7492 154 A 4.0101 8.0354 120.1901 55.1776 18.5391 179.3692 155 A 4.0765 8.1279 118.8406 55.4083 18.5145 179.3490 156 Q 4.2156 9.0339 118.6402 59.4760 29.0625 178.8829 157 G 3.7177 8.4967 106.8088 47.7452 0.0000 175.8969 158 K 4.1030 8.1461 120.4584 59.6477 32.1080 179.6826 159 T 3.9899 8.2912 116.0948 66.4874 68.4021 176.6423 160 R 3.9983 8.5671 121.0166 59.9817 30.0846 178.6712 161 T 3.8957 7.8903 114.9194 66.5086 67.9802 176.2621 162 L 3.9945 8.1292 121.0859 58.4540 41.7513 179.7768 163 M 3.9859 8.0709 118.0678 58.3992 31.8132 178.4876 164 E 3.0427 8.3157 118.5074 58.8725 29.7699 178.7069 165 K 4.1288 8.0577 117.9441 58.9371 32.2837 176.8341 166 D 4.7456 7.6868 115.4429 56.1644 42.7401 178.2786 167 S 4.3572 7.8238 115.0537 61.3752 63.3663 176.1935 168 Y 4.1957 8.1729 122.4854 60.3781 38.3223 176.0512 169 P 3.8753 0.0000 0.0000 65.6489 31.5444 178.5024 170 R 4.0854 7.6991 116.4369 58.7884 30.0016 178.6224 171 F 2.8294 8.4319 121.0352 61.0997 39.1247 177.3419 172 L 3.3761 7.3027 116.3016 56.6742 41.3684 178.6107 173 K 4.2946 7.1705 116.4769 55.3501 32.9607 177.1214 174 S 4.3052 7.3077 115.8034 57.4209 63.7719 173.4378 175 P 4.1763 0.0000 0.0000 65.8836 30.9449 178.8010 176 A 3.9784 7.9443 118.8066 55.3653 18.4276 178.8791 177 Y 3.8165 7.8160 117.9845 60.8602 38.8469 178.2962 178 R 3.7714 8.1521 119.2077 59.2084 30.1085 178.6249 179 D 4.1910 8.1686 117.8762 57.3771 41.2479 178.2610 180 L 4.0070 7.9489 119.4140 57.7619 41.5492 179.4344 181 A 3.5451 7.7692 120.8667 54.7490 18.0988 179.5253 182 A 3.8744 7.7366 119.2757 55.3457 18.2163 179.9369 183 Q 3.8994 7.8487 115.2352 59.0161 28.9062 178.4277 184 A 4.1908 7.9172 120.6359 55.4254 18.4499 179.5863 185 S 4.1363 8.1971 112.6003 61.4600 62.9750 175.0100 186 A 4.2811 8.0510 127.0494 52.3696 18.2869 176.9731 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 45 E 8.43 4.31 0.00 2.01 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 2.13 1.88 0.00 46 N 7.77 4.62 0.00 3.10 3.04 0.00 0.00 6.28 5.79 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 47 L 8.56 4.24 0.00 1.78 1.79 0.95 0.71 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 48 Y 8.12 3.89 0.00 3.16 3.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 F 9.20 4.04 0.00 3.27 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 50 Q 8.05 4.04 0.00 2.11 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.57 0.00 0.00 0.00 0.00 0.00 2.66 2.64 0.00 51 S 7.79 4.04 0.00 3.84 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 52 M 8.19 3.86 0.00 1.78 1.35 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.44 0.00 53 R 7.88 3.76 0.00 1.84 1.93 0.00 3.32 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.55 0.00 54 N 8.40 4.46 0.00 2.86 2.90 0.00 0.00 6.67 7.79 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 55 F 8.34 3.99 0.00 3.08 3.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 S 8.40 3.76 0.00 3.89 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 57 E 8.17 3.88 0.00 2.19 1.93 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 2.33 2.19 0.00 58 D 7.57 4.17 0.00 2.74 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 59 V 6.81 2.00 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 0.00 0.00 0.29 0.00 0.00 -0.33 0.00 0.00 60 L 7.61 4.02 0.00 1.66 1.61 0.82 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 61 G 7.81 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 W 7.58 4.50 0.00 3.42 3.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 R 7.76 4.20 0.00 2.22 2.12 0.00 3.17 0.00 0.00 3.22 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.53 0.00 64 E 8.16 4.25 0.00 2.40 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 0.00 2.33 2.18 0.00 65 S 7.24 4.75 0.00 3.99 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 66 F 8.69 3.42 0.00 2.30 2.80 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 67 D 7.91 4.09 0.00 2.67 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 68 L 7.51 4.01 0.00 1.97 1.82 0.99 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 69 L 7.56 3.71 0.00 1.60 1.33 -0.04 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 70 L 7.09 3.55 0.00 1.03 0.88 -0.79 -0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 71 S 7.78 4.38 0.00 3.85 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 72 S 7.36 4.68 0.00 4.12 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 73 K 8.89 3.90 0.00 1.99 1.84 0.00 1.89 0.00 0.00 1.82 0.00 0.00 2.87 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.51 1.11 7.81 74 N 8.33 4.58 0.00 3.31 3.13 0.00 0.00 6.95 7.58 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 75 G 8.22 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 0.00 0.00 0.00 0.00 0.00 0.00 76 V 7.83 3.44 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 1.08 0.00 0.00 0.85 0.00 0.00 77 A 7.96 3.96 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 78 A 8.07 4.07 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 79 F 8.36 3.68 0.00 2.33 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 80 H 8.57 3.87 0.00 3.28 3.41 0.00 5.65 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 A 7.70 4.01 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 82 F 8.43 4.34 0.00 3.46 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 83 L 8.05 3.54 0.00 1.47 1.46 0.33 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.58 0.00 0.00 0.00 0.00 0.00 0.00 84 K 8.03 4.09 0.00 1.86 1.69 0.00 1.70 0.00 0.00 1.77 0.00 0.00 2.95 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.36 1.09 7.81 85 T 7.15 3.46 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 86 E 7.09 4.16 0.00 1.64 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.56 0.00 87 F 7.14 3.83 0.00 3.16 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 88 S 8.11 4.96 0.00 3.89 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 89 E 8.05 3.95 0.00 1.84 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 0.00 2.44 2.16 0.00 90 E 8.22 4.18 0.00 2.41 2.36 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 2.43 2.41 0.00 91 N 8.11 4.40 0.00 2.91 2.98 0.00 0.00 6.51 6.43 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 92 L 7.80 4.04 0.00 1.70 1.77 0.90 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 93 E 8.38 3.97 0.00 2.39 2.25 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 2.46 2.67 0.00 94 F 8.00 2.95 0.00 2.28 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 95 W 8.05 3.74 0.00 3.49 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 96 L 8.31 3.89 0.00 1.73 1.70 0.97 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 97 A 7.77 3.91 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 0.00 0.00 98 C 7.48 3.81 0.00 2.47 2.59 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 0.00 0.00 0.00 0.00 99 E 7.16 3.62 0.00 1.74 1.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.47 0.00 100 E 7.98 4.03 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 2.46 2.43 0.00 101 F 8.23 4.02 0.00 3.19 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 0.00 102 K 7.97 4.04 0.00 1.88 2.10 0.00 1.52 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.64 1.31 7.81 103 K 7.52 4.12 0.00 1.86 1.82 0.00 1.64 0.00 0.00 1.65 0.00 0.00 2.91 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.37 1.49 7.81 104 I 7.28 3.89 1.56 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.53 0.83 0.00 0.00 105 R 8.30 4.29 0.00 1.73 1.91 0.00 3.31 0.00 0.00 3.07 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.48 0.00 106 S 7.76 4.22 0.00 3.86 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 0.00 107 A 8.52 3.98 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 0.00 108 T 7.82 3.90 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 1.22 0.00 0.00 109 K 8.14 4.09 0.00 1.80 1.90 0.00 1.69 0.00 0.00 1.66 0.00 0.00 2.94 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.46 1.61 7.81 110 L 8.12 3.96 0.00 1.93 1.77 0.89 0.04 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 0.00 111 A 8.05 4.15 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 0.00 112 S 8.31 4.15 0.00 4.14 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 0.00 113 R 8.31 4.02 0.00 2.18 2.36 0.00 3.49 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 1.93 1.95 0.00 114 A 8.97 4.18 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 0.00 115 H 8.46 4.21 0.00 3.43 3.42 0.00 5.63 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 Q 8.16 4.07 0.00 2.36 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.81 0.00 0.00 0.00 0.00 0.00 2.44 2.66 0.00 117 I 8.05 3.88 1.60 0.00 0.00 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.76 0.31 0.00 0.00 118 F 8.68 4.25 0.00 3.43 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 0.00 119 E 8.41 3.95 0.00 2.04 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 2.50 2.69 0.00 120 E 8.11 3.85 0.00 1.82 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 1.47 1.47 0.00 121 F 8.20 4.86 0.00 2.90 2.53 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 0.00 122 I 7.40 3.89 1.48 0.00 0.00 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.15 0.84 0.00 0.00 123 C 7.16 3.89 0.00 2.95 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 0.00 124 S 8.38 4.25 0.00 3.83 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 0.00 125 E 8.82 3.72 0.00 2.15 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 0.00 2.21 2.36 0.00 126 A 7.82 4.03 1.13 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 0.00 0.00 127 P 0.00 4.33 0.00 2.07 2.12 0.00 3.77 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.87 0.00 128 K 7.94 4.71 0.00 1.37 1.85 0.00 1.58 0.00 0.00 1.87 0.00 0.00 2.76 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.32 1.21 7.81 129 E 8.22 4.11 0.00 2.04 1.80 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 2.21 2.23 0.00 130 V 8.21 4.10 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 0.64 0.00 0.00 0.63 0.00 0.00 131 N 8.66 4.59 0.00 2.66 2.76 0.00 0.00 6.80 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 0.00 132 I 7.53 4.68 1.88 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 1.55 0.81 0.90 0.00 0.00 133 D 8.27 4.69 0.00 3.00 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 0.00 134 H 8.68 4.11 0.00 3.22 3.35 0.00 5.68 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 E 8.18 3.94 0.00 2.11 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 0.00 2.40 2.43 0.00 136 T 8.40 3.90 4.28 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 1.27 0.00 0.00 137 R 7.97 3.96 0.00 1.88 2.01 0.00 3.08 0.00 0.00 3.08 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.73 0.00 138 E 8.51 3.92 0.00 2.09 1.90 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 2.31 2.35 0.00 139 L 8.17 3.92 0.00 1.89 1.84 0.91 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 140 T 8.02 3.75 4.60 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 1.37 0.00 0.00 141 R 7.98 3.27 0.00 1.96 2.13 0.00 3.28 0.00 0.00 3.33 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.40 0.00 142 M 7.96 4.14 0.00 2.18 2.17 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.45 0.00 143 N 8.22 4.30 0.00 2.72 2.68 0.00 0.00 6.98 6.36 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 0.00 144 L 7.16 3.94 0.00 1.51 1.47 0.04 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 145 Q 7.55 4.24 0.00 2.06 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.03 7.16 0.00 0.00 0.00 0.00 0.00 2.35 2.41 0.00 146 T 7.29 4.46 4.22 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 1.19 0.00 0.00 147 A 8.42 4.16 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 0.00 148 T 8.20 4.65 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 1.24 0.00 0.00 149 A 8.49 4.03 1.20 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 0.00 0.00 150 T 7.74 4.63 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 1.25 0.00 0.00 151 C 7.99 3.66 0.00 3.08 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 0.00 152 F 7.84 4.89 0.00 2.99 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 0.00 153 D 8.01 4.39 0.00 2.82 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 0.00 154 A 8.04 4.01 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 0.00 155 A 8.13 4.08 1.61 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 0.00 0.00 0.00 0.00 0.00 0.00 156 Q 9.03 4.22 0.00 2.02 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.75 0.00 0.00 0.00 0.00 0.00 2.41 2.17 0.00 157 G 8.50 3.72 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 158 K 8.15 4.10 0.00 2.08 1.93 0.00 1.74 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.80 1.68 7.81 159 T 8.29 3.99 4.69 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 1.45 0.00 0.00 160 R 8.57 4.00 0.00 2.13 2.26 0.00 3.32 0.00 0.00 3.32 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.83 0.00 161 T 7.89 3.90 4.44 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 1.24 0.00 0.00 162 L 8.13 3.99 0.00 2.00 1.78 1.03 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 163 M 8.07 3.99 0.00 2.44 2.44 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.92 2.62 0.00 164 E 8.32 3.04 0.00 1.77 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 2.23 1.92 0.00 165 K 8.06 4.13 0.00 2.15 1.85 0.00 1.83 0.00 0.00 1.63 0.00 0.00 2.91 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.47 1.31 7.81 166 D 7.69 4.75 0.00 2.70 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 0.00 167 S 7.82 4.36 0.00 4.25 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 168 Y 8.17 4.20 0.00 2.26 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 0.00 169 P 0.00 3.88 0.00 1.98 1.96 0.00 3.81 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.01 0.00 170 R 7.70 4.09 0.00 2.29 2.29 0.00 3.39 0.00 0.00 3.17 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.69 0.00 171 F 8.43 2.83 0.00 2.83 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 0.00 172 L 7.30 3.38 0.00 1.53 1.41 0.30 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 173 K 7.17 4.29 0.00 1.62 1.82 0.00 1.71 0.00 0.00 1.75 0.00 0.00 3.07 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.37 1.51 7.81 174 S 7.31 4.31 0.00 4.04 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 0.00 175 P 0.00 4.18 0.00 2.20 2.17 0.00 3.66 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.19 0.00 176 A 7.94 3.98 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 0.00 177 Y 7.82 3.82 0.00 2.45 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 0.00 178 R 8.15 3.77 0.00 1.99 1.91 0.00 3.29 0.00 0.00 3.07 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.79 0.00 179 D 8.17 4.19 0.00 2.74 2.85 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 0.00 180 L 7.95 4.01 0.00 1.63 1.51 1.19 0.97 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 0.00 181 A 7.77 3.55 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 0.00 182 A 7.74 3.87 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 0.00 183 Q 7.85 3.90 0.00 2.38 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.89 0.00 0.00 0.00 0.00 0.00 2.38 2.55 0.00 184 A 7.92 4.19 1.07 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 0.00 0.00 185 S 8.20 4.14 0.00 3.92 3.89 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 0.00 186 A 8.05 4.28 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