NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 P 4.4592 0.0000 0.0000 62.6127 32.1281 178.1531 2 K 4.1532 9.0518 113.9378 54.7095 32.6481 175.8877 3 L 4.7186 8.6513 118.8571 54.6463 43.3678 178.6555 4 S 4.1582 8.9545 117.8431 59.6060 62.6127 175.6940 5 Q 3.7532 8.1865 120.3744 56.8945 28.7688 174.0063 6 D 4.4751 7.7994 116.0805 56.7789 42.0514 178.0788 7 E 4.4190 8.1123 117.7127 58.4582 29.6145 178.9778 8 I 4.0566 7.7116 120.1738 64.2574 37.4440 177.6967 9 D 4.4242 7.7039 119.4817 57.0984 40.6570 178.4242 10 D 4.3826 8.6556 119.8961 57.5319 40.8709 178.7295 11 L 3.9619 8.0107 120.5733 58.0327 41.9879 179.1762 12 K 3.8417 8.2434 118.6463 59.3591 32.0527 179.0875 13 D 4.3432 8.5019 119.6134 57.3075 40.7912 179.0002 14 V 3.7224 7.9670 118.7367 65.9123 31.5359 177.6183 15 F 3.8669 8.6063 120.8033 61.5511 39.2372 176.8475 16 E 4.0485 8.5577 118.0686 59.3299 29.2345 179.2816 17 L 3.9334 7.8263 119.8098 58.3575 41.9827 179.1591 18 F 4.0887 8.5040 117.7247 60.2456 38.5378 177.2403 19 D 4.2669 8.0746 117.6481 57.1781 41.4017 177.6495 20 F 3.9969 8.1715 121.0704 61.1777 39.1820 177.0171 21 W 4.5179 8.1024 116.4436 58.1349 28.8307 176.3725 22 D 4.8215 7.9854 118.3961 52.6318 39.1881 176.2426 23 G 3.5003 7.7565 108.9503 46.6607 0.0000 174.2681 24 R 4.1221 7.8282 126.4600 56.7330 29.5562 176.2180 25 D 4.5635 9.7601 122.2735 53.6266 42.2288 176.1007 26 G 4.0751 10.0917 108.5869 45.8456 0.0000 172.7043 27 A 5.3309 8.7736 119.8493 50.0663 22.5946 176.5100 28 V 4.4950 9.1008 121.5739 60.5966 34.4212 174.5350 29 D 5.0135 9.7439 127.8704 54.5556 41.9802 177.2600 30 A 4.1338 9.4200 128.7994 54.7434 18.6059 179.0440 31 F 4.5608 9.5520 117.7922 59.9069 39.6871 176.2861 32 K 4.3476 8.3242 119.0420 56.2421 32.5353 177.3578 33 L 4.2777 7.8092 122.4294 58.3307 41.8585 178.9862 34 G 3.4778 7.8553 104.9706 47.9463 0.0000 175.3061 35 D 4.2769 7.7557 119.8710 56.6946 41.1397 178.5861 36 V 3.0888 7.5066 118.9574 66.1058 31.5536 177.8393 37 C 3.9900 7.8884 116.2876 62.9810 28.0717 176.4193 38 R 4.7590 8.1791 121.1064 58.9685 29.3790 178.7681 39 C 4.3841 7.8188 115.4326 61.8377 28.1623 174.8769 40 L 4.4800 7.5618 119.1758 54.5299 41.4578 177.4120 41 G 4.0554 8.1266 107.9195 44.9335 0.0000 173.7125 42 I 4.5304 7.5899 112.6960 59.3481 40.2450 174.5530 43 N 5.3118 8.2067 118.2124 50.9723 38.1999 172.6509 44 P 4.4185 0.0000 0.0000 62.2911 32.9971 178.2183 45 R 4.2072 9.0212 120.2365 55.4524 32.1294 177.5500 46 N 3.7457 8.8586 118.2479 56.8000 38.4770 177.2605 47 E 4.0154 8.3405 120.1489 59.2132 29.8584 178.5191 48 D 4.2990 7.8255 118.5298 57.3726 40.9587 178.7817 49 V 3.5843 7.5159 118.5978 65.9594 31.4719 178.0737 50 F 4.8482 8.1434 118.9017 60.1516 38.5895 177.4620 51 A 4.1659 8.0504 118.9801 54.2371 18.1440 178.9538 52 V 4.2422 6.8734 107.7316 60.8203 32.2174 176.0368 53 G 3.9492 8.1531 107.2854 45.4052 0.0000 175.3716 54 G 3.6956 8.4685 110.6908 45.9692 0.0000 173.5886 55 T 4.6459 8.0449 113.2746 60.5159 70.7569 174.2904 56 H 4.8106 8.6322 117.1578 56.5810 29.2638 175.2876 57 K 3.3083 7.4151 116.3029 55.3740 34.7104 175.1008 58 M 4.3054 7.3290 119.4511 56.6334 32.3478 176.2342 59 G 3.8893 9.7829 108.4498 47.1756 0.0000 174.4451 60 E 4.5237 8.4914 118.1365 56.8633 31.9293 176.4313 61 K 4.7692 7.6701 117.7904 54.8622 36.0734 174.4379 62 S 5.2807 8.7612 119.3895 56.5109 65.4220 172.8575 63 L 5.1578 9.2910 126.2275 52.4278 45.2766 174.7650 64 P 5.4148 0.0000 0.0000 60.8951 33.3215 176.6441 65 F 3.3610 8.6498 120.0897 61.3574 38.6301 176.8264 66 E 3.7822 8.2012 116.3542 59.3790 29.2532 178.8204 67 E 4.0158 8.1107 119.2438 59.2314 29.4503 179.1575 68 F 3.8815 8.3020 117.6350 60.0149 38.7406 177.2355 69 L 3.9392 7.3103 118.2471 57.2800 41.3207 177.5166 70 P 4.1830 0.0000 0.0000 65.8230 31.1213 178.1370 71 A 4.0031 7.4931 119.7970 55.1157 18.4777 178.8290 72 Y 4.2641 8.3864 118.1216 60.9808 38.6712 177.9571 73 E 3.7786 8.2689 118.4988 59.5954 29.7657 179.2384 74 G 3.8286 8.6719 106.0284 48.1039 0.0000 175.5929 75 L 4.0355 8.2963 121.2534 57.5183 41.3533 179.3513 76 M 4.1088 7.5635 117.8335 58.2170 31.9107 177.1534 77 D 4.5341 7.5903 116.8297 55.1059 41.3918 176.5046 78 C 4.1782 7.9966 116.0306 57.6835 30.0197 173.4342 79 E 4.0045 8.6904 124.1635 56.3445 29.8592 175.5307 80 Q 4.6294 8.3354 125.6208 53.6671 31.7462 175.4067 81 G 3.7457 9.0317 113.3440 45.3166 0.0000 173.0787 82 T 4.4555 7.3067 110.3610 59.2483 72.4883 175.5312 83 F 4.1996 8.6009 122.5335 61.3376 39.2871 176.7871 84 A 3.9409 8.0927 119.8731 55.3731 18.1396 179.1327 85 D 4.2251 7.7051 116.6810 57.7241 40.8090 178.6823 86 Y 4.5005 7.4568 117.0858 61.6261 37.8375 178.7209 87 M 4.2238 8.1325 119.7948 58.3302 31.7620 178.4816 88 E 3.9072 8.2549 118.8037 59.0825 30.0126 178.3696 89 A 4.0411 8.6073 121.3930 55.4336 18.4580 179.6981 90 F 4.1250 8.4316 115.8890 60.2888 38.8757 177.7066 91 K 3.9589 8.3684 119.9289 59.8325 31.6607 178.6983 92 T 3.8189 7.5498 108.4200 63.6763 68.6412 175.4315 93 F 4.8225 8.0286 119.1256 56.5397 40.2438 175.8923 94 D 4.8631 7.7370 120.1736 52.4253 39.8483 175.8866 95 R 4.1458 8.4583 123.3483 58.9301 30.5261 178.4805 96 E 4.0718 8.2615 115.8200 57.4595 29.6658 177.3046 97 G 3.9200 9.4059 106.5763 47.0568 0.0000 173.8434 98 Q 4.4944 8.7486 115.1337 55.1459 29.6471 176.7279 99 G 3.3679 9.0762 106.8941 45.1331 0.0000 173.0975 100 F 5.2697 7.7810 116.8423 55.7566 41.7161 174.9716 101 I 4.9860 8.8404 121.0487 59.2570 41.7941 174.5612 102 S 4.5910 8.8934 123.3914 58.0513 63.9708 175.1878 103 G 3.9586 9.3896 110.7652 47.4077 0.0000 176.0119 104 A 3.9668 7.8680 122.2361 54.9329 18.5254 179.1521 105 E 3.8327 8.5410 118.3502 59.1739 29.7134 178.7210 106 L 3.8964 8.2445 120.7950 58.2948 42.2535 178.9203 107 R 3.8582 8.0850 118.6490 59.5289 29.8489 177.9261 108 H 4.0865 8.3759 118.2812 59.4405 29.9708 177.6853 109 V 3.3601 7.6860 114.1497 64.3820 31.2229 178.6488 110 L 4.0722 8.0200 118.9113 57.0058 41.2470 178.7058 111 T 4.7604 8.0018 108.6116 60.9971 69.9075 175.0166 112 A 4.4872 8.0155 122.7320 51.7680 20.5725 175.9159 113 L 4.6328 7.5479 115.1882 52.7579 45.0188 176.8820 114 G 3.8523 8.3195 107.7741 47.4518 0.0000 175.7175 115 E 4.3373 8.6554 114.2753 54.7539 28.0921 174.9102 116 R 3.9620 7.4506 119.0640 54.6708 31.1267 176.0917 117 L 4.7951 9.0163 123.6894 53.1744 44.6005 176.1212 118 S 4.5880 8.5634 114.9241 57.9103 64.5628 175.1189 119 D 4.3481 8.7586 120.5222 57.4281 40.4466 178.9470 120 E 4.0346 8.1205 119.0198 59.2352 29.4783 178.7649 121 D 4.3346 8.3215 119.3366 57.2528 40.8214 178.9055 122 V 3.5980 8.0290 118.8963 66.0622 31.5396 177.4711 123 D 4.3751 8.1337 118.6422 57.6359 40.7324 178.7781 124 E 3.9213 8.3454 119.4840 59.3241 29.6385 178.6689 125 I 3.7955 8.1299 119.0203 64.0366 38.0587 177.9116 126 I 3.7511 8.0941 121.0028 64.1492 36.9376 178.3215 127 K 3.9275 8.1818 120.3685 59.6920 31.9139 178.9946 128 L 4.0789 8.2560 118.3422 57.2859 41.5901 178.6136 129 T 4.2752 8.0151 107.3275 60.6853 69.4605 173.9308 130 D 4.4067 7.9912 120.1118 54.9782 40.3339 173.2186 131 L 4.1291 7.9605 118.9674 54.7440 42.6251 175.8235 132 Q 4.6952 8.4401 124.1961 54.0639 31.5948 174.9600 133 E 4.5542 8.3986 121.0208 55.3256 31.0217 176.5499 134 D 4.7729 8.9146 122.0978 52.1792 41.3005 176.6363 135 L 3.8627 8.3962 119.7665 58.2475 41.9204 177.6605 136 E 4.1408 8.1821 115.3209 56.3854 29.8622 176.9803 137 G 3.8893 8.6455 108.4427 45.2770 0.0000 172.7360 138 N 5.4476 8.6010 117.1323 51.5857 41.6752 174.2964 139 V 4.8206 8.9777 113.1672 59.5485 36.4568 175.3973 140 K 4.6261 8.8044 124.7791 54.6464 31.9842 176.7623 141 Y 4.0287 8.2269 127.9913 59.7277 37.7248 177.7847 142 E 3.9691 7.4947 120.9444 59.3395 29.7111 178.2126 143 D 4.3730 7.9986 118.3782 57.3440 40.9215 178.4998 144 F 4.2651 7.9500 121.0056 61.2929 39.4035 177.1458 145 V 3.3755 8.1110 118.2275 66.0174 31.3030 178.0228 146 K 4.0262 8.3505 118.0637 59.4798 31.7080 179.4215 147 K 3.8931 8.2493 118.8562 59.4313 31.7677 179.5219 148 V 3.4028 7.5960 117.4262 66.3517 31.4857 177.7920 149 M 4.2263 8.2340 117.1509 58.1794 31.9412 178.3056 150 A 4.1798 8.0311 121.3971 53.3080 18.5189 176.8334 151 G 3.9457 7.3337 101.8144 43.6672 0.0000 172.1317 152 P 4.0498 0.0000 0.0000 65.0013 31.4576 176.4287 153 Y 4.5587 7.2130 116.4069 55.7870 39.2751 174.8161 154 P 4.6492 0.0000 0.0000 61.1925 30.4832 178.5114 155 D 4.7421 7.2342 115.5583 53.4067 42.9149 174.7805 156 K 4.2307 9.5886 123.6943 55.9156 32.9619 176.2980 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 4.46 0.00 2.16 1.90 0.00 3.61 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.94 0.00 2 K 9.05 4.15 0.00 1.83 1.86 0.00 1.78 0.00 0.00 1.70 0.00 0.00 2.93 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.42 1.45 7.81 3 L 8.65 4.72 0.00 1.73 1.66 0.95 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 4 S 8.95 4.16 0.00 4.05 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 5 Q 8.19 3.75 0.00 2.29 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.69 6.60 0.00 0.00 0.00 0.00 0.00 2.28 2.49 0.00 6 D 7.80 4.48 0.00 2.79 2.71 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 0.00 0.00 0.00 7 E 8.11 4.42 0.00 2.14 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 2.50 2.47 0.00 8 I 7.71 4.06 2.14 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.27 1.11 0.00 0.00 9 D 7.70 4.42 0.00 2.71 2.72 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 10 D 8.66 4.38 0.00 2.86 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 11 L 8.01 3.96 0.00 1.89 2.05 0.67 0.79 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 12 K 8.24 3.84 0.00 1.98 1.59 0.00 1.55 0.00 0.00 1.23 0.00 0.00 2.32 0.00 0.00 2.89 0.00 0.00 0.00 0.00 0.37 1.60 7.81 13 D 8.50 4.34 0.00 2.85 2.73 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 14 V 7.97 3.72 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 1.11 0.00 0.00 1.00 0.00 0.00 15 F 8.61 3.87 0.00 3.21 3.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 E 8.56 4.05 0.00 2.31 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 2.41 2.48 0.00 17 L 7.83 3.93 0.00 1.82 1.94 0.99 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 18 F 8.50 4.09 0.00 3.03 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 19 D 8.07 4.27 0.00 1.98 2.72 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 20 F 8.17 4.00 0.00 3.10 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 21 W 8.10 4.52 0.00 3.27 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 22 D 7.99 4.82 0.00 2.81 2.82 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 23 G 7.76 3.50 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 0.00 0.00 0.00 24 R 7.83 4.12 0.00 1.70 1.73 0.00 3.28 0.00 0.00 3.36 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.62 0.00 25 D 9.76 4.56 0.00 2.75 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 26 G 10.09 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 A 8.77 5.33 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 28 V 9.10 4.49 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 0.95 0.00 0.00 -0.09 0.00 0.00 29 D 9.74 5.01 0.00 2.96 2.72 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 30 A 9.42 4.13 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 31 F 9.55 4.56 0.00 3.13 3.29 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 32 K 8.32 4.35 0.00 2.06 1.81 0.00 1.96 0.00 0.00 1.49 0.00 0.00 2.96 0.00 0.00 3.27 0.00 0.00 0.00 0.00 1.58 1.84 7.81 33 L 7.81 4.28 0.00 1.59 1.74 0.53 0.79 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 34 G 7.86 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 D 7.76 4.28 0.00 2.67 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 36 V 7.51 3.09 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 0.14 0.00 0.00 37 C 7.89 3.99 0.00 3.18 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 38 R 8.18 4.76 0.00 1.99 1.98 0.00 3.22 0.00 0.00 3.23 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.62 0.00 39 C 7.82 4.38 0.00 3.22 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 L 7.56 4.48 0.00 1.77 1.76 0.86 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 41 G 8.13 4.06 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 0.00 0.00 0.00 42 I 7.59 4.53 1.92 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 1.71 0.78 1.00 0.00 0.00 43 N 8.21 5.31 0.00 2.73 2.79 0.00 0.00 6.98 8.02 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 44 P 0.00 4.42 0.00 2.10 2.03 0.00 3.80 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.96 0.00 45 R 9.02 4.21 0.00 1.98 2.18 0.00 3.16 0.00 0.00 3.18 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.66 0.00 46 N 8.86 3.75 0.00 3.00 2.54 0.00 0.00 6.47 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 47 E 8.34 4.02 0.00 2.19 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 2.35 2.43 0.00 48 D 7.83 4.30 0.00 2.81 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 49 V 7.52 3.58 1.75 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 0.89 0.00 0.00 0.79 0.00 0.00 50 F 8.14 4.85 0.00 3.13 2.97 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 51 A 8.05 4.17 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 52 V 6.87 4.24 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 0.81 0.00 0.00 0.98 0.00 0.00 53 G 8.15 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 54 G 8.47 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 55 T 8.04 4.65 4.50 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 1.34 0.00 0.00 56 H 8.63 4.81 0.00 3.11 3.38 0.00 5.74 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 K 7.42 3.31 0.00 1.48 1.51 0.00 1.49 0.00 0.00 1.63 0.00 0.00 2.96 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.23 1.32 7.81 58 M 7.33 4.31 0.00 2.04 1.92 0.00 0.00 0.00 0.00 0.00 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 2.68 0.00 59 G 9.78 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 0.00 0.00 0.00 60 E 8.49 4.52 0.00 1.97 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 2.19 2.23 0.00 61 K 7.67 4.77 0.00 1.82 1.64 0.00 1.68 0.00 0.00 1.77 0.00 0.00 2.83 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.45 1.47 7.81 62 S 8.76 5.28 0.00 3.95 3.75 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 63 L 9.29 5.16 0.00 1.95 1.66 0.68 0.94 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 64 P 0.00 5.41 0.00 2.49 2.32 0.00 4.01 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 1.98 0.00 65 F 8.65 3.36 0.00 2.06 2.82 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 66 E 8.20 3.78 0.00 2.17 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 2.39 2.38 0.00 67 E 8.11 4.02 0.00 2.22 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 2.36 2.53 0.00 68 F 8.30 3.88 0.00 3.03 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 69 L 7.31 3.94 0.00 1.74 1.60 0.81 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 70 P 0.00 4.18 0.00 2.22 2.27 0.00 3.75 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 1.98 0.00 71 A 7.49 4.00 1.29 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 72 Y 8.39 4.26 0.00 3.02 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 73 E 8.27 3.78 0.00 2.09 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 2.26 2.55 0.00 74 G 8.67 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 75 L 8.30 4.04 0.00 1.88 1.76 0.94 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 76 M 7.56 4.11 0.00 1.88 2.06 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 2.47 2.15 0.00 77 D 7.59 4.53 0.00 2.76 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 78 C 8.00 4.18 0.00 3.03 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 E 8.69 4.00 0.00 1.94 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.29 0.00 80 Q 8.34 4.63 0.00 2.01 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.77 0.00 0.00 0.00 0.00 0.00 2.27 2.36 0.00 81 G 9.03 3.75 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 0.00 0.00 0.00 82 T 7.31 4.46 4.20 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 1.14 0.00 0.00 83 F 8.60 4.20 0.00 3.07 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 84 A 8.09 3.94 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 85 D 7.71 4.23 0.00 2.54 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 Y 7.46 4.50 0.00 3.13 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 87 M 8.13 4.22 0.00 1.97 1.91 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.49 0.00 88 E 8.25 3.91 0.00 2.07 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 2.30 2.31 0.00 89 A 8.61 4.04 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 90 F 8.43 4.12 0.00 2.79 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 0.00 0.00 0.00 91 K 8.37 3.96 0.00 2.10 2.03 0.00 1.66 0.00 0.00 1.78 0.00 0.00 3.13 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.47 1.55 7.81 92 T 7.55 3.82 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 1.17 0.00 0.00 93 F 8.03 4.82 0.00 3.08 3.28 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 94 D 7.74 4.86 0.00 2.85 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 95 R 8.46 4.15 0.00 1.90 2.02 0.00 3.30 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 1.66 1.71 0.00 96 E 8.26 4.07 0.00 2.06 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 0.00 2.36 2.41 0.00 97 G 9.41 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.75 4.49 0.00 2.36 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.89 0.00 0.00 0.00 0.00 0.00 2.35 2.42 0.00 99 G 9.08 3.37 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 0.00 100 F 7.78 5.27 0.00 3.01 3.03 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 0.00 101 I 8.84 4.99 2.06 0.00 0.00 0.92 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 1.53 1.10 0.00 0.00 102 S 8.89 4.59 0.00 3.95 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 0.00 103 G 9.39 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 A 7.87 3.97 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 0.00 105 E 8.54 3.83 0.00 2.02 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 0.00 2.21 2.30 0.00 106 L 8.24 3.90 0.00 1.68 1.71 0.94 0.10 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 0.00 107 R 8.09 3.86 0.00 1.87 2.03 0.00 3.14 0.00 0.00 3.22 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.63 0.00 108 H 8.38 4.09 0.00 3.30 3.44 0.00 5.84 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 0.00 109 V 7.69 3.36 1.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.10 0.00 0.00 0.86 0.00 0.00 110 L 8.02 4.07 0.00 1.71 1.73 1.04 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 111 T 8.00 4.76 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 1.26 0.00 0.00 112 A 8.02 4.49 1.16 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 0.00 0.00 0.00 0.00 0.00 0.00 113 L 7.55 4.63 0.00 1.77 1.58 0.99 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 114 G 8.32 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 E 8.66 4.34 0.00 1.97 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 2.33 2.34 0.00 116 R 7.45 3.96 0.00 1.86 2.02 0.00 3.41 0.00 0.00 3.34 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.81 0.00 117 L 9.02 4.80 0.00 1.66 1.58 0.94 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 118 S 8.56 4.59 0.00 3.92 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 0.00 119 D 8.76 4.35 0.00 2.75 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 0.00 120 E 8.12 4.03 0.00 2.02 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 2.40 2.40 0.00 121 D 8.32 4.33 0.00 2.88 2.73 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 0.00 122 V 8.03 3.60 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 1.09 0.00 0.00 1.01 0.00 0.00 123 D 8.13 4.38 0.00 3.03 2.72 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 0.00 124 E 8.35 3.92 0.00 2.16 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 2.30 2.35 0.00 125 I 8.13 3.80 1.93 0.00 0.00 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 1.56 1.20 1.18 0.00 0.00 126 I 8.09 3.75 2.08 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.73 0.87 0.00 0.00 127 K 8.18 3.93 0.00 1.83 2.08 0.00 1.89 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 3.29 0.00 0.00 0.00 0.00 1.44 1.48 7.81 128 L 8.26 4.08 0.00 1.60 1.68 0.88 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 129 T 8.02 4.28 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 1.22 0.00 0.00 130 D 7.99 4.41 0.00 2.81 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 0.00 131 L 7.96 4.13 0.00 1.70 1.51 0.92 -0.10 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 0.00 132 Q 8.44 4.70 0.00 2.04 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.68 0.00 0.00 0.00 0.00 0.00 2.41 2.28 0.00 133 E 8.40 4.55 0.00 2.01 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 0.00 2.33 2.25 0.00 134 D 8.91 4.77 0.00 2.78 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 L 8.40 3.86 0.00 1.58 1.71 0.90 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 136 E 8.18 4.14 0.00 1.98 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 2.22 2.22 0.00 137 G 8.65 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 0.00 0.00 0.00 138 N 8.60 5.45 0.00 2.82 2.85 0.00 0.00 6.77 7.22 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 0.00 139 V 8.98 4.82 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 0.77 0.00 0.00 0.96 0.00 0.00 140 K 8.80 4.63 0.00 1.77 1.70 0.00 0.64 0.00 0.00 0.96 0.00 0.00 2.70 0.00 0.00 2.55 0.00 0.00 0.00 0.00 1.22 0.92 7.81 141 Y 8.23 4.03 0.00 2.54 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 0.00 142 E 7.49 3.97 0.00 1.88 1.86 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 2.58 2.75 0.00 143 D 8.00 4.37 0.00 2.94 2.73 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 0.00 144 F 7.95 4.27 0.00 2.88 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 0.00 145 V 8.11 3.38 2.38 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 1.28 0.00 0.00 1.02 0.00 0.00 146 K 8.35 4.03 0.00 2.04 1.84 0.00 1.73 0.00 0.00 1.57 0.00 0.00 2.56 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.36 1.87 7.81 147 K 8.25 3.89 0.00 1.88 1.82 0.00 1.91 0.00 0.00 1.58 0.00 0.00 2.92 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.59 7.81 148 V 7.60 3.40 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 0.61 0.00 0.00 0.03 0.00 0.00 149 M 8.23 4.23 0.00 2.09 2.26 0.00 0.00 0.00 0.00 0.00 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3.01 2.82 0.00 150 A 8.03 4.18 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 0.00 151 G 7.33 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 0.00 152 P 0.00 4.05 0.00 1.22 1.85 0.00 3.67 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.80 0.00 153 Y 7.21 4.56 0.00 3.02 2.93 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 0.00 154 P 0.00 4.65 0.00 2.06 2.03 0.00 3.78 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.18 0.00 155 D 7.23 4.74 0.00 2.60 2.54 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 0.00 156 K 9.59 4.23 0.00 1.95 1.64 0.00 1.80 0.00 0.00 1.79 0.00 0.00 3.10 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.40 1.40 7.81