NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9254 8.3549 109.7737 44.8009 0.0000 173.3208 2 L 4.2469 7.4112 119.3781 51.0672 43.9759 174.6532 3 S 4.5468 10.7700 117.4017 57.8417 66.2702 174.6822 4 D 4.6733 8.6819 121.3508 57.2506 40.2231 179.1736 5 G 3.6727 8.0461 105.2011 47.9262 0.0000 175.1674 6 E 4.0220 8.0906 121.2809 58.9430 29.4719 179.2332 7 W 4.5850 8.0365 118.8740 60.3513 29.1154 178.4161 8 Q 4.0947 8.2839 119.2458 58.9499 28.5077 178.0138 9 L 4.0638 8.1168 120.3122 57.5735 41.6027 179.6051 10 V 3.7220 7.8057 117.6983 66.2515 31.7354 178.0293 11 L 4.3097 8.4670 118.9125 57.6985 41.1559 179.4066 12 N 4.4108 8.1248 116.1939 56.4168 38.9256 177.5767 13 V 3.8272 8.1316 120.6338 64.4695 31.6438 178.1539 14 W 4.2297 8.9979 129.4907 59.9769 30.0052 178.1037 15 G 3.6783 8.0112 105.4440 47.5902 0.0000 175.8638 16 K 3.9503 7.6196 119.9871 59.1032 32.2824 179.2729 17 V 2.8432 6.9315 118.0928 65.6380 31.1169 177.7636 18 E 4.0329 7.3758 116.6294 58.5922 29.3266 178.3634 19 A 4.2474 7.2801 118.0370 52.7076 20.2457 177.2494 20 D 4.5563 8.0020 113.1805 52.5808 43.8791 176.1152 21 V 3.4865 7.5681 123.1166 65.5054 32.0937 176.8196 22 A 4.0990 7.9750 120.3131 55.0859 18.1836 179.6884 23 G 3.5195 8.0565 104.1035 48.3089 0.0000 175.7323 24 H 4.2084 8.2858 118.5463 58.3167 28.7706 178.1837 25 G 3.5766 8.3545 108.2811 47.5496 0.0000 175.7200 26 Q 3.8622 8.4606 122.3239 59.1048 29.1096 178.1206 27 E 3.9087 7.8567 119.6988 59.0515 29.3212 179.5409 28 V 3.4445 7.5550 118.2232 66.0752 31.6003 178.1450 29 L 3.4182 7.4635 118.1287 57.4984 41.2245 179.6696 30 I 3.5502 7.8057 120.1430 64.3358 37.0184 178.6010 31 R 3.8199 8.3631 119.2144 59.1653 29.7999 178.8814 32 L 3.9142 7.9943 120.4329 58.2178 41.7650 179.0706 33 F 4.5698 7.8390 117.7891 60.2654 38.6429 177.8603 34 K 4.1834 8.2952 117.7928 58.7161 31.9953 179.3154 35 G 3.7775 7.8296 105.6994 46.5001 0.0000 173.6962 36 H 4.6661 8.1297 118.6256 50.9025 30.0481 171.9847 37 P 4.5446 0.0000 0.0000 64.4091 31.3970 177.5806 38 E 4.1490 8.1980 116.2518 59.1870 29.5408 179.0572 39 T 3.9179 8.1242 111.6599 64.5052 68.8645 176.3271 40 L 3.7081 7.9397 122.9967 57.7182 41.7460 178.6816 41 E 4.1241 7.8649 117.9210 58.9089 29.4086 178.8149 42 K 4.3942 8.1488 117.3116 57.2699 33.0543 177.8138 43 F 4.5658 8.0037 119.2646 55.3097 38.6029 175.5640 44 D 4.4118 8.4134 123.8047 57.5887 40.6847 178.9081 45 K 4.0066 7.9027 116.1183 58.2932 32.1543 177.4291 46 F 5.1309 8.2438 116.1080 56.5422 40.4370 176.9192 47 K 3.9076 7.7334 119.5169 59.6780 32.2520 177.8129 48 H 4.4300 8.1578 113.5782 56.9898 29.0044 175.3488 49 L 4.0915 7.8242 122.0532 54.6211 41.7110 176.8083 50 K 4.3893 8.5048 122.7133 57.0187 33.6895 176.3878 51 S 4.5368 7.3090 112.3657 56.1845 66.5805 174.8474 52 E 3.8799 8.5638 121.4938 59.5769 29.0388 178.2329 53 D 4.0177 8.0326 118.3902 57.2747 40.6520 178.4097 54 E 4.0170 7.6498 118.7086 59.2446 29.6013 178.8844 55 M 4.1330 8.1981 119.2137 58.3964 31.8511 178.8889 56 K 3.8869 8.8406 118.1340 59.1602 32.2300 178.6296 57 A 4.3516 7.3936 119.4490 52.5902 18.9919 177.6703 58 S 4.1492 7.4019 113.9231 58.4347 63.1412 174.7754 59 E 4.1460 8.9344 126.9819 59.6437 29.8556 178.7364 60 D 4.5422 8.1777 119.3199 56.6371 40.9368 178.2493 61 L 3.5530 7.8964 121.2345 57.9237 42.1763 178.9922 62 K 3.9264 7.6532 118.1319 59.5143 32.0634 178.9940 63 K 4.0866 8.0239 118.5637 59.5936 31.9129 178.9163 64 H 4.3372 8.4669 118.5064 59.0915 29.8161 177.5441 65 G 3.5740 8.5161 108.1897 47.6008 0.0000 175.0397 66 N 4.2920 7.9447 118.9614 56.9012 38.9930 176.9389 67 T 3.8924 8.1069 117.1408 67.0209 68.6481 176.8230 68 T 3.9061 8.0572 117.5197 66.8078 68.5197 177.0788 69 L 4.2765 8.1454 120.6773 57.6889 41.4620 179.6899 70 T 3.9429 8.4245 116.3640 66.6676 68.5506 176.4848 71 A 4.0159 7.8884 122.2759 54.9732 18.3503 179.4871 72 L 3.7646 7.9604 118.8974 58.1539 42.1402 179.4707 73 G 3.3278 8.9402 106.4155 47.5014 0.0000 175.9165 74 G 3.6312 7.6786 107.1757 47.3385 0.0000 175.8718 75 I 3.8691 7.5008 121.6987 64.2191 37.1549 178.1803 76 L 3.8924 7.6140 119.8733 57.9156 41.2219 179.8617 77 K 3.9077 7.3731 116.0782 58.7228 31.5132 178.7293 78 K 3.9317 7.8136 117.3777 56.0889 32.8274 176.5652 79 K 2.0000 8.3214 119.1995 56.1924 29.7373 174.7320 80 G 3.9930 7.7179 106.2716 45.7624 0.0000 173.6188 81 H 4.6331 8.5407 119.0874 54.8123 27.2516 174.6501 82 H 5.1166 7.2788 112.0235 54.0488 29.9091 176.3458 83 E 4.0020 8.5082 121.6381 60.3204 28.9062 179.1664 84 A 4.0299 7.8711 119.0214 55.0840 18.6607 178.9579 85 E 4.1594 8.1136 116.3402 58.5849 29.7501 179.0289 86 L 4.0033 8.4839 121.1746 58.6466 42.1782 178.8281 87 T 3.8905 7.9149 115.8753 66.5086 68.3569 174.3050 88 P 4.1758 0.0000 0.0000 65.5624 31.3842 178.5019 89 L 4.0481 7.4260 118.7612 57.9635 42.1111 178.8746 90 A 4.2366 8.5051 121.3142 55.4047 18.2762 179.3218 91 Q 3.8649 8.8319 117.4542 58.9303 28.7602 178.8981 92 S 3.9714 8.3694 114.9897 62.2880 62.8896 176.5337 93 H 4.1787 8.5860 119.5452 57.4992 28.1345 177.7845 94 A 3.1976 7.3417 122.0122 54.5304 18.4870 178.8898 95 T 3.8005 7.2648 106.0975 63.0208 69.7598 175.8813 96 K 4.0567 7.4825 120.7993 58.3777 32.7830 176.9231 97 H 4.3960 8.3875 113.5247 55.5334 29.6198 175.1076 98 K 3.5601 7.5846 117.8061 57.3074 28.9364 175.2256 99 I 4.3262 8.4646 119.1390 58.5712 39.1194 175.0969 100 P 4.4647 0.0000 0.0000 62.3014 32.1446 177.6138 101 V 3.5240 7.8646 118.9506 65.4255 31.2180 178.1627 102 K 3.5704 7.9100 119.3964 59.9247 31.8368 177.9915 103 Y 4.1664 7.3569 115.5220 61.1307 37.6712 178.7768 104 L 4.1028 7.7862 119.7244 57.7012 41.5572 179.1559 105 E 3.9551 7.9639 119.4787 59.1189 29.5434 178.8506 106 F 4.5734 7.4236 117.4929 60.7283 38.9989 177.2454 107 I 3.9423 8.3832 118.2088 63.5624 37.6642 178.1583 108 S 4.1855 8.3273 116.9695 61.5575 62.6713 176.3148 109 E 4.0262 8.7221 120.5293 59.2650 29.2600 179.0327 110 A 4.6964 7.9976 123.0677 54.5731 18.4443 179.6250 111 I 3.6518 8.0672 118.5688 64.7271 37.2291 178.8059 112 I 3.8323 8.1641 120.8830 64.3938 36.9523 178.4236 113 Q 4.0592 8.4988 119.4587 59.0355 28.4808 179.2668 114 V 3.5065 8.1149 119.5180 65.9109 31.5137 178.1397 115 L 3.7503 7.6715 118.8034 57.5842 41.0472 179.2154 116 Q 4.1514 8.0675 118.9199 59.4404 29.0940 178.3359 117 S 4.2428 7.9731 115.1242 61.4451 62.9744 176.3510 118 K 4.0455 8.0960 120.2590 57.8349 33.3781 177.0688 119 H 5.0181 8.5488 115.6871 53.5502 29.5905 172.4223 120 P 4.3360 0.0000 0.0000 65.9870 31.5989 179.3642 121 G 3.9742 8.2662 106.6448 47.5492 0.0000 173.4519 122 D 4.9085 8.1276 116.3785 53.8855 42.1069 176.3756 123 F 5.0344 8.3741 121.4266 56.6540 38.9059 174.4436 124 G 3.8354 7.5000 111.0442 43.6182 0.0000 171.4127 125 A 3.8890 8.4112 120.8613 55.3840 18.1099 179.4388 126 D 4.1833 7.9685 116.2665 57.5209 40.9364 178.7114 127 A 3.9403 7.7894 120.4905 55.2272 18.3825 179.2147 128 Q 3.3819 7.7723 117.0142 59.0884 28.6238 179.8298 129 G 3.4946 8.1554 106.3925 47.5429 0.0000 175.6992 130 A 3.8393 8.0867 123.2243 55.1272 18.3823 179.3247 131 M 4.0298 8.3093 117.0626 59.0100 32.2558 178.5623 132 S 4.1751 8.4731 115.6263 61.6120 62.9453 176.8840 133 K 3.9636 7.8561 120.9813 59.2591 31.7127 179.3302 134 A 3.8872 7.9281 121.1417 55.1214 18.2139 179.7341 135 L 4.1212 8.3130 117.9215 57.6708 41.5866 179.2906 136 E 3.9493 8.5795 120.0894 59.0519 29.5244 178.6037 137 L 3.9576 8.4221 121.0143 58.0160 42.1752 178.7434 138 F 4.1154 8.2865 120.7080 61.2031 39.1251 177.2357 139 R 3.5440 8.2967 117.8170 59.3904 29.9446 178.8165 140 N 4.1914 8.2833 116.3101 56.4265 38.4900 177.2994 141 D 4.3368 8.1570 120.3398 57.4644 40.8705 178.8032 142 M 3.7527 7.6257 119.0425 58.0180 32.0010 178.4638 143 A 3.6094 8.5594 121.7858 55.2018 18.5187 179.6386 144 A 4.0075 7.9824 119.0567 55.0983 18.1803 180.0638 145 K 4.0668 7.9188 116.5599 59.5150 32.3959 178.9087 146 Y 4.4028 8.2094 117.1987 61.2798 37.3501 178.6372 147 K 4.1720 8.1150 119.1546 59.6143 32.0097 178.7096 148 E 4.2337 8.0139 115.0869 57.8876 30.0174 177.7870 149 L 4.4894 8.3203 119.0643 54.1868 42.5707 176.1692 150 G 3.5274 7.8172 105.8191 46.7401 0.0000 172.8633 151 F 4.7429 8.0122 115.8844 54.5406 42.3904 174.9521 152 Q 5.1364 8.5380 126.0426 55.9132 31.3089 173.3350 153 G 3.5222 8.3742 113.7318 45.7122 0.0000 171.8823 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 G 8.35 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 0.00 0.00 0.00 2 L 7.41 4.25 0.00 0.61 0.96 0.48 -0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 3 S 10.77 4.55 0.00 4.05 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 4 D 8.68 4.67 0.00 2.77 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 5 G 8.05 3.67 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 0.00 0.00 0.00 6 E 8.09 4.02 0.00 2.09 1.69 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 2.21 2.26 0.00 7 W 8.04 4.59 0.00 3.54 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 Q 8.28 4.09 0.00 2.41 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.81 0.00 0.00 0.00 0.00 0.00 2.40 2.49 0.00 9 L 8.12 4.06 0.00 1.98 1.72 0.89 0.66 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 10 V 7.81 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 1.28 0.00 0.00 0.90 0.00 0.00 11 L 8.47 4.31 0.00 1.88 1.80 0.91 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 12 N 8.12 4.41 0.00 3.04 2.94 0.00 0.00 7.06 7.80 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 13 V 8.13 3.83 2.44 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 0.95 0.00 0.00 1.14 0.00 0.00 14 W 9.00 4.23 0.00 3.56 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 15 G 8.01 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 16 K 7.62 3.95 0.00 1.57 1.50 0.00 1.64 0.00 0.00 1.55 0.00 0.00 2.95 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.37 1.40 7.81 17 V 6.93 2.84 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.10 0.00 0.00 0.09 0.00 0.00 18 E 7.38 4.03 0.00 1.99 1.95 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 2.39 2.35 0.00 19 A 7.28 4.25 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 20 D 8.00 4.56 0.00 2.63 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 21 V 7.57 3.49 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 0.99 0.00 0.00 0.93 0.00 0.00 22 A 7.97 4.10 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 23 G 8.06 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 H 8.29 4.21 0.00 3.09 3.21 0.00 5.82 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 25 G 8.35 3.58 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 0.00 0.00 0.00 0.00 0.00 0.00 26 Q 8.46 3.86 0.00 2.03 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.74 0.00 0.00 0.00 0.00 0.00 2.25 2.30 0.00 27 E 7.86 3.91 0.00 1.88 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 2.23 2.38 0.00 28 V 7.56 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 1.04 0.00 0.00 0.96 0.00 0.00 29 L 7.46 3.42 0.00 1.32 0.72 0.87 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 30 I 7.81 3.55 1.84 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 1.46 0.55 0.85 0.00 0.00 31 R 8.36 3.82 0.00 1.93 1.92 0.00 3.25 0.00 0.00 3.04 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.73 0.00 32 L 7.99 3.91 0.00 1.61 1.34 1.01 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 33 F 7.84 4.57 0.00 2.99 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 34 K 8.30 4.18 0.00 1.68 1.84 0.00 1.78 0.00 0.00 1.74 0.00 0.00 3.03 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.65 1.57 7.81 35 G 7.83 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 36 H 8.13 4.67 0.00 2.85 2.95 0.00 5.64 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 P 0.00 4.54 0.00 2.14 2.09 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 2.08 1.97 0.00 38 E 8.20 4.15 0.00 2.30 2.29 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 2.34 2.52 0.00 39 T 8.12 3.92 4.43 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 0.85 0.00 0.00 40 L 7.94 3.71 0.00 1.46 1.75 -0.13 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 41 E 7.86 4.12 0.00 2.17 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 2.41 2.55 0.00 42 K 8.15 4.39 0.00 2.04 1.65 0.00 1.74 0.00 0.00 2.04 0.00 0.00 3.14 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.54 1.58 7.81 43 F 8.00 4.57 0.00 3.29 3.01 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 44 D 8.41 4.41 0.00 2.70 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 45 K 7.90 4.01 0.00 1.19 0.78 0.00 1.26 0.00 0.00 1.58 0.00 0.00 2.99 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.27 1.33 7.81 46 F 8.24 5.13 0.00 2.82 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 47 K 7.73 3.91 0.00 1.94 1.98 0.00 1.64 0.00 0.00 1.77 0.00 0.00 3.22 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.61 1.52 7.81 48 H 8.16 4.43 0.00 3.25 3.45 0.00 5.72 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 L 7.82 4.09 0.00 1.63 1.57 0.93 1.05 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 50 K 8.50 4.39 0.00 2.09 1.83 0.00 1.75 0.00 0.00 1.83 0.00 0.00 3.03 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.60 1.49 7.81 51 S 7.31 4.54 0.00 3.98 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 52 E 8.56 3.88 0.00 2.03 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 2.34 2.36 0.00 53 D 8.03 4.02 0.00 2.71 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 54 E 7.65 4.02 0.00 2.14 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 2.33 2.33 0.00 55 M 8.20 4.13 0.00 2.00 2.23 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.75 2.52 0.00 56 K 8.84 3.89 0.00 1.77 1.85 0.00 1.66 0.00 0.00 1.66 0.00 0.00 2.99 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.43 1.54 7.81 57 A 7.39 4.35 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 58 S 7.40 4.15 0.00 3.82 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 59 E 8.93 4.15 0.00 2.26 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 0.00 2.42 2.45 0.00 60 D 8.18 4.54 0.00 2.99 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 61 L 7.90 3.55 0.00 1.33 1.49 0.70 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 62 K 7.65 3.93 0.00 1.89 1.99 0.00 1.66 0.00 0.00 1.64 0.00 0.00 2.92 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.43 1.46 7.81 63 K 8.02 4.09 0.00 1.98 1.90 0.00 1.78 0.00 0.00 1.62 0.00 0.00 2.93 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.50 1.70 7.81 64 H 8.47 4.34 0.00 3.77 3.71 0.00 5.79 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 65 G 8.52 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.94 4.29 0.00 2.82 3.03 0.00 0.00 7.22 6.52 0.00 0.00 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 T 8.11 3.89 4.36 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 1.24 0.00 0.00 68 T 8.06 3.91 4.40 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 1.29 0.00 0.00 69 L 8.15 4.28 0.00 1.76 1.90 0.89 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 70 T 8.42 3.94 4.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 71 A 7.89 4.02 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 72 L 7.96 3.76 0.00 1.63 1.76 0.18 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 73 G 8.94 3.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 7.68 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 I 7.50 3.87 1.88 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.03 0.89 0.00 0.00 76 L 7.61 3.89 0.00 1.05 1.45 -0.08 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 77 K 7.37 3.91 0.00 1.61 1.79 0.00 1.67 0.00 0.00 1.69 0.00 0.00 3.09 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.46 1.59 7.81 78 K 7.81 3.93 0.00 1.88 1.74 0.00 1.63 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.44 1.73 7.81 79 K 8.32 2.00 0.00 0.94 0.74 0.00 1.40 0.00 0.00 1.34 0.00 0.00 2.96 0.00 0.00 3.05 0.00 0.00 0.00 0.00 0.69 0.73 7.81 80 G 7.72 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 H 8.54 4.63 0.00 3.17 3.21 0.00 5.62 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 82 H 7.28 5.12 0.00 3.27 3.44 0.00 5.68 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 83 E 8.51 4.00 0.00 2.09 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 2.43 2.50 0.00 84 A 7.87 4.03 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 85 E 8.11 4.16 0.00 2.09 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 2.38 2.42 0.00 86 L 8.48 4.00 0.00 1.96 1.68 0.85 0.73 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 87 T 7.91 3.89 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 88 P 0.00 4.18 0.00 2.19 2.13 0.00 3.76 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.17 0.00 89 L 7.43 4.05 0.00 1.86 1.86 1.02 1.14 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 90 A 8.51 4.24 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 91 Q 8.83 3.86 0.00 2.21 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.69 0.00 0.00 0.00 0.00 0.00 2.39 2.64 0.00 92 S 8.37 3.97 0.00 3.97 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 H 8.59 4.18 0.00 3.52 3.56 0.00 5.80 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 94 A 7.34 3.20 0.35 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 T 7.26 3.80 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 1.01 0.00 0.00 96 K 7.48 4.06 0.00 1.58 1.67 0.00 1.70 0.00 0.00 1.54 0.00 0.00 3.05 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.25 1.36 7.81 97 H 8.39 4.40 0.00 3.00 3.13 0.00 5.86 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 K 7.58 3.56 0.00 1.82 1.76 0.00 1.67 0.00 0.00 1.77 0.00 0.00 2.97 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.26 1.44 7.81 99 I 8.46 4.33 2.05 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.96 1.12 0.00 0.00 100 P 0.00 4.46 0.00 1.88 1.99 0.00 3.09 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 1.49 0.00 101 V 7.86 3.52 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 0.79 0.00 0.00 0.64 0.00 0.00 102 K 7.91 3.57 0.00 1.73 1.64 0.00 1.86 0.00 0.00 1.50 0.00 0.00 2.99 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.35 1.50 7.81 103 Y 7.36 4.17 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 0.00 104 L 7.79 4.10 0.00 1.84 1.80 0.61 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 105 E 7.96 3.96 0.00 2.05 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 2.31 2.32 0.00 106 F 7.42 4.57 0.00 3.24 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 0.00 107 I 8.38 3.94 2.01 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.65 1.06 0.00 0.00 108 S 8.33 4.19 0.00 4.11 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 0.00 109 E 8.72 4.03 0.00 2.26 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 0.00 2.67 2.41 0.00 110 A 8.00 4.70 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 I 8.07 3.65 2.10 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 1.59 0.65 1.03 0.00 0.00 112 I 8.16 3.83 1.98 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.66 1.15 0.00 0.00 113 Q 8.50 4.06 0.00 2.20 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.82 0.00 0.00 0.00 0.00 0.00 2.40 2.48 0.00 114 V 8.11 3.51 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 0.99 0.00 0.00 0.98 0.00 0.00 115 L 7.67 3.75 0.00 0.48 0.45 0.78 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 116 Q 8.07 4.15 0.00 2.30 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.97 0.00 0.00 0.00 0.00 0.00 2.46 2.52 0.00 117 S 7.97 4.24 0.00 3.80 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 0.00 118 K 8.10 4.05 0.00 1.57 1.27 0.00 1.49 0.00 0.00 1.36 0.00 0.00 2.54 0.00 0.00 2.51 0.00 0.00 0.00 0.00 1.24 1.29 7.81 119 H 8.55 5.02 0.00 3.07 3.36 0.00 5.63 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 P 0.00 4.34 0.00 2.24 2.36 0.00 3.79 0.00 0.00 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 1.98 0.00 121 G 8.27 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 0.00 122 D 8.13 4.91 0.00 2.73 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 0.00 123 F 8.37 5.03 0.00 2.90 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 0.00 124 G 7.50 3.84 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 0.00 0.00 0.00 125 A 8.41 3.89 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 D 7.97 4.18 0.00 2.65 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 0.00 127 A 7.79 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 0.00 128 Q 7.77 3.38 0.00 1.90 1.88 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 1.16 1.69 0.00 129 G 8.16 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 0.00 130 A 8.09 3.84 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 0.00 131 M 8.31 4.03 0.00 2.39 2.32 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 2.76 2.91 0.00 132 S 8.47 4.18 0.00 3.86 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 0.00 133 K 7.86 3.96 0.00 1.73 1.69 0.00 1.51 0.00 0.00 1.54 0.00 0.00 2.88 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.38 1.54 7.81 134 A 7.93 3.89 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 0.00 135 L 8.31 4.12 0.00 1.74 1.81 1.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 136 E 8.58 3.95 0.00 2.08 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.31 0.00 137 L 8.42 3.96 0.00 1.86 2.00 1.05 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 138 F 8.29 4.12 0.00 3.15 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 0.00 139 R 8.30 3.54 0.00 2.12 1.87 0.00 3.17 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 1.66 2.00 0.00 140 N 8.28 4.19 0.00 2.71 2.82 0.00 0.00 7.11 8.93 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 0.00 141 D 8.16 4.34 0.00 2.87 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 0.00 142 M 7.63 3.75 0.00 1.44 1.44 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.76 0.00 143 A 8.56 3.61 1.19 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 0.00 0.00 144 A 7.98 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 0.00 145 K 7.92 4.07 0.00 1.92 2.02 0.00 1.80 0.00 0.00 1.83 0.00 0.00 3.09 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.50 1.66 7.81 146 Y 8.21 4.40 0.00 3.23 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 0.00 147 K 8.12 4.17 0.00 2.03 1.91 0.00 1.66 0.00 0.00 1.71 0.00 0.00 3.01 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.51 1.51 7.81 148 E 8.01 4.23 0.00 2.14 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.37 0.00 149 L 8.32 4.49 0.00 2.06 2.08 0.95 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 150 G 7.82 3.53 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 0.00 0.00 0.00 151 F 8.01 4.74 0.00 3.07 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 0.00 152 Q 8.54 5.14 0.00 2.12 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.27 0.00 0.00 0.00 0.00 0.00 2.12 2.15 0.00 153 G 8.37 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00