NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 L 4.4653 8.1693 120.6330 54.3304 43.2837 177.0185 4 S 4.2054 9.6194 119.1866 57.2097 64.8766 172.6426 5 P 4.1782 0.0000 0.0000 66.4896 31.5686 179.9876 6 S 4.2113 8.1935 112.5373 61.9230 62.8551 176.7949 7 A 4.9732 7.7200 123.8444 54.7600 18.1409 179.6877 8 R 3.8633 8.5470 117.7421 59.4806 30.1527 178.6201 9 R 3.9768 8.7012 118.9931 59.5003 30.0036 178.7499 10 V 3.5996 7.8997 117.7036 65.8963 31.5153 177.7031 11 Q 3.9311 8.2927 119.5420 59.1828 28.8340 178.5448 12 G 3.6235 8.6255 106.8188 47.8483 0.0000 175.4923 13 A 4.0451 7.9820 123.1672 54.8351 18.2966 179.7218 14 L 3.8668 7.9951 117.6215 57.7995 41.6003 179.6539 15 E 3.9349 8.3081 118.5124 59.9305 29.2910 179.5589 16 T 3.8960 8.0576 114.5147 66.6176 68.5455 176.3344 17 R 4.2860 7.8761 118.3720 57.1829 30.2877 177.5182 18 G 3.9019 8.1807 106.9367 45.2388 0.0000 173.7749 19 F 4.8193 8.4094 118.4344 56.4688 39.5417 178.0884 20 G 3.7133 8.3529 111.8447 48.5902 0.0000 175.1818 21 H 4.3875 8.2236 113.8015 57.1242 29.0020 175.3938 22 L 4.2339 7.6743 121.7917 54.0517 42.1242 176.0001 23 K 4.6300 8.3945 122.0662 54.4426 35.0815 175.3869 24 V 4.3694 8.4651 125.2165 62.7080 32.6933 175.3944 25 V 4.4513 9.4182 120.8534 59.7034 35.0211 174.5164 26 E 5.0888 8.8396 126.8616 54.3491 29.3770 175.1308 27 L 4.3596 8.7865 126.5885 53.7385 42.8944 176.2631 28 P 4.4525 0.0000 0.0000 63.6882 31.7829 176.0173 29 A 4.6951 7.2432 120.7481 49.9647 21.9672 176.0529 30 S 4.2957 8.5690 115.6882 58.9794 62.8831 173.9576 31 T 4.7194 8.7459 114.2496 61.2805 69.5886 175.7097 32 R 4.0818 8.1609 124.8349 59.6780 30.2949 177.1770 33 T 4.6811 7.3648 106.4866 59.1838 72.6445 174.5878 34 A 3.9219 8.4977 123.8578 55.4056 18.3596 179.8453 35 K 3.7517 8.0184 117.2588 59.9504 32.1896 178.6569 36 E 3.9123 7.9151 118.5111 59.1149 29.2526 179.0737 37 A 3.8291 8.5050 120.9324 55.2269 18.3903 179.4807 38 A 3.6954 8.1795 119.5263 55.3776 17.8773 179.6919 39 Q 3.7750 7.9119 117.2892 59.1164 28.8738 178.2199 40 A 4.0022 7.9110 121.3049 54.0502 18.4145 178.4084 41 V 3.7883 6.8448 107.5196 60.3322 32.1423 176.0141 42 G 3.7137 7.4119 106.2785 46.4179 0.0000 173.9363 43 A 4.5564 7.5498 122.1311 49.8915 21.0437 177.5641 44 E 4.2790 8.1734 118.8130 55.5721 30.5903 178.8026 45 V 3.5337 8.5017 121.9609 64.7851 31.4169 178.6474 46 G 4.0628 7.8674 107.3718 47.2555 0.0000 174.1610 47 Q 3.5525 7.8101 118.5519 57.0976 29.2732 175.6875 48 I 4.4406 7.5929 120.5249 60.8421 38.6220 175.0433 49 V 4.5707 8.7331 127.2051 61.3710 32.7667 175.0417 50 K 4.4329 9.0392 128.9424 55.2111 33.7097 176.2587 51 S 4.9429 8.7885 122.5236 57.7557 63.3389 173.3498 52 L 4.8044 9.4227 126.3250 53.0080 44.0685 175.8849 53 V 5.0576 8.4182 123.6689 61.5291 33.6310 174.3368 54 F 5.1350 9.6686 126.0382 55.7063 43.1159 173.9674 55 V 4.5416 9.0176 123.0903 61.7873 33.4341 175.3472 56 G 4.7772 9.6217 115.4628 43.7165 0.0000 174.0823 57 E 4.2223 9.0875 118.6351 59.0151 29.4182 178.5929 58 K 4.4254 8.2177 114.3450 55.2346 32.8925 176.1599 59 G 3.7001 6.7183 105.6452 45.8789 0.0000 171.3931 60 A 5.1965 7.8782 120.0939 50.5657 21.6967 176.1559 61 Y 4.9221 9.1672 116.0387 56.2734 42.9663 174.1368 62 L 5.1435 9.0234 125.1872 53.5367 44.5720 174.8797 63 F 5.1200 9.7414 125.5372 55.8364 41.8922 174.5690 64 L 5.0726 9.3317 125.5112 53.5485 42.6531 175.4186 65 V 4.6819 8.5558 124.9045 60.6195 33.9567 175.0895 66 S 4.6381 9.1242 122.6584 58.2441 62.8984 175.4498 67 G 3.7002 8.9031 115.7965 48.0077 0.0000 174.4926 68 K 4.2588 8.0066 116.8339 57.3674 33.4254 176.0966 69 N 5.0155 7.9106 116.8253 51.4524 41.3610 173.4274 70 R 4.6040 8.0552 120.0856 54.1799 32.4288 174.9011 71 L 4.2323 8.5672 128.8964 55.4011 42.7012 175.5464 72 D 4.4905 9.2717 127.3264 53.0466 41.4632 176.7287 73 L 3.7101 8.5607 129.1001 57.7414 42.0777 178.9622 74 G 3.4831 7.9473 105.4552 47.6149 0.0000 175.7134 75 K 3.8416 8.5423 121.5281 58.8956 32.0665 179.2214 76 A 3.6684 7.7471 121.0972 55.4186 18.0667 179.6908 77 T 3.6799 7.8354 114.3712 66.7317 68.2810 176.7946 78 R 3.7907 7.5605 119.2010 59.2931 30.2093 178.0403 79 L 4.0527 7.6162 117.6170 58.0839 41.7136 179.6059 80 V 3.6538 7.4039 116.5741 63.6868 31.4494 176.4292 81 G 3.7754 9.4219 105.8988 45.6919 0.0000 172.9065 82 G 4.0123 7.4865 105.1957 43.5034 0.0000 172.3349 83 P 4.3772 0.0000 0.0000 63.1436 31.6548 175.2428 84 L 5.3744 8.0834 119.0589 53.5865 46.0892 175.6813 85 R 4.8520 8.7369 115.5891 54.7132 33.1440 174.1743 86 Q 2.9968 8.8321 122.8617 56.0071 29.5271 175.8028 87 A 4.4656 7.7349 128.5834 51.7783 19.2797 177.6311 88 T 4.0918 9.4043 111.9372 60.4803 69.9003 173.8530 89 P 4.2059 0.0000 0.0000 65.9346 31.1678 178.8647 90 E 3.9510 8.0553 116.7324 59.5677 29.4346 179.1026 91 E 3.9924 8.1230 118.6208 59.1451 29.3767 179.5300 92 V 3.5591 7.9566 118.5702 65.9685 31.5854 178.0710 93 R 4.1551 7.6551 119.4855 59.0074 29.7349 178.3505 94 E 3.9433 7.8583 116.9764 59.3304 29.6157 179.1994 95 L 4.1223 8.2494 119.4773 58.0004 41.8174 179.4432 96 T 4.2352 8.3373 109.8118 62.5955 69.1076 176.3730 97 G 3.7365 8.3631 107.8482 44.6591 0.0000 172.5511 98 F 4.8470 8.3101 117.3058 55.3206 43.0581 173.7935 99 A 4.6611 8.3201 124.6909 50.1803 20.4691 177.0086 100 I 3.8447 8.1601 114.3866 62.8794 37.8255 176.5681 101 G 4.0291 10.0705 111.0266 45.5274 0.0000 174.6839 102 G 4.1630 8.1130 104.9914 44.7523 0.0000 172.4106 103 V 3.6838 7.8869 120.3982 62.3950 31.5335 173.9134 104 P 4.8008 0.0000 0.0000 60.4238 32.5392 174.0571 105 P 4.5293 0.0000 0.0000 63.6072 31.7577 175.7549 106 V 4.2744 6.9687 111.0805 61.1310 35.6348 174.1678 107 G 3.9064 8.6639 106.3374 47.1148 0.0000 173.8152 108 H 5.8171 7.8422 116.3420 54.0199 29.8632 176.2269 109 N 4.5453 8.1039 116.2724 56.2853 38.4251 176.3192 110 T 4.5818 7.2559 114.7886 61.2701 72.8456 171.6531 111 P 4.3627 0.0000 0.0000 62.6970 31.8867 175.6243 112 L 4.6096 8.1781 122.8514 52.0044 43.7234 174.4995 113 P 4.4053 0.0000 0.0000 63.0420 32.4338 175.1757 114 A 5.7712 8.2190 123.6667 49.3036 23.1865 174.2093 115 Y 4.9000 8.1610 115.6013 55.9794 42.2916 174.2255 116 L 5.1142 8.8205 125.6025 52.8232 45.0930 174.4335 117 D 4.8669 9.3745 126.9130 54.7183 41.6935 176.6165 118 E 4.2249 9.4327 126.9532 59.9338 29.2997 178.8522 119 D 4.4589 8.8910 119.5108 56.6173 40.6646 178.3018 120 L 4.4018 8.4401 120.1385 57.1335 41.4328 178.3649 121 L 4.4380 7.6810 117.0787 55.7100 41.6529 178.2494 122 G 3.5670 7.6323 104.9611 44.5610 0.0000 173.2604 123 Y 4.8915 6.9944 119.5333 55.3529 40.1161 175.2310 124 P 4.4050 0.0000 0.0000 65.3069 31.8989 176.4537 125 E 4.9329 7.9020 115.7777 54.6137 33.5490 175.1789 126 V 4.6830 9.1830 115.4908 59.4492 37.0014 174.3196 127 W 4.9502 9.1454 121.1316 54.9740 32.0702 175.1000 128 A 4.8840 7.8596 125.7834 49.4503 21.7076 175.3905 129 A 4.4021 8.4006 120.9696 51.7003 19.9164 178.4339 130 G 4.0086 9.1987 110.6004 45.7020 0.0000 175.6796 131 G 4.2913 9.3288 109.0592 44.7533 0.0000 173.8140 132 T 4.7876 7.4429 108.4617 59.3756 72.0363 172.2375 133 P 4.8495 0.0000 0.0000 63.2684 31.8331 177.3287 134 R 4.7948 8.7408 116.1687 54.6791 33.4991 174.2346 135 A 5.7378 7.8948 121.8501 50.0066 21.3561 176.2057 136 L 5.3189 8.3304 119.4583 53.7416 46.9357 174.5244 137 F 5.4190 8.6979 115.4994 54.6478 41.3287 173.5744 138 R 4.0346 8.2388 122.2658 55.4802 31.1089 174.6961 139 A 4.5517 8.1871 125.3850 51.5148 23.5004 175.7999 140 T 4.6494 8.6227 109.6410 60.3026 70.3911 174.4469 141 P 4.2278 0.0000 0.0000 65.6907 31.2279 179.0000 142 K 3.9330 8.0705 116.7718 59.7592 32.0421 179.0416 143 E 4.0413 8.3094 118.6466 59.2212 29.3815 179.1508 144 L 3.9320 8.0062 120.5579 57.9541 41.9547 179.1292 145 L 3.9104 8.3160 119.1908 57.7733 41.3896 179.3220 146 A 3.8689 8.0973 119.8284 55.1982 18.3975 179.4361 147 L 3.8478 8.1193 117.2058 56.9578 41.6791 178.6904 148 T 4.4897 7.5169 107.2023 60.0736 70.2573 174.8138 149 G 3.8179 8.9044 109.8151 46.2546 0.0000 173.6517 150 A 4.3750 7.4966 120.8707 51.4991 19.4251 177.6891 151 Q 4.5288 8.3310 117.9324 54.1015 30.8763 175.5266 152 V 4.2060 8.4263 122.8713 63.5874 32.3572 174.5474 153 A 4.5389 8.8364 126.7938 51.2201 23.4181 175.0436 154 D 4.8272 8.7438 119.6705 53.8558 40.8746 175.5392 155 L 4.7059 8.4762 126.3042 54.8442 44.5233 177.2034 156 K 4.6040 7.9960 117.5369 56.8259 32.8388 177.4285 157 E 4.3122 8.4149 122.2863 58.5832 30.2251 177.4402 158 G 3.7045 7.9398 112.0410 45.7265 0.0000 173.1328 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 3 L 8.17 4.47 0.00 1.68 1.71 1.00 0.67 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 4 S 9.62 4.21 0.00 4.07 4.10 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 5 P 0.00 4.18 0.00 2.18 2.15 0.00 3.63 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.21 0.00 6 S 8.19 4.21 0.00 3.99 4.39 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 7 A 7.72 4.97 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 8 R 8.55 3.86 0.00 1.94 2.19 0.00 3.12 0.00 0.00 3.10 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.65 0.00 9 R 8.70 3.98 0.00 1.92 2.31 0.00 3.09 0.00 0.00 2.89 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.74 0.00 10 V 7.90 3.60 2.35 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 0.84 0.00 0.00 0.93 0.00 0.00 11 Q 8.29 3.93 0.00 2.20 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.56 0.00 0.00 0.00 0.00 0.00 2.35 2.69 0.00 12 G 8.63 3.62 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 0.00 0.00 0.00 13 A 7.98 4.05 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 14 L 8.00 3.87 0.00 1.72 1.75 0.23 -0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 15 E 8.31 3.93 0.00 2.19 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 2.32 2.44 0.00 16 T 8.06 3.90 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 1.22 0.00 0.00 17 R 7.88 4.29 0.00 2.23 2.31 0.00 3.29 0.00 0.00 3.31 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.85 0.00 18 G 8.18 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 0.00 0.00 0.00 19 F 8.41 4.82 0.00 3.10 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 20 G 8.35 3.71 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 0.00 0.00 0.00 21 H 8.22 4.39 0.00 3.29 3.42 0.00 5.52 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 22 L 7.67 4.23 0.00 1.56 1.56 0.89 0.90 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 23 K 8.39 4.63 0.00 1.67 1.71 0.00 1.68 0.00 0.00 1.73 0.00 0.00 2.77 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.57 1.35 7.81 24 V 8.47 4.37 2.12 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 0.87 0.00 0.00 0.92 0.00 0.00 25 V 9.42 4.45 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 1.21 0.00 0.00 26 E 8.84 5.09 0.00 2.01 1.91 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 2.24 2.35 0.00 27 L 8.79 4.36 0.00 1.83 1.74 0.96 0.66 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 28 P 0.00 4.45 0.00 2.17 2.16 0.00 3.69 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.95 0.00 29 A 7.24 4.70 1.21 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 0.00 0.00 30 S 8.57 4.30 0.00 3.83 3.76 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 31 T 8.75 4.72 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 32 R 8.16 4.08 0.00 1.81 2.22 0.00 3.21 0.00 0.00 3.28 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.60 0.00 33 T 7.36 4.68 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 1.20 0.00 0.00 34 A 8.50 3.92 1.33 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 35 K 8.02 3.75 0.00 1.81 1.80 0.00 1.71 0.00 0.00 1.80 0.00 0.00 2.95 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.48 1.52 7.81 36 E 7.92 3.91 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 2.30 2.30 0.00 37 A 8.51 3.83 1.33 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 38 A 8.18 3.70 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 39 Q 7.91 3.78 0.00 2.09 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.74 0.00 0.00 0.00 0.00 0.00 2.29 2.32 0.00 40 A 7.91 4.00 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 41 V 6.84 3.79 0.71 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 -0.30 0.00 0.00 -0.14 0.00 0.00 42 G 7.41 3.71 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 0.00 0.00 0.00 43 A 7.55 4.56 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 44 E 8.17 4.28 0.00 1.91 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.31 0.00 45 V 8.50 3.53 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 0.79 0.00 0.00 0.96 0.00 0.00 46 G 7.87 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 47 Q 7.81 3.55 0.00 2.04 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.00 6.95 0.00 0.00 0.00 0.00 0.00 1.16 1.82 0.00 48 I 7.59 4.44 1.92 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.97 0.89 0.00 0.00 49 V 8.73 4.57 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 0.75 0.00 0.00 0.87 0.00 0.00 50 K 9.04 4.43 0.00 1.87 1.77 0.00 1.73 0.00 0.00 1.66 0.00 0.00 2.90 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.40 1.42 7.81 51 S 8.79 4.94 0.00 3.96 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 L 9.42 4.80 0.00 1.98 2.01 1.09 0.73 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 53 V 8.42 5.06 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 1.06 0.00 0.00 0.99 0.00 0.00 54 F 9.67 5.13 0.00 3.34 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 V 9.02 4.54 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 0.96 0.00 0.00 56 G 9.62 4.78 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 57 E 9.09 4.22 0.00 2.04 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 2.36 2.40 0.00 58 K 8.22 4.43 0.00 1.83 1.87 0.00 1.93 0.00 0.00 1.75 0.00 0.00 3.01 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.41 1.47 7.81 59 G 6.72 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 60 A 7.88 5.20 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 Y 9.17 4.92 0.00 3.10 2.78 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 62 L 9.02 5.14 0.00 1.80 1.64 1.06 0.88 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 63 F 9.74 5.12 0.00 3.21 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 64 L 9.33 5.07 0.00 1.60 1.66 0.92 0.63 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 65 V 8.56 4.68 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 1.02 0.00 0.00 66 S 9.12 4.64 0.00 4.07 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 67 G 8.90 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 68 K 8.01 4.26 0.00 1.91 1.99 0.00 1.61 0.00 0.00 1.87 0.00 0.00 3.11 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.46 1.51 7.81 69 N 7.91 5.02 0.00 2.83 2.75 0.00 0.00 6.74 7.28 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 70 R 8.06 4.60 0.00 1.91 1.75 0.00 3.24 0.00 0.00 3.27 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.63 0.00 71 L 8.57 4.23 0.00 1.60 1.48 0.53 0.21 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 72 D 9.27 4.49 0.00 2.65 2.48 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 73 L 8.56 3.71 0.00 1.69 1.56 0.78 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 74 G 7.95 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 75 K 8.54 3.84 0.00 1.80 1.76 0.00 1.70 0.00 0.00 1.78 0.00 0.00 2.91 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.39 1.56 7.81 76 A 7.75 3.67 0.33 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 77 T 7.84 3.68 4.33 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 1.19 0.00 0.00 78 R 7.56 3.79 0.00 1.76 2.04 0.00 3.24 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.63 0.00 79 L 7.62 4.05 0.00 1.45 1.21 0.75 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 80 V 7.40 3.65 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.38 0.00 0.00 0.28 0.00 0.00 81 G 9.42 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 82 G 7.49 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 0.00 0.00 0.00 83 P 0.00 4.38 0.00 2.26 2.22 0.00 3.77 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.15 0.00 84 L 8.08 5.37 0.00 1.48 1.68 0.85 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 85 R 8.74 4.85 0.00 1.87 2.03 0.00 2.80 0.00 0.00 3.13 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.61 0.00 86 Q 8.83 3.00 0.00 1.89 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 7.00 0.00 0.00 0.00 0.00 0.00 2.10 1.89 0.00 87 A 7.73 4.47 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 88 T 9.40 4.09 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 1.25 0.00 0.00 89 P 0.00 4.21 0.00 2.17 2.15 0.00 3.58 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.17 0.00 90 E 8.06 3.95 0.00 2.04 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 2.39 2.45 0.00 91 E 8.12 3.99 0.00 2.20 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 2.32 2.30 0.00 92 V 7.96 3.56 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 1.13 0.00 0.00 0.93 0.00 0.00 93 R 7.66 4.16 0.00 1.87 2.09 0.00 3.17 0.00 0.00 3.25 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.50 0.00 94 E 7.86 3.94 0.00 2.00 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 2.33 2.54 0.00 95 L 8.25 4.12 0.00 1.71 1.71 0.93 0.75 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 96 T 8.34 4.24 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 1.05 0.00 0.00 97 G 8.36 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 98 F 8.31 4.85 0.00 3.05 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 99 A 8.32 4.66 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 0.00 100 I 8.16 3.84 1.88 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 1.36 0.90 0.91 0.00 0.00 101 G 10.07 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 0.00 0.00 0.00 102 G 8.11 4.16 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 0.00 103 V 7.89 3.68 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 0.91 0.00 0.00 0.98 0.00 0.00 104 P 0.00 4.80 0.00 2.04 1.87 0.00 2.83 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.44 0.00 105 P 0.00 4.53 0.00 2.21 2.20 0.00 3.97 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.01 0.00 106 V 6.97 4.27 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 0.64 0.00 0.00 0.83 0.00 0.00 107 G 8.66 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 0.00 108 H 7.84 5.82 0.00 3.42 3.33 0.00 5.92 0.00 0.00 0.00 0.00 6.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 N 8.10 4.55 0.00 3.01 2.89 0.00 0.00 6.81 7.42 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 0.00 110 T 7.26 4.58 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 1.20 0.00 0.00 111 P 0.00 4.36 0.00 2.16 2.06 0.00 3.74 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.98 0.00 112 L 8.18 4.61 0.00 1.67 1.57 0.97 1.09 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 0.00 113 P 0.00 4.41 0.00 2.29 1.99 0.00 3.50 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.07 0.00 114 A 8.22 5.77 1.11 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 0.00 115 Y 8.16 4.90 0.00 2.64 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 0.00 116 L 8.82 5.11 0.00 1.69 1.52 0.93 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 117 D 9.37 4.87 0.00 2.89 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 0.00 118 E 9.43 4.22 0.00 2.22 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 2.32 2.38 0.00 119 D 8.89 4.46 0.00 2.93 2.81 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 0.00 120 L 8.44 4.40 0.00 1.80 1.80 1.01 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 121 L 7.68 4.44 0.00 1.84 1.70 0.94 0.92 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 0.00 122 G 7.63 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 0.00 123 Y 6.99 4.89 0.00 3.00 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 0.00 124 P 0.00 4.41 0.00 2.21 2.22 0.00 3.93 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 2.07 2.06 0.00 125 E 7.90 4.93 0.00 1.78 1.63 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 2.15 2.32 0.00 126 V 9.18 4.68 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 0.81 0.00 0.00 0.95 0.00 0.00 127 W 9.15 4.95 0.00 3.08 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 0.00 128 A 7.86 4.88 0.65 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 0.00 129 A 8.40 4.40 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 0.00 130 G 9.20 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 0.00 0.00 0.00 131 G 9.33 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 0.00 0.00 0.00 0.00 132 T 7.44 4.79 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 1.35 0.00 0.00 133 P 0.00 4.85 0.00 2.15 2.32 0.00 3.84 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 1.86 0.00 134 R 8.74 4.79 0.00 1.74 1.92 0.00 3.36 0.00 0.00 3.46 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.56 0.00 135 A 7.89 5.74 1.33 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 0.00 136 L 8.33 5.32 0.00 1.79 1.83 0.77 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 137 F 8.70 5.42 0.00 3.12 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 0.00 138 R 8.24 4.03 0.00 0.67 1.05 0.00 3.08 0.00 0.00 2.58 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.50 0.00 139 A 8.19 4.55 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 0.00 140 T 8.62 4.65 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 1.25 0.00 0.00 141 P 0.00 4.23 0.00 2.20 2.17 0.00 3.63 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.26 0.00 142 K 8.07 3.93 0.00 1.80 1.90 0.00 1.70 0.00 0.00 1.83 0.00 0.00 2.96 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.55 1.51 7.81 143 E 8.31 4.04 0.00 2.16 1.91 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 2.62 2.42 0.00 144 L 8.01 3.93 0.00 1.70 1.84 0.90 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 145 L 8.32 3.91 0.00 1.91 1.68 0.92 0.84 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 0.00 146 A 8.10 3.87 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 L 8.12 3.85 0.00 1.56 1.53 0.66 0.27 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 0.00 148 T 7.52 4.49 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 149 G 8.90 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 150 A 7.50 4.37 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 0.00 151 Q 8.33 4.53 0.00 2.07 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.93 0.00 0.00 0.00 0.00 0.00 1.76 2.37 0.00 152 V 8.43 4.21 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 0.80 0.00 0.00 0.94 0.00 0.00 153 A 8.84 4.54 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 0.00 154 D 8.74 4.83 0.00 2.68 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 0.00 155 L 8.48 4.71 0.00 1.64 1.63 1.15 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 156 K 8.00 4.60 0.00 1.75 1.82 0.00 1.58 0.00 0.00 1.96 0.00 0.00 2.94 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.40 1.66 7.81 157 E 8.41 4.31 0.00 1.85 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 2.29 2.30 0.00 158 G 7.94 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