NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.8254 8.3544 109.7377 46.3357 0.0000 172.9598 2 S 3.5979 8.1487 114.0981 57.8324 61.5714 170.8636 3 M 4.7835 7.5717 112.9474 52.8240 31.8097 171.1028 4 P 4.4503 0.0000 0.0000 63.3674 33.5901 177.9422 5 R 3.9992 8.8074 115.1437 56.9819 29.0957 175.3239 6 V 4.8747 7.4093 108.3029 60.7268 35.8086 174.1260 7 V 4.5617 8.1642 114.2888 58.6753 34.3517 174.4669 8 P 4.3800 0.0000 0.0000 66.1130 32.0495 178.1223 9 D 4.7373 7.6855 120.8946 52.3045 37.4890 176.8552 10 Q 4.1359 7.9251 123.1712 59.1753 28.0144 178.4136 11 R 3.4284 7.8962 119.0538 59.1038 30.0862 178.6325 12 S 4.2707 7.9782 114.7905 61.4301 62.9272 176.2200 13 K 4.0686 8.4729 122.5863 59.3791 31.6665 178.1746 14 F 4.1422 8.4781 120.7013 61.4551 39.3157 176.4339 15 E 4.1034 7.3980 114.4463 56.9551 29.8657 177.8462 16 N 4.5646 7.9638 116.4676 54.7594 39.5774 175.5285 17 E 3.9243 8.1293 119.7891 57.0262 30.2726 178.3590 18 E 3.9485 8.8992 123.0931 59.2551 29.3030 179.1655 19 F 3.7560 8.4267 120.7538 61.4039 39.4229 177.2540 20 F 4.4706 7.5811 116.7497 60.7519 38.5586 177.8282 21 R 3.9058 7.8959 116.9216 59.0211 29.8646 178.9303 22 K 3.9546 7.7821 117.7909 59.2575 32.0425 179.0749 23 L 2.5621 7.0525 118.3878 55.7861 42.0318 178.2858 24 S 3.4307 8.1490 113.5617 57.8809 62.7889 170.9810 25 R 4.4280 8.2554 118.5732 54.8208 30.9586 174.6588 26 E 3.7063 8.2916 117.4380 56.3626 28.5798 175.5909 27 C 4.9498 8.8295 122.2204 57.6961 33.0858 172.6403 28 E 4.7236 8.5517 119.9654 55.9639 30.8614 175.2063 29 I 4.9178 8.4578 118.3893 59.3368 41.9337 173.8141 30 K 4.9451 8.6273 120.6326 54.6569 36.5455 175.7350 31 Y 4.1825 8.9044 125.0609 58.1914 39.7302 176.1785 32 T 4.4841 7.8649 114.8227 59.6443 69.5077 174.2280 33 G 3.8392 7.9527 124.9472 45.8120 0.0000 173.4124 34 F 4.1220 7.9289 116.3730 59.0375 37.8855 177.6436 35 R 3.8273 6.3622 117.0906 59.0284 28.8918 177.1601 36 D 4.4555 8.0123 116.9119 55.3628 40.7331 176.4790 37 R 4.1379 7.6154 119.1744 55.0666 30.6401 174.4753 38 P 4.4845 0.0000 0.0000 62.8921 31.8481 176.0218 39 H 4.0909 8.2393 116.2103 56.2426 28.9372 172.5610 40 E 4.6448 8.1295 125.1376 56.3399 26.9929 177.7275 41 E 4.2286 8.0145 119.3302 58.5510 30.1472 178.6337 42 R 4.0218 7.8588 115.5233 58.9505 28.8227 178.7914 43 Q 3.9914 7.9138 118.7578 59.3657 28.8644 178.5554 44 T 3.9173 7.8042 116.0628 66.7135 68.6352 176.5759 45 R 3.7345 8.1625 120.7625 59.2701 29.8810 178.0634 46 F 4.2062 8.4080 120.5654 61.6920 39.5897 177.2108 47 Q 3.5719 7.6643 115.6118 57.9344 28.4166 178.2256 48 N 4.2993 7.8183 118.0023 55.7845 37.1668 177.2411 49 A 3.7783 8.1735 122.5582 55.1170 18.1353 179.4869 50 C 3.8360 7.9457 114.7605 62.1879 28.6237 174.9258 51 R 4.0345 7.1029 118.2651 57.4361 30.3506 177.5656 52 D 4.3128 7.9874 118.1026 57.6812 42.2160 173.9517 53 G 4.0808 6.7491 104.2694 43.3683 0.0000 175.3844 54 R 4.5319 8.9870 123.0720 57.1333 30.2003 176.0651 55 S 4.6646 8.8247 112.1567 57.9268 66.1584 171.4400 56 E 4.9767 8.7842 118.1390 54.9506 32.8069 175.6687 57 I 4.4142 8.6656 126.4296 59.4343 42.0194 174.1060 58 A 5.3630 9.1404 126.3884 50.3506 23.0035 175.4521 59 F 4.5283 8.7652 118.1947 56.7524 41.4567 177.4431 60 V 3.9016 8.7450 118.3575 64.7604 32.4986 177.6624 61 A 4.1002 8.3849 121.0853 55.2491 18.1577 178.1945 62 T 4.2744 7.8495 108.7154 62.6624 70.2804 174.2708 63 G 3.9931 7.4866 107.7235 46.5533 0.0000 175.4604 64 T 4.3622 7.5709 116.6450 61.4634 69.5296 174.4566 65 N 4.8413 8.7012 125.8239 53.5358 39.5277 173.7855 66 L 5.0282 8.9516 125.9738 53.9336 44.7151 175.9364 67 S 4.7101 8.5814 116.5912 57.8452 63.2741 174.2683 68 L 3.7811 8.1675 125.2607 54.7125 42.8163 176.5859 69 Q 4.3127 7.6399 119.9556 53.6425 29.6136 175.4928 70 F 4.3189 8.2436 125.8309 56.3858 37.5254 176.2672 71 F 4.0742 7.5102 117.7035 54.3978 40.4668 173.6710 72 P 4.6612 0.0000 0.0000 61.5794 32.6187 176.2967 73 A 4.1865 8.5923 120.1804 55.1800 18.2610 177.5606 74 S 4.5654 7.9402 110.2664 56.8729 61.7126 173.6673 75 W 4.4962 8.9730 127.9148 57.0376 29.5152 175.0811 76 Q 4.3182 7.7098 117.9366 55.9121 30.8798 178.4301 77 G 4.2253 7.4497 106.9513 46.3749 0.0000 173.8828 78 E 4.1648 7.7909 119.6098 56.3695 28.9024 177.2064 79 Q 3.5443 8.3595 120.4005 57.2498 28.1812 170.5439 80 R 3.5514 7.4769 119.8283 56.4355 32.8349 172.6318 81 Q 4.2815 8.8084 120.9637 56.5633 27.5313 178.5048 82 T 4.4995 8.6231 118.0575 61.7756 69.5919 171.8068 83 P 4.3905 0.0000 0.0000 61.5664 34.2301 176.6884 84 S 4.5491 8.1904 114.4243 58.4878 64.9363 174.4572 85 R 4.0111 8.4720 120.8280 59.7122 29.4302 178.8061 86 E 3.8999 8.2162 118.7283 60.0074 29.5358 177.4708 87 Y 4.4734 7.6477 120.8116 57.9257 39.1436 175.3239 88 V 4.2066 7.5720 118.8774 62.2314 35.0764 172.1101 89 D 4.3200 8.8839 130.8926 54.0749 38.7090 172.8957 90 L 4.7249 7.6408 129.8220 54.9959 41.0785 179.3022 91 E 3.7249 9.2262 119.3362 56.9778 29.7047 173.8757 92 R 4.1898 7.8184 118.0961 56.4553 31.9880 174.7513 93 E 4.3842 8.8478 125.8910 54.7970 31.4088 175.7858 94 A 4.4453 8.4055 122.2303 53.5347 15.6309 177.0047 95 G 4.0397 8.5226 106.4537 45.3274 0.0000 170.6982 96 K 5.0332 7.7008 118.7740 55.1383 35.9855 174.7921 97 V 5.1613 8.7918 116.7838 60.7741 35.2333 173.7014 98 Y 5.2478 8.9579 118.1857 56.5048 40.5557 175.2798 99 L 5.2581 9.0952 121.6453 52.6874 47.1216 175.7832 100 K 4.8338 8.6070 117.1715 56.1246 35.0511 173.8752 101 A 4.1522 9.1058 131.1951 48.8005 21.5851 173.0465 102 P 4.7255 0.0000 0.0000 64.2914 31.8358 175.9729 103 M 4.6043 8.7637 123.2275 53.7532 35.1903 175.0387 104 I 4.8098 7.8617 120.4262 59.2264 37.0284 175.0786 105 L 3.9587 8.6365 124.8546 56.5013 42.0388 177.5143 106 N 4.4157 8.4203 125.3856 54.9259 40.1836 175.6765 107 G 4.4605 8.4178 107.6928 44.9012 0.0000 172.6797 108 V 4.7615 8.0682 119.4270 60.8736 34.3909 174.6519 109 C 4.7816 8.8407 126.7104 59.8206 26.9924 173.9137 110 V 3.9846 8.1402 117.9365 60.4350 33.8324 174.5059 111 I 4.6469 8.2782 122.8564 59.4158 39.3456 175.1545 112 W 5.0615 8.9859 135.0000 56.7281 32.0353 175.1283 113 K 5.1395 8.9964 125.5125 54.7506 36.3884 175.0988 114 G 3.9123 7.6233 107.3826 46.0380 0.0000 171.1680 115 W 5.0273 7.4335 116.9082 54.4243 30.7766 174.9272 116 I 4.6379 8.5303 124.9303 59.3314 38.4187 174.9289 117 D 4.7288 8.6843 128.0569 54.2165 41.6062 176.9047 118 L 4.2332 8.7379 125.3415 56.0676 41.9579 178.0942 119 H 4.3508 8.5546 115.4984 58.3139 28.3604 176.6726 120 R 4.3853 6.7163 113.9856 54.1058 32.1057 174.7312 121 L 3.3517 7.6383 117.2245 56.2664 38.8900 173.6010 122 D 5.3090 8.0714 116.2846 51.8699 45.0493 176.3243 123 G 4.2706 7.2568 107.1718 46.8744 0.0000 171.6981 124 M 4.6820 6.8988 121.9366 53.3917 36.1322 175.2606 125 G 3.6015 7.9102 108.1450 46.4473 0.0000 171.0212 126 C 5.1041 7.0606 113.0500 58.3985 33.6673 172.7884 127 L 5.2338 8.5549 118.5958 53.7091 43.9493 175.3367 128 E 4.9176 9.2729 121.0776 54.8687 33.9294 173.5383 129 F 4.0880 8.2243 122.7740 56.9548 41.0001 175.2612 130 D 4.5747 7.4371 125.2136 52.3760 39.9872 176.2521 131 E 4.2332 8.5007 124.6309 57.8657 29.8313 177.2700 132 E 4.0705 8.0403 118.8952 59.0246 30.2340 178.0747 133 R 3.8864 8.3177 117.9198 59.0729 30.0745 178.8581 134 A 3.9210 8.1063 121.0039 55.3080 18.3744 179.7297 135 Q 3.9847 7.6018 116.7315 59.1608 28.7070 178.8523 136 Q 3.9855 8.3453 120.9870 59.1428 29.2044 177.8269 137 E 3.9949 8.8437 120.7814 59.1830 29.4390 178.4229 138 D 4.3986 8.1023 118.2096 57.0807 41.0406 178.4034 139 A 4.1458 8.0290 121.2701 55.2008 18.3506 179.4774 140 L 4.1368 8.0572 114.9387 56.2894 41.6466 179.2304 141 A 4.2205 7.6992 120.0486 51.9929 19.7086 177.4821 142 Q 3.1615 7.9506 115.8657 58.5469 26.3885 174.1401 143 Q 4.1801 8.3374 121.6079 56.1953 29.0123 174.7513 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 3.83 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 2 S 8.15 3.60 0.00 4.08 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 3 M 7.57 4.78 0.00 2.10 2.01 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.47 0.00 4 P 0.00 4.45 0.00 2.24 2.25 0.00 3.80 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 1.94 0.00 5 R 8.81 4.00 0.00 2.04 2.07 0.00 3.36 0.00 0.00 3.34 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.65 0.00 6 V 7.41 4.87 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 1.09 0.00 0.00 7 V 8.16 4.56 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 0.96 0.00 0.00 1.12 0.00 0.00 8 P 0.00 4.38 0.00 2.18 2.15 0.00 3.54 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.13 0.00 9 D 7.69 4.74 0.00 2.75 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 10 Q 7.93 4.14 0.00 2.39 2.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.60 7.08 0.00 0.00 0.00 0.00 0.00 2.73 2.61 0.00 11 R 7.90 3.43 0.00 1.44 1.73 0.00 2.21 0.00 0.00 2.25 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.55 0.00 12 S 7.98 4.27 0.00 3.94 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 13 K 8.47 4.07 0.00 2.09 2.14 0.00 1.65 0.00 0.00 1.74 0.00 0.00 3.05 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.73 1.73 7.81 14 F 8.48 4.14 0.00 3.00 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 15 E 7.40 4.10 0.00 2.08 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 1.59 2.29 0.00 16 N 7.96 4.56 0.00 2.86 2.90 0.00 0.00 7.27 6.98 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 17 E 8.13 3.92 0.00 2.34 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.33 0.00 18 E 8.90 3.95 0.00 1.98 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 2.37 2.34 0.00 19 F 8.43 3.76 0.00 2.95 2.58 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 20 F 7.58 4.47 0.00 3.19 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 21 R 7.90 3.91 0.00 1.92 1.92 0.00 3.23 0.00 0.00 3.25 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.79 0.00 22 K 7.78 3.95 0.00 1.63 1.59 0.00 1.67 0.00 0.00 1.52 0.00 0.00 2.94 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.34 1.45 7.81 23 L 7.05 2.56 0.00 1.34 0.62 1.03 -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 0.00 0.00 0.00 0.00 24 S 8.15 3.43 0.00 3.95 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 25 R 8.26 4.43 0.00 1.82 1.87 0.00 3.29 0.00 0.00 3.29 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.56 0.00 26 E 8.29 3.71 0.00 1.96 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 2.28 2.38 0.00 27 C 8.83 4.95 0.00 2.96 2.92 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 28 E 8.55 4.72 0.00 2.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.36 0.00 29 I 8.46 4.92 1.68 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.60 -0.34 0.00 0.00 30 K 8.63 4.95 0.00 1.64 1.77 0.00 1.65 0.00 0.00 1.85 0.00 0.00 2.79 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.32 1.34 7.81 31 Y 8.90 4.18 0.00 3.11 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 32 T 7.86 4.48 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 1.19 0.00 0.00 33 G 7.95 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 34 F 7.93 4.12 0.00 3.38 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 R 6.36 3.83 0.00 1.72 1.63 0.00 3.02 0.00 0.00 3.25 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.75 0.00 36 D 8.01 4.46 0.00 2.77 2.75 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 37 R 7.62 4.14 0.00 1.90 1.91 0.00 3.36 0.00 0.00 3.30 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.80 0.00 38 P 0.00 4.48 0.00 2.19 2.07 0.00 3.78 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 1.99 2.00 0.00 39 H 8.24 4.09 0.00 3.16 3.30 0.00 5.88 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 E 8.13 4.64 0.00 2.01 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.07 0.00 41 E 8.01 4.23 0.00 2.07 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 2.34 2.34 0.00 42 R 7.86 4.02 0.00 2.07 2.21 0.00 3.14 0.00 0.00 3.34 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.36 0.00 43 Q 7.91 3.99 0.00 2.13 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.63 7.01 0.00 0.00 0.00 0.00 0.00 2.58 2.36 0.00 44 T 7.80 3.92 4.24 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 1.24 0.00 0.00 45 R 8.16 3.73 0.00 1.85 1.94 0.00 3.03 0.00 0.00 2.79 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.04 0.00 46 F 8.41 4.21 0.00 3.10 3.35 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 47 Q 7.66 3.57 0.00 2.09 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.53 6.72 0.00 0.00 0.00 0.00 0.00 2.22 1.91 0.00 48 N 7.82 4.30 0.00 2.71 2.69 0.00 0.00 6.61 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 49 A 8.17 3.78 0.69 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 0.00 0.00 50 C 7.95 3.84 0.00 2.63 2.47 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 51 R 7.10 4.03 0.00 1.92 1.91 0.00 3.04 0.00 0.00 3.17 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.45 0.00 52 D 7.99 4.31 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 53 G 6.75 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 54 R 8.99 4.53 0.00 2.22 2.23 0.00 3.18 0.00 0.00 3.28 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.94 0.00 55 S 8.82 4.66 0.00 4.16 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 56 E 8.78 4.98 0.00 2.02 1.83 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 2.36 2.46 0.00 57 I 8.67 4.41 1.26 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.07 0.85 0.00 0.00 58 A 9.14 5.36 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 F 8.77 4.53 0.00 3.14 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 V 8.74 3.90 2.20 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 0.98 0.00 0.00 0.88 0.00 0.00 61 A 8.38 4.10 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 62 T 7.85 4.27 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 1.12 0.00 0.00 63 G 7.49 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 64 T 7.57 4.36 4.14 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 0.87 0.00 0.00 65 N 8.70 4.84 0.00 2.74 2.78 0.00 0.00 7.02 8.32 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 66 L 8.95 5.03 0.00 1.90 2.02 1.40 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 67 S 8.58 4.71 0.00 3.73 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 68 L 8.17 3.78 0.00 1.22 0.77 -0.76 -0.25 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 69 Q 7.64 4.31 0.00 1.66 1.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.75 7.56 0.00 0.00 0.00 0.00 0.00 2.09 2.38 0.00 70 F 8.24 4.32 0.00 3.00 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 71 F 7.51 4.07 0.00 2.25 1.48 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 72 P 0.00 4.66 0.00 2.07 1.80 0.00 3.71 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 2.04 1.47 0.00 73 A 8.59 4.19 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 S 7.94 4.57 0.00 3.89 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 75 W 8.97 4.50 0.00 3.42 3.54 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 76 Q 7.71 4.32 0.00 1.87 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.57 5.55 0.00 0.00 0.00 0.00 0.00 2.42 2.35 0.00 77 G 7.45 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 0.00 0.00 0.00 0.00 78 E 7.79 4.16 0.00 2.11 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.22 0.00 79 Q 8.36 3.54 0.00 2.05 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 5.89 0.00 0.00 0.00 0.00 0.00 2.38 2.16 0.00 80 R 7.48 3.55 0.00 2.05 1.77 0.00 3.23 0.00 0.00 3.16 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.57 0.00 81 Q 8.81 4.28 0.00 1.99 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.99 0.00 0.00 0.00 0.00 0.00 2.25 2.30 0.00 82 T 8.62 4.50 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 1.17 0.00 0.00 83 P 0.00 4.39 0.00 1.77 1.55 0.00 3.70 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 2.10 1.91 0.00 84 S 8.19 4.55 0.00 4.05 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 85 R 8.47 4.01 0.00 1.93 1.96 0.00 3.19 0.00 0.00 3.26 7.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.76 0.00 86 E 8.22 3.90 0.00 2.14 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 2.57 2.66 0.00 87 Y 7.65 4.47 0.00 3.04 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 88 V 7.57 4.21 2.22 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 0.62 0.00 0.00 0.82 0.00 0.00 89 D 8.88 4.32 0.00 2.73 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 90 L 7.64 4.72 0.00 1.81 1.99 1.21 0.66 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 91 E 9.23 3.72 0.00 2.12 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 0.00 2.19 2.28 0.00 92 R 7.82 4.19 0.00 1.92 2.25 0.00 3.41 0.00 0.00 3.19 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.53 0.00 93 E 8.85 4.38 0.00 2.39 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 2.43 2.32 0.00 94 A 8.41 4.45 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 95 G 8.52 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 K 7.70 5.03 0.00 2.07 2.17 0.00 1.17 0.00 0.00 1.62 0.00 0.00 2.26 0.00 0.00 2.17 0.00 0.00 0.00 0.00 1.49 1.52 7.81 97 V 8.79 5.16 2.34 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 1.11 0.00 0.00 1.02 0.00 0.00 98 Y 8.96 5.25 0.00 2.96 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 99 L 9.10 5.26 0.00 2.08 2.05 1.31 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 100 K 8.61 4.83 0.00 2.05 1.68 0.00 1.69 0.00 0.00 1.88 0.00 0.00 2.98 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.40 1.40 7.81 101 A 9.11 4.15 0.16 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 0.00 102 P 0.00 4.73 0.00 2.07 2.23 0.00 3.53 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 2.05 2.14 0.00 103 M 8.76 4.60 0.00 2.05 2.11 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.68 0.00 104 I 7.86 4.81 1.96 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 1.39 1.66 0.99 0.00 0.00 105 L 8.64 3.96 0.00 1.97 1.41 0.26 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 106 N 8.42 4.42 0.00 2.71 2.99 0.00 0.00 7.44 7.96 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 0.00 107 G 8.42 4.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 V 8.07 4.76 2.23 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 1.26 0.00 0.00 1.26 0.00 0.00 109 C 8.84 4.78 0.00 2.67 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 0.00 110 V 8.14 3.98 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.02 0.00 0.00 1.01 0.00 0.00 111 I 8.28 4.65 1.82 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.65 0.93 0.00 0.00 112 W 8.99 5.06 0.00 3.44 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 9.00 5.14 0.00 1.79 1.85 0.00 1.44 0.00 0.00 1.67 0.00 0.00 2.84 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.19 1.11 7.81 114 G 7.62 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 0.00 115 W 7.43 5.03 0.00 2.67 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 0.00 0.00 0.00 0.00 116 I 8.53 4.64 2.36 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.32 0.71 0.00 0.00 117 D 8.68 4.73 0.00 2.87 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 0.00 118 L 8.74 4.23 0.00 1.78 1.74 1.02 1.42 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 0.00 119 H 8.55 4.35 0.00 3.24 3.56 0.00 5.69 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 0.00 120 R 6.72 4.39 0.00 1.42 1.78 0.00 3.29 0.00 0.00 3.04 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.40 0.00 121 L 7.64 3.35 0.00 1.58 1.42 -0.05 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 122 D 8.07 5.31 0.00 2.77 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 0.00 123 G 7.26 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 0.00 0.00 0.00 124 M 6.90 4.68 0.00 0.71 0.57 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.19 0.00 125 G 7.91 3.60 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 0.00 0.00 0.00 126 C 7.06 5.10 0.00 3.08 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 0.00 127 L 8.55 5.23 0.00 1.74 1.83 1.23 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 128 E 9.27 4.92 0.00 1.99 1.72 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 2.22 2.31 0.00 129 F 8.22 4.09 0.00 1.89 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 0.00 130 D 7.44 4.57 0.00 2.51 2.27 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 0.00 131 E 8.50 4.23 0.00 2.29 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 2.49 2.61 0.00 132 E 8.04 4.07 0.00 2.08 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 0.00 2.34 2.40 0.00 133 R 8.32 3.89 0.00 1.96 1.89 0.00 3.26 0.00 0.00 3.49 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.73 0.00 134 A 8.11 3.92 1.15 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 0.00 0.00 135 Q 7.60 3.98 0.00 2.37 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.79 0.00 0.00 0.00 0.00 0.00 2.43 2.58 0.00 136 Q 8.35 3.99 0.00 2.20 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.86 0.00 0.00 0.00 0.00 0.00 2.39 2.38 0.00 137 E 8.84 3.99 0.00 2.26 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 2.35 2.42 0.00 138 D 8.10 4.40 0.00 3.01 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 0.00 139 A 8.03 4.15 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 0.00 140 L 8.06 4.14 0.00 1.85 1.72 0.97 0.76 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 0.00 141 A 7.70 4.22 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 0.00 142 Q 7.95 3.16 0.00 2.11 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.81 0.00 0.00 0.00 0.00 0.00 2.27 2.37 0.00 143 Q 8.34 4.18 0.00 2.09 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.59 6.57 0.00 0.00 0.00 0.00 0.00 2.31 2.29 0.00