NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 6 D 4.6501 8.4645 119.5575 52.2009 42.9020 177.3810 7 K 4.5332 7.4027 119.9414 52.4793 33.0844 172.7471 8 V 4.4691 7.8202 120.1649 61.2039 35.5372 174.6995 9 L 4.6013 8.5148 129.8741 53.6345 43.1378 175.4005 10 K 4.4860 8.6345 126.9081 55.4517 33.8046 175.8785 11 I 4.9654 8.3735 125.2436 59.5141 39.8997 174.4691 12 Q 4.5753 9.5752 129.3524 54.3550 31.1389 174.0020 13 L 4.8641 8.5011 126.6364 53.8885 42.3189 176.7019 14 R 4.4466 8.9740 123.7349 56.7650 31.1022 176.3143 15 S 4.4490 7.4788 112.0072 57.4300 64.9798 176.2066 16 A 4.1918 8.5864 122.9419 54.1003 18.1684 178.5152 17 S 4.3664 8.2509 111.6223 59.0350 63.4970 174.3159 18 A 4.6237 7.4971 122.9934 51.2301 18.9529 176.8905 19 T 4.4368 8.1201 116.7138 61.0490 71.2578 174.4474 20 V 3.5732 8.5246 125.6705 62.8511 31.8197 173.6723 21 P 5.3904 0.0000 0.0000 62.9237 32.0623 175.6638 22 T 4.8794 8.6362 111.9012 59.9020 72.2028 172.7777 23 K 4.2525 8.8797 124.8059 55.8543 32.3630 177.5045 24 G 3.7167 8.8197 114.0509 47.4081 0.0000 172.8395 25 S 4.4884 7.4179 112.7783 56.9459 65.8382 175.1428 26 A 3.9054 8.6633 123.5843 55.1642 18.0621 178.6882 27 T 4.3803 7.6231 102.3713 61.1110 68.3031 174.4709 28 A 3.9483 7.5015 125.6399 52.5051 18.9328 179.1020 29 A 4.0146 8.7800 125.2407 55.0150 18.4331 177.4054 30 G 4.2407 7.1488 96.7482 45.0986 0.0000 171.3808 31 Y 4.8846 8.5814 117.2306 55.7757 40.4461 175.7776 32 D 4.4932 9.4774 124.7307 54.9780 42.2737 175.3758 33 I 4.7178 8.5121 124.1059 59.8493 39.4339 174.0961 34 Y 5.2798 8.6019 124.1264 55.7518 40.0490 175.6074 35 A 4.4520 9.0840 126.4086 52.6830 19.4468 177.9130 36 S 4.8156 8.9065 115.1093 57.5948 64.0887 173.8815 37 Q 4.6412 7.6728 120.3170 54.8334 31.7438 173.5503 38 D 4.7311 8.6933 125.5211 55.2420 41.7870 175.4483 39 I 4.4211 8.6437 120.1956 60.4728 42.1240 172.9338 40 T 4.9753 8.4072 123.4002 61.8417 70.9053 173.7977 41 I 4.2832 8.5640 127.7652 59.4352 38.3831 173.7423 42 P 4.9001 0.0000 0.0000 61.8033 32.5749 176.0162 43 A 3.9921 8.8299 125.7258 54.5294 18.6631 177.2007 44 M 3.4830 8.1718 119.3695 54.9024 31.0123 177.2538 45 G 4.2723 7.7961 107.0742 45.6166 0.0000 171.9764 46 Q 5.1889 8.7635 118.2960 55.3767 32.0026 173.9398 47 G 4.2651 8.8639 106.1973 45.4828 0.0000 171.2540 48 M 5.1777 8.4591 119.1147 53.3247 34.5881 175.6417 49 V 4.2380 8.7454 124.5260 61.5519 33.3996 175.4760 50 S 4.8871 8.6926 123.9803 58.7800 63.5698 174.9115 51 T 4.5141 9.4050 111.0468 60.3688 70.5198 174.1326 52 D 4.2409 8.6060 120.9100 55.2208 38.6306 172.6203 53 I 5.2503 7.5292 110.2776 59.3996 41.4389 174.3073 54 S 4.9969 8.9170 118.7641 56.9765 67.0561 172.9303 55 F 5.3642 7.8761 115.1797 56.0648 41.2290 173.8319 56 T 4.6567 8.7893 117.2245 61.8986 70.2285 174.6874 57 V 4.1638 8.5892 119.8671 60.4007 32.7062 174.5650 58 P 4.5485 0.0000 0.0000 61.8788 32.8350 176.2656 59 V 3.4555 8.4028 120.8713 65.1352 31.7270 176.2967 60 G 3.9650 9.4199 114.2366 45.5442 0.0000 171.9357 61 T 6.0282 7.7571 108.6714 58.8087 72.4841 172.0451 62 Y 4.9949 8.2144 118.0778 55.4210 42.3709 174.1015 63 G 4.1923 9.5468 108.0406 44.9498 0.0000 172.7442 64 R 5.0370 8.6980 127.8769 55.1676 31.5970 175.4675 65 I 4.6774 8.9432 128.8823 60.9394 37.2494 175.1941 66 A 4.9106 9.0105 129.3798 49.0429 22.4551 173.5874 67 P 4.6127 0.0000 0.0000 62.1394 32.4545 177.0421 68 R 4.0090 8.4964 122.6297 56.2208 30.9663 177.8522 69 S 4.2046 8.9500 119.8685 61.7482 62.8655 177.0630 70 G 3.6209 7.9894 107.8181 47.6418 0.0000 175.6276 71 L 3.8542 7.8246 120.5396 57.1273 41.1925 179.2227 72 A 4.1857 7.6188 122.3779 54.7062 18.1739 179.8906 73 V 3.5481 7.4108 114.9492 65.8546 31.7140 177.6895 74 K 4.3265 8.1814 116.6653 57.2042 32.5703 177.1382 75 N 4.7885 7.7503 113.2199 51.8180 39.7943 174.3923 76 G 3.9506 7.6617 105.4403 46.4553 0.0000 172.9711 77 I 4.6047 7.4041 120.2103 59.8696 38.8801 174.6870 78 Q 4.8301 8.8870 128.5697 54.0014 31.9453 174.8409 79 T 4.4544 8.8339 116.5023 62.0805 69.8118 173.3434 80 G 4.3358 8.4267 110.2983 43.7539 0.0000 175.1071 81 A 3.6238 9.8551 123.7665 53.3676 18.2816 179.2834 82 G 3.9810 8.8373 105.3277 47.5212 0.0000 172.7864 83 V 4.4757 7.5992 119.5308 61.9860 31.6623 175.1696 84 V 4.1199 9.0108 129.7765 61.2116 32.7603 175.0527 85 D 4.8176 8.5725 128.2616 54.1786 41.5309 177.9082 86 R 4.0103 8.8996 121.7077 59.1062 30.3137 176.9715 87 D 4.7324 7.9962 114.6762 52.9931 39.7004 175.3369 88 Y 4.2936 7.9538 123.1339 58.0617 39.0034 175.6862 89 T 4.1697 7.8147 115.6991 61.0040 69.5717 174.2608 90 G 3.5598 5.3800 110.7429 43.8629 0.0000 172.8096 91 E 4.0183 8.3249 120.1582 56.0558 29.9936 176.0902 92 V 4.0985 8.7947 127.0569 62.3119 31.8334 175.1891 93 K 4.7996 8.6621 127.3616 54.8019 34.7438 176.0474 94 V 4.2158 8.5176 123.8667 61.3529 33.2801 174.8603 95 V 4.2659 8.2411 128.6252 62.3312 33.1035 174.4516 96 L 5.0983 8.6379 127.3193 52.9773 45.1626 175.4234 97 F 5.3256 9.2362 122.7097 55.9981 41.3519 174.3602 98 N 5.1752 9.1190 121.3241 52.3609 40.9502 173.9887 99 H 5.0875 9.0850 123.2225 55.6809 29.9443 175.1518 100 S 4.5821 8.4189 115.2174 57.6229 64.9716 174.7170 101 Q 4.3844 8.6247 116.9242 55.9870 28.8245 175.7479 102 R 4.7566 7.4344 117.6964 53.9407 32.3837 175.7833 103 D 4.7240 8.9119 123.5142 54.8301 41.8509 175.3866 104 F 5.0058 9.3516 125.3378 56.6601 41.3192 173.9774 105 A 4.7184 8.0321 127.8080 50.2411 20.6951 175.7604 106 I 4.3587 8.6260 123.5202 59.2615 40.4677 174.9368 107 K 4.9897 9.2726 125.9483 53.8559 35.1021 175.7452 108 K 3.9691 9.1410 124.0025 58.5658 32.3310 176.5979 109 G 4.1362 9.0573 114.9056 45.3665 0.0000 173.6270 110 D 4.7080 8.4008 120.1513 54.2567 42.2075 175.8484 111 R 4.4295 8.4984 120.8843 56.0883 30.4139 176.7200 112 V 4.5516 8.6590 115.4972 61.2119 34.3742 174.7408 113 A 4.5883 7.3896 120.6198 51.3790 22.7130 174.5320 114 Q 4.9373 8.8728 115.6521 54.5781 32.6706 174.1514 115 L 5.0289 9.1937 123.3126 53.7289 44.1525 174.9218 116 I 4.5277 8.5922 127.9831 59.5780 39.4604 175.6334 117 L 4.6180 8.5470 127.7217 54.3210 40.3799 174.7232 118 E 4.1209 8.4400 122.7980 55.5006 30.7322 176.0635 119 K 4.8183 8.6360 124.8566 56.3009 32.9495 176.2934 120 I 4.7719 8.5877 117.1513 59.1957 41.4158 175.0952 121 V 3.9645 8.4545 123.0328 62.2868 30.9768 175.2019 122 D 4.8890 8.6962 126.4356 53.1736 40.2545 176.2757 123 D 4.9274 7.7841 119.2890 52.9205 39.9952 176.3054 124 A 4.1861 8.0006 121.6090 53.1579 19.2048 177.6909 125 Q 4.3959 8.3526 119.6773 54.6933 29.8400 175.8713 126 I 4.0719 8.2453 124.3287 60.5470 38.0426 175.3589 127 V 4.3203 8.2277 124.4181 60.8486 33.7724 174.4927 128 V 4.1973 8.3385 126.6941 61.5057 32.4295 175.2310 129 V 4.5866 7.9573 119.5664 59.2921 34.9904 175.4919 130 D 4.5123 8.7835 122.6184 57.1029 40.9403 177.0117 131 S 4.6659 7.4834 110.1680 56.5090 65.4145 173.5244 132 L 4.2812 8.4971 124.2079 55.8574 41.9311 177.0716 133 E 4.2755 8.0300 123.8157 56.4089 30.0079 175.5541 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 6 D 8.46 4.65 0.00 2.71 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 7 K 7.40 4.53 0.00 1.80 1.61 0.00 1.71 0.00 0.00 1.67 0.00 0.00 2.83 0.00 0.00 2.60 0.00 0.00 0.00 0.00 1.27 1.06 7.81 8 V 7.82 4.47 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.93 0.00 0.00 9 L 8.51 4.60 0.00 1.49 1.37 0.65 -0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 10 K 8.63 4.49 0.00 1.81 1.73 0.00 1.68 0.00 0.00 1.66 0.00 0.00 2.82 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.42 1.42 7.81 11 I 8.37 4.97 1.87 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.80 0.96 0.00 0.00 12 Q 9.58 4.58 0.00 2.06 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.84 0.00 0.00 0.00 0.00 0.00 2.25 2.30 0.00 13 L 8.50 4.86 0.00 1.57 1.60 0.92 0.98 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 14 R 8.97 4.45 0.00 1.72 1.96 0.00 3.15 0.00 0.00 3.16 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.55 0.00 15 S 7.48 4.45 0.00 3.93 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 16 A 8.59 4.19 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 17 S 8.25 4.37 0.00 3.91 4.07 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 18 A 7.50 4.62 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 T 8.12 4.44 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 0.27 0.00 0.00 20 V 8.52 3.57 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 0.81 0.00 0.00 0.93 0.00 0.00 21 P 0.00 5.39 0.00 1.84 2.10 0.00 3.73 0.00 0.00 4.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 2.03 0.00 22 T 8.64 4.88 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 1.41 0.00 0.00 23 K 8.88 4.25 0.00 1.55 1.65 0.00 1.55 0.00 0.00 1.64 0.00 0.00 2.24 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.07 0.35 7.81 24 G 8.82 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 S 7.42 4.49 0.00 3.93 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 26 A 8.66 3.91 1.28 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 0.00 0.00 27 T 7.62 4.38 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 1.18 0.00 0.00 28 A 7.50 3.95 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 A 8.78 4.01 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 30 G 7.15 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 0.00 0.00 0.00 0.00 31 Y 8.58 4.88 0.00 2.86 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 32 D 9.48 4.49 0.00 2.40 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 0.00 0.00 0.00 33 I 8.51 4.72 1.97 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 1.29 0.86 0.99 0.00 0.00 34 Y 8.60 5.28 0.00 2.86 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 35 A 9.08 4.45 1.28 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 0.00 0.00 36 S 8.91 4.82 0.00 3.87 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 0.00 37 Q 7.67 4.64 0.00 2.05 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.98 0.00 0.00 0.00 0.00 0.00 2.25 2.39 0.00 38 D 8.69 4.73 0.00 2.58 2.56 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.64 4.42 1.86 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.92 0.90 0.00 0.00 40 T 8.41 4.98 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 1.22 0.00 0.00 41 I 8.56 4.28 2.05 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.25 1.01 0.00 0.00 42 P 0.00 4.90 0.00 2.10 1.99 0.00 3.76 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.11 0.00 43 A 8.83 3.99 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 44 M 8.17 3.48 0.00 2.20 2.16 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 2.57 2.71 0.00 45 G 7.80 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 46 Q 8.76 5.19 0.00 1.91 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.72 0.00 0.00 0.00 0.00 0.00 2.27 2.33 0.00 47 G 8.86 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 48 M 8.46 5.18 0.00 1.85 1.94 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.42 0.00 49 V 8.75 4.24 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 1.07 0.00 0.00 0.96 0.00 0.00 50 S 8.69 4.89 0.00 3.84 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 51 T 9.41 4.51 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 1.33 0.00 0.00 52 D 8.61 4.24 0.00 2.90 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 53 I 7.53 5.25 2.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.13 1.04 0.00 0.00 54 S 8.92 5.00 0.00 3.81 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 F 7.88 5.36 0.00 2.98 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 56 T 8.79 4.66 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 1.34 0.00 0.00 57 V 8.59 4.16 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 0.84 0.00 0.00 1.06 0.00 0.00 58 P 0.00 4.55 0.00 2.09 1.98 0.00 3.61 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 2.11 2.18 0.00 59 V 8.40 3.46 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 0.79 0.00 0.00 0.98 0.00 0.00 60 G 9.42 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 61 T 7.76 6.03 4.31 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 1.30 0.00 0.00 62 Y 8.21 4.99 0.00 3.20 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 63 G 9.55 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 R 8.70 5.04 0.00 1.59 1.73 0.00 3.22 0.00 0.00 3.33 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.81 0.00 65 I 8.94 4.68 1.94 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 1.30 0.82 0.96 0.00 0.00 66 A 9.01 4.91 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 67 P 0.00 4.61 0.00 1.94 1.99 0.00 3.69 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.22 0.00 68 R 8.50 4.01 0.00 1.80 1.83 0.00 3.26 0.00 0.00 3.27 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.64 0.00 69 S 8.95 4.20 0.00 3.84 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 70 G 7.99 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 71 L 7.82 3.85 0.00 1.55 1.36 0.96 0.92 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 72 A 7.62 4.19 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 73 V 7.41 3.55 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 0.85 0.00 0.00 0.96 0.00 0.00 74 K 8.18 4.33 0.00 1.89 1.84 0.00 1.70 0.00 0.00 1.71 0.00 0.00 3.01 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.42 1.45 7.81 75 N 7.75 4.79 0.00 2.28 2.42 0.00 0.00 6.98 7.51 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 76 G 7.66 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 77 I 7.40 4.60 1.60 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 -0.07 0.79 0.00 0.00 78 Q 8.89 4.83 0.00 2.23 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.97 0.00 0.00 0.00 0.00 0.00 2.39 2.49 0.00 79 T 8.83 4.45 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 1.26 0.00 0.00 80 G 8.43 4.34 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 0.00 81 A 9.86 3.62 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 82 G 8.84 3.98 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 0.00 0.00 0.00 83 V 7.60 4.48 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 0.41 0.00 0.00 0.85 0.00 0.00 84 V 9.01 4.12 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 0.72 0.00 0.00 1.04 0.00 0.00 85 D 8.57 4.82 0.00 2.78 2.63 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 86 R 8.90 4.01 0.00 1.87 2.04 0.00 3.45 0.00 0.00 3.33 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.83 0.00 87 D 8.00 4.73 0.00 2.85 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 88 Y 7.95 4.29 0.00 3.02 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 89 T 7.81 4.17 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 1.12 0.00 0.00 90 G 5.38 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.32 4.02 0.00 1.92 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 2.31 2.30 0.00 92 V 8.79 4.10 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 0.89 0.00 0.00 0.31 0.00 0.00 93 K 8.66 4.80 0.00 1.67 1.70 0.00 1.79 0.00 0.00 1.64 0.00 0.00 2.92 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.37 1.43 7.81 94 V 8.52 4.22 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 0.96 0.00 0.00 0.98 0.00 0.00 95 V 8.24 4.27 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 0.40 0.00 0.00 0.83 0.00 0.00 96 L 8.64 5.10 0.00 1.56 1.49 1.02 1.20 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 97 F 9.24 5.33 0.00 2.92 2.77 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 0.00 0.00 0.00 98 N 9.12 5.18 0.00 2.77 2.85 0.00 0.00 7.00 7.70 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 99 H 9.09 5.09 0.00 3.03 3.28 0.00 5.72 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 0.00 100 S 8.42 4.58 0.00 3.93 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 0.00 101 Q 8.62 4.38 0.00 2.08 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.72 0.00 0.00 0.00 0.00 0.00 2.33 2.32 0.00 102 R 7.43 4.76 0.00 1.67 1.87 0.00 3.21 0.00 0.00 3.25 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.59 0.00 103 D 8.91 4.72 0.00 2.59 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 0.00 104 F 9.35 5.01 0.00 3.00 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 0.00 105 A 8.03 4.72 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 0.00 106 I 8.63 4.36 1.90 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.07 0.89 0.00 0.00 107 K 9.27 4.99 0.00 1.74 1.74 0.00 1.69 0.00 0.00 1.53 0.00 0.00 2.71 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.30 1.47 7.81 108 K 9.14 3.97 0.00 1.66 1.77 0.00 1.76 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 1.47 1.55 7.81 109 G 9.06 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 0.00 0.00 0.00 0.00 110 D 8.40 4.71 0.00 2.68 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 R 8.50 4.43 0.00 1.63 1.67 0.00 3.15 0.00 0.00 3.16 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 1.57 0.00 112 V 8.66 4.55 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 0.74 0.00 0.00 1.03 0.00 0.00 113 A 7.39 4.59 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 0.00 114 Q 8.87 4.94 0.00 2.13 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.78 6.72 0.00 0.00 0.00 0.00 0.00 2.36 2.25 0.00 115 L 9.19 5.03 0.00 1.67 1.53 0.85 0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 116 I 8.59 4.53 1.78 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 1.32 0.42 0.88 0.00 0.00 117 L 8.55 4.62 0.00 1.54 1.62 1.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 118 E 8.44 4.12 0.00 1.16 1.70 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 2.12 1.94 0.00 119 K 8.64 4.82 0.00 1.65 1.76 0.00 1.69 0.00 0.00 1.76 0.00 0.00 2.97 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.45 1.44 7.81 120 I 8.59 4.77 1.96 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.74 1.19 0.00 0.00 121 V 8.45 3.96 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 0.86 0.00 0.00 0.95 0.00 0.00 122 D 8.70 4.89 0.00 2.83 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 0.00 123 D 7.78 4.93 0.00 2.78 2.77 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 0.00 0.00 0.00 124 A 8.00 4.19 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 0.00 125 Q 8.35 4.40 0.00 2.05 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.85 0.00 0.00 0.00 0.00 0.00 2.32 2.37 0.00 126 I 8.25 4.07 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.48 0.91 0.00 0.00 127 V 8.23 4.32 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 0.81 0.00 0.00 0.93 0.00 0.00 128 V 8.34 4.20 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 0.87 0.00 0.00 0.93 0.00 0.00 129 V 7.96 4.59 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 0.81 0.00 0.00 0.96 0.00 0.00 130 D 8.78 4.51 0.00 2.64 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 0.00 131 S 7.48 4.67 0.00 3.76 3.66 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 0.00 132 L 8.50 4.28 0.00 1.68 1.70 0.92 0.84 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 0.00 133 E 8.03 4.28 0.00 1.91 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.25 0.00