NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 T 4.2586 8.1749 117.3708 63.3256 69.8348 172.9122 4 I 4.3395 8.0868 126.4509 58.7575 39.1289 173.7907 5 N 4.4832 9.9459 126.0502 52.2852 39.8689 173.6220 6 P 4.4590 0.0000 0.0000 62.5832 32.1987 175.6001 7 T 4.3927 7.8614 109.9637 59.8529 70.9516 175.2173 8 N 4.5657 8.1322 123.4156 52.5085 37.0984 174.7880 9 Y 4.2025 7.9058 123.2236 60.6924 37.8281 177.8216 10 T 3.9184 7.9484 116.2695 66.8838 68.6866 176.4433 11 L 3.9034 7.8701 120.1998 57.4356 41.7175 178.9916 12 L 4.1671 8.0191 120.5076 58.1866 42.1065 179.2313 13 K 4.1177 8.4328 118.6151 59.3779 31.7201 179.5214 14 K 4.0652 7.3816 117.8323 59.3502 32.2087 179.1893 15 Q 4.1179 8.2518 118.1854 58.8856 28.7030 178.3767 16 A 3.9984 8.4458 122.0050 55.4229 18.3616 179.4245 17 A 4.0152 7.9888 118.8023 55.2611 18.0836 179.7588 18 S 4.3403 8.2570 112.2124 60.4355 63.4154 175.5999 19 L 4.5626 7.4321 120.5116 54.4547 41.9576 176.7548 20 I 4.3210 7.2943 120.1283 62.4065 39.9518 175.6663 21 E 4.1533 8.3242 120.5655 57.7593 29.6718 176.5331 22 D 4.5103 8.7308 123.2854 54.7420 38.9196 173.1771 23 E 4.6409 7.6946 118.5366 55.2115 30.9233 175.5613 24 H 4.6594 8.6350 117.4240 55.2353 30.7185 173.9585 25 H 4.5772 7.9045 118.4006 54.4121 28.9789 174.9672 26 M 3.9223 8.5326 126.3436 58.9243 32.0015 177.9911 27 I 3.6208 7.7469 118.9239 64.2663 37.2628 178.1563 28 A 3.9376 7.8817 121.1844 55.0451 18.2005 179.5875 29 I 3.5957 7.7517 118.3008 64.5911 37.2260 178.7387 30 L 3.4453 8.0261 120.1333 57.4820 41.2039 179.8287 31 S 4.0811 8.2460 115.3822 61.8144 62.7639 176.5222 32 N 4.3570 8.2279 119.1089 56.5915 38.1717 177.4701 33 M 4.1423 8.4190 120.6692 58.2838 32.0495 178.8910 34 S 4.1346 8.4948 114.3956 61.3369 63.0213 176.5763 35 A 3.9070 7.8399 124.0933 54.6818 17.9417 179.2202 36 L 3.8738 7.9045 117.8418 58.4312 42.5048 178.9183 37 L 4.1536 8.1271 118.9154 57.8651 41.3425 179.0251 38 N 4.3171 8.0186 115.8683 56.7660 38.9782 176.2454 39 D 4.5673 8.2428 118.6367 55.8075 41.0623 176.5577 40 N 4.9020 7.8039 114.4562 52.4093 39.9805 173.8301 41 L 4.6066 7.7515 118.7679 52.8055 43.7868 175.7505 42 D 4.5504 8.5269 123.0020 53.8712 42.6417 174.7632 43 Q 3.4614 8.5606 120.8567 57.1536 27.2451 173.0354 44 I 4.8869 7.5072 108.0671 59.1950 40.9915 174.5847 45 N 5.1111 8.8411 117.3746 52.3431 38.6939 174.0401 46 W 5.1337 8.0086 128.3646 56.7031 34.6032 173.3407 47 V 4.8498 7.7219 126.5591 60.9731 34.5070 174.1788 48 G 3.5311 8.0790 111.0839 46.0823 0.0000 171.7143 49 F 5.7124 8.6817 117.5003 55.9710 43.4516 173.9863 50 Y 5.1033 8.9569 117.6932 56.2851 41.7565 174.5273 51 L 5.1797 9.1212 123.0970 52.7853 44.9300 175.7547 52 L 4.7614 8.5568 124.0390 54.6731 42.3254 176.6826 53 E 4.6130 9.4009 123.5730 56.2004 33.5759 175.6008 54 Q 3.1303 9.7151 121.3867 57.0632 26.5736 172.9512 55 N 4.2590 8.5839 109.4791 53.9095 37.5656 172.7342 56 E 4.8167 7.9319 111.8159 54.8241 33.7212 173.8999 57 L 4.8721 8.9950 122.0397 54.4322 43.4766 175.8512 58 I 5.0154 8.8667 124.4716 58.9349 40.1664 174.8791 59 L 3.2078 8.8258 129.5962 55.8868 42.3719 176.4906 60 G 4.5209 8.2411 113.8066 44.0672 0.0000 170.3929 61 P 4.5903 0.0000 0.0000 63.4137 32.4420 175.5879 62 F 4.8730 7.6518 116.0967 56.2556 40.8049 172.9084 63 Q 4.2262 9.9202 118.8661 53.5148 31.1270 176.6234 64 G 3.9557 8.1577 111.8568 45.4174 0.0000 171.6402 65 H 4.8781 8.4862 117.7635 54.1792 29.8643 173.3420 66 P 4.5499 0.0000 0.0000 63.4119 31.5786 175.5029 67 A 4.6862 8.0562 122.5428 49.9109 22.4161 176.4174 68 C 4.4843 8.3869 116.7967 57.3974 41.4745 174.6446 69 V 3.8544 8.6049 123.7094 65.4896 32.5274 175.1831 70 H 5.4044 8.2656 116.6254 54.0814 30.7472 174.3736 71 I 4.4846 8.6320 123.7284 58.6827 40.4316 173.4576 72 P 4.6895 0.0000 0.0000 62.0414 32.6267 176.3848 73 I 3.8589 8.2017 124.0615 62.9049 37.4980 176.8740 74 G 4.0103 9.0098 113.5742 45.0118 0.0000 173.4216 75 K 4.4694 7.7367 119.1651 55.3368 35.0373 176.9216 76 G 4.0940 8.7536 110.6542 45.0933 0.0000 175.0986 77 V 3.0271 8.2650 117.1138 65.9495 31.1130 177.7152 78 C 4.1079 7.7602 116.0955 62.7721 27.9514 176.2425 79 G 4.0940 7.7373 108.0965 47.5311 0.0000 175.7593 80 T 4.1258 8.4023 119.0334 65.6130 68.5268 176.7914 81 A 4.0206 7.8170 122.9451 54.9361 18.1394 180.1062 82 V 3.5393 7.2935 116.9740 65.0455 31.8050 178.0783 83 S 4.2549 8.0070 114.1399 60.6150 61.8170 175.6133 84 E 4.0869 8.6416 120.0380 56.5944 29.5628 177.2251 85 R 4.1393 7.7140 116.1848 56.3468 28.2622 175.9390 86 R 4.7853 7.3583 110.0476 54.7278 32.4791 174.6409 87 T 4.2235 8.4898 116.0102 64.3977 69.4018 173.4551 88 Q 4.6036 9.0305 124.6270 54.1702 31.3802 174.7290 89 V 4.4607 8.5716 124.6544 61.3007 33.2619 174.7695 90 V 4.3713 8.8272 129.7710 61.2448 32.6343 176.2320 91 A 4.1024 8.8356 130.7541 54.4926 19.9686 175.8667 92 D 4.8030 8.0394 114.5682 52.4356 42.3395 175.1006 93 V 3.5820 8.8788 127.4338 66.0432 31.6817 177.9492 94 H 4.0085 8.0297 117.9526 58.3752 29.7211 175.5618 95 Q 4.4666 8.1304 116.5208 55.3601 29.1680 174.8839 96 F 4.2666 8.2974 122.9273 56.7762 39.5612 174.4692 97 K 3.8017 7.9291 129.8459 59.9382 31.8935 176.2568 98 G 4.1087 8.9063 114.7113 45.2593 0.0000 172.4746 99 H 4.8246 8.1757 115.5564 55.4231 29.1690 174.2988 100 I 4.6106 8.8746 113.8924 58.4376 40.7760 176.1208 101 A 3.9783 8.5462 122.1932 55.6101 18.0955 180.4318 102 C 4.3327 8.0884 111.5041 59.3401 41.5274 174.0169 103 D 4.3394 8.2260 118.8967 53.7760 41.0358 177.8450 104 A 3.9005 7.7955 123.5520 55.4630 18.2030 178.3792 105 N 4.5721 7.9912 109.9360 53.9825 39.2820 174.2812 106 S 4.7166 7.8391 114.1348 57.8322 64.3110 174.0116 107 K 4.4322 9.1025 125.8818 58.3439 33.3998 176.9513 108 S 5.1089 7.6836 112.2258 57.1487 67.0916 172.4611 109 E 5.3328 8.9471 119.3137 55.7294 33.7362 173.7824 110 I 4.9158 8.1013 123.4549 59.0982 41.6819 174.0145 111 V 4.7704 8.6363 128.3477 61.0784 34.6446 173.9610 112 V 4.6032 8.5818 128.2609 60.4093 33.5290 173.1740 113 P 4.8091 0.0000 0.0000 62.6340 32.3768 175.6226 114 I 4.7467 8.6525 124.1789 59.7454 39.4448 174.8661 115 F 5.4020 9.8412 125.8741 55.9007 42.0812 175.7545 116 K 4.3429 9.2783 122.5060 56.4811 34.5991 175.8365 117 D 4.3506 9.4899 127.6544 55.8677 38.0906 174.1564 118 D 4.5971 8.5798 114.2016 54.6347 38.8586 173.6694 119 K 4.6363 7.8551 120.8971 54.3054 34.2503 175.2362 120 I 3.8360 8.2296 127.1453 61.0038 37.4924 175.7821 121 I 4.2562 9.0024 118.6437 59.7693 38.7607 175.8013 122 G 4.2955 6.8381 107.6741 46.4933 0.0000 171.2795 123 V 5.0034 7.9346 110.9650 59.9151 36.7933 173.9121 124 L 4.7228 8.9608 125.3809 53.5420 43.9994 174.5739 125 D 5.2859 9.1248 126.1047 52.5046 44.4663 174.3110 126 I 5.1266 8.6467 125.9638 59.8151 40.6123 174.2073 127 D 5.6606 9.6677 127.0475 52.5968 43.9276 175.3279 128 A 5.1982 8.9236 122.3996 49.6255 22.4910 175.1999 129 P 4.5425 0.0000 0.0000 63.1530 32.1024 175.8247 130 I 4.6563 7.1703 111.6173 59.0485 40.6099 174.9123 131 T 4.2727 8.2639 111.3396 61.5744 69.7245 173.2887 132 D 4.4221 8.6552 119.2081 55.3688 39.1091 175.8750 133 R 3.7735 7.8671 119.8762 58.2814 30.3956 176.3018 134 F 5.2080 7.8064 115.0943 55.5646 41.2493 174.1311 135 D 5.1761 8.9568 123.1350 50.9312 42.4109 176.1381 136 D 4.3924 8.6962 117.4944 57.6423 40.5002 178.5664 137 N 4.2668 8.2300 117.0866 56.7742 39.0424 176.4798 138 D 4.2809 8.8314 120.6803 57.1461 40.9232 178.6358 139 K 3.8279 8.1642 120.0758 59.4660 32.3381 178.3502 140 E 3.8270 8.2252 119.5493 59.7479 29.5822 178.5946 141 H 4.0853 7.7821 116.1397 58.7083 28.6020 177.8865 142 L 4.0582 8.0617 121.2597 57.7412 41.4263 179.4040 143 E 3.9906 8.3987 118.5262 59.1602 29.3402 179.2173 144 A 4.0281 7.8149 120.6961 55.1775 18.5568 179.7801 145 I 3.7489 7.8141 118.4417 64.4971 37.1051 178.8523 146 V 3.7230 8.0960 119.2833 65.8000 31.3520 177.9708 147 K 4.1780 8.1707 119.5272 59.5697 31.6022 178.8800 148 I 3.7803 7.6140 119.7726 64.2767 36.9696 178.5115 149 I 3.7413 7.6533 120.2930 64.3952 36.9240 178.1846 150 E 4.0061 8.5824 119.8409 59.5746 29.0897 179.6829 151 K 3.9818 7.9476 117.3020 59.4691 32.1406 178.9006 152 Q 4.0766 7.6467 118.7221 58.7720 29.0717 177.5200 153 L 4.2075 7.8350 118.4932 56.2580 41.9480 177.2180 154 A 4.3119 7.9495 125.1699 52.6179 18.5030 176.8981 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 T 8.17 4.26 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 4 I 8.09 4.34 1.83 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 1.34 0.68 0.84 0.00 0.00 5 N 9.95 4.48 0.00 2.66 2.72 0.00 0.00 7.10 8.61 0.00 0.00 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 P 0.00 4.46 0.00 2.01 1.97 0.00 3.60 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 2.01 2.06 0.00 7 T 7.86 4.39 3.65 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 1.06 0.00 0.00 8 N 8.13 4.57 0.00 2.76 2.69 0.00 0.00 7.20 7.56 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 9 Y 7.91 4.20 0.00 2.73 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 10 T 7.95 3.92 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 1.25 0.00 0.00 11 L 7.87 3.90 0.00 1.68 1.71 0.93 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 12 L 8.02 4.17 0.00 1.87 1.92 0.96 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 13 K 8.43 4.12 0.00 2.04 1.89 0.00 1.77 0.00 0.00 1.72 0.00 0.00 3.04 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.54 1.82 7.81 14 K 7.38 4.07 0.00 1.72 1.88 0.00 1.62 0.00 0.00 1.91 0.00 0.00 3.13 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.49 1.53 7.81 15 Q 8.25 4.12 0.00 2.31 2.16 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 2.38 2.54 0.00 16 A 8.45 4.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 A 7.99 4.02 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 S 8.26 4.34 0.00 4.00 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 19 L 7.43 4.56 0.00 1.67 1.71 0.96 0.78 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 20 I 7.29 4.32 1.90 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 1.30 0.93 0.00 0.00 21 E 8.32 4.15 0.00 2.04 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.29 0.00 22 D 8.73 4.51 0.00 2.88 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 23 E 7.69 4.64 0.00 2.05 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 2.46 2.38 0.00 24 H 8.64 4.66 0.00 2.99 3.23 0.00 5.88 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 H 7.90 4.58 0.00 3.22 3.25 0.00 5.83 0.00 0.00 0.00 0.00 6.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 M 8.53 3.92 0.00 2.04 2.03 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 2.57 2.54 0.00 27 I 7.75 3.62 1.84 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 1.55 0.79 0.87 0.00 0.00 28 A 7.88 3.94 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 29 I 7.75 3.60 1.93 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.74 0.82 0.00 0.00 30 L 8.03 3.45 0.00 1.68 1.40 0.29 0.57 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 31 S 8.25 4.08 0.00 3.92 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 32 N 8.23 4.36 0.00 2.84 2.85 0.00 0.00 7.12 7.27 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 33 M 8.42 4.14 0.00 2.26 2.27 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.82 0.00 34 S 8.49 4.13 0.00 4.15 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 0.00 35 A 7.84 3.91 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 36 L 7.90 3.87 0.00 1.63 1.90 0.93 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 37 L 8.13 4.15 0.00 1.70 1.72 1.01 0.63 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 38 N 8.02 4.32 0.00 2.78 2.94 0.00 0.00 7.31 7.79 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 39 D 8.24 4.57 0.00 2.81 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 40 N 7.80 4.90 0.00 2.66 2.71 0.00 0.00 6.79 7.86 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 41 L 7.75 4.61 0.00 1.70 1.64 1.06 1.12 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 42 D 8.53 4.55 0.00 2.58 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 43 Q 8.56 3.46 0.00 2.12 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.56 0.00 0.00 0.00 0.00 0.00 2.18 2.32 0.00 44 I 7.51 4.89 2.15 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 1.67 0.90 1.07 0.00 0.00 45 N 8.84 5.11 0.00 2.78 2.98 0.00 0.00 6.67 9.28 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 46 W 8.01 5.13 0.00 3.39 3.16 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 47 V 7.72 4.85 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 0.69 0.00 0.00 0.82 0.00 0.00 48 G 8.08 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 49 F 8.68 5.71 0.00 2.95 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 50 Y 8.96 5.10 0.00 3.02 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 L 9.12 5.18 0.00 1.61 1.57 0.98 0.59 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 52 L 8.56 4.76 0.00 1.66 1.62 0.95 1.04 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 53 E 9.40 4.61 0.00 1.96 1.80 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 2.24 2.29 0.00 54 Q 9.72 3.13 0.00 2.14 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.85 0.00 0.00 0.00 0.00 0.00 2.30 2.40 0.00 55 N 8.58 4.26 0.00 2.83 2.89 0.00 0.00 7.04 7.65 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 56 E 7.93 4.82 0.00 2.10 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 2.49 2.35 0.00 57 L 9.00 4.87 0.00 1.69 1.71 0.80 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 58 I 8.87 5.02 2.12 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 1.17 0.97 0.91 0.00 0.00 59 L 8.83 3.21 0.00 1.62 1.55 0.52 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 60 G 8.24 4.52 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 61 P 0.00 4.59 0.00 2.13 1.94 0.00 3.69 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.07 0.00 62 F 7.65 4.87 0.00 1.56 2.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 Q 9.92 4.23 0.00 1.74 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.93 0.00 0.00 0.00 0.00 0.00 2.11 2.40 0.00 64 G 8.16 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 65 H 8.49 4.88 0.00 3.33 3.35 0.00 5.75 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 P 0.00 4.55 0.00 2.13 2.14 0.00 3.78 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 2.15 2.29 0.00 67 A 8.06 4.69 0.82 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 68 C 8.39 4.48 0.00 2.96 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 69 V 8.60 3.85 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 0.94 0.00 0.00 0.98 0.00 0.00 70 H 8.27 5.40 0.00 3.04 3.37 0.00 5.89 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 I 8.63 4.48 1.59 0.00 0.00 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 1.00 0.33 0.71 0.00 0.00 72 P 0.00 4.69 0.00 2.05 1.95 0.00 3.56 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 2.09 2.11 0.00 73 I 8.20 3.86 1.86 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 1.33 0.56 0.90 0.00 0.00 74 G 9.01 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 75 K 7.74 4.47 0.00 1.90 1.66 0.00 1.73 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.33 1.32 7.81 76 G 8.75 4.09 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 0.00 0.00 0.00 77 V 8.26 3.03 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 0.57 0.00 0.00 0.38 0.00 0.00 78 C 7.76 4.11 0.00 2.64 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 79 G 7.74 4.09 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 0.00 0.00 0.00 80 T 8.40 4.13 4.64 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 1.36 0.00 0.00 81 A 7.82 4.02 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 82 V 7.29 3.54 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 0.81 0.00 0.00 0.89 0.00 0.00 83 S 8.01 4.25 0.00 4.03 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 84 E 8.64 4.09 0.00 2.13 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 2.46 2.47 0.00 85 R 7.71 4.14 0.00 2.07 2.21 0.00 3.23 0.00 0.00 3.35 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.60 0.00 86 R 7.36 4.79 0.00 1.92 1.91 0.00 3.11 0.00 0.00 3.26 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.64 0.00 87 T 8.49 4.22 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 1.22 0.00 0.00 88 Q 9.03 4.60 0.00 1.87 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.75 0.00 0.00 0.00 0.00 0.00 2.42 2.43 0.00 89 V 8.57 4.46 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 0.94 0.00 0.00 90 V 8.83 4.37 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 0.65 0.00 0.00 91 A 8.84 4.10 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 92 D 8.04 4.80 0.00 2.70 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 93 V 8.88 3.58 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 0.78 0.00 0.00 0.93 0.00 0.00 94 H 8.03 4.01 0.00 3.06 3.49 0.00 5.97 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 Q 8.13 4.47 0.00 2.20 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.63 0.00 0.00 0.00 0.00 0.00 2.50 2.45 0.00 96 F 8.30 4.27 0.00 3.05 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 97 K 7.93 3.80 0.00 1.52 1.35 0.00 1.60 0.00 0.00 1.60 0.00 0.00 3.02 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.27 1.33 7.81 98 G 8.91 4.11 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 0.00 99 H 8.18 4.82 0.00 3.30 3.65 0.00 5.70 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 I 8.87 4.61 1.85 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.21 0.95 0.00 0.00 101 A 8.55 3.98 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 0.00 102 C 8.09 4.33 0.00 2.87 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 0.00 103 D 8.23 4.34 0.00 2.78 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 0.00 104 A 7.80 3.90 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 0.00 105 N 7.99 4.57 0.00 2.65 2.78 0.00 0.00 6.89 7.63 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 0.00 106 S 7.84 4.72 0.00 3.91 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 K 9.10 4.43 0.00 1.92 1.84 0.00 1.61 0.00 0.00 1.68 0.00 0.00 2.86 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.42 1.66 7.81 108 S 7.68 5.11 0.00 4.09 4.13 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 0.00 109 E 8.95 5.33 0.00 2.02 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 2.01 2.44 0.00 110 I 8.10 4.92 1.14 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 0.89 1.31 -0.19 0.00 0.00 111 V 8.64 4.77 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 0.96 0.00 0.00 0.85 0.00 0.00 112 V 8.58 4.60 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 0.89 0.00 0.00 113 P 0.00 4.81 0.00 1.99 1.76 0.00 3.80 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.12 0.00 114 I 8.65 4.75 1.90 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.05 0.97 0.00 0.00 115 F 9.84 5.40 0.00 2.78 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 0.00 116 K 9.28 4.34 0.00 1.75 1.65 0.00 1.80 0.00 0.00 1.66 0.00 0.00 2.92 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.37 1.44 7.81 117 D 9.49 4.35 0.00 2.90 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 0.00 118 D 8.58 4.60 0.00 2.89 2.85 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 0.00 119 K 7.86 4.64 0.00 1.81 1.87 0.00 1.64 0.00 0.00 1.66 0.00 0.00 2.94 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.32 1.37 7.81 120 I 8.23 3.84 1.68 0.00 0.00 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 0.03 0.25 0.71 0.00 0.00 121 I 9.00 4.26 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 1.37 0.69 0.96 0.00 0.00 122 G 6.84 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 0.00 0.00 0.00 0.00 123 V 7.93 5.00 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 0.78 0.00 0.00 1.02 0.00 0.00 124 L 8.96 4.72 0.00 1.77 1.51 0.38 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 125 D 9.12 5.29 0.00 2.85 2.79 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 0.00 0.00 0.00 126 I 8.65 5.13 1.55 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.55 1.12 0.00 0.00 127 D 9.67 5.66 0.00 2.84 2.60 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 0.00 128 A 8.92 5.20 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 0.00 129 P 0.00 4.54 0.00 2.20 2.20 0.00 3.88 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.96 0.00 130 I 7.17 4.66 1.84 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.66 0.89 0.00 0.00 131 T 8.26 4.27 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 1.22 0.00 0.00 132 D 8.66 4.42 0.00 2.73 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 0.00 133 R 7.87 3.77 0.00 1.48 1.41 0.00 2.93 0.00 0.00 3.03 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 0.50 0.00 134 F 7.81 5.21 0.00 3.11 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 0.00 135 D 8.96 5.18 0.00 2.90 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 136 D 8.70 4.39 0.00 2.72 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 0.00 137 N 8.23 4.27 0.00 2.80 3.07 0.00 0.00 7.23 8.49 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 0.00 138 D 8.83 4.28 0.00 3.08 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 K 8.16 3.83 0.00 1.83 1.93 0.00 1.65 0.00 0.00 1.57 0.00 0.00 2.96 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.41 1.43 7.81 140 E 8.23 3.83 0.00 1.97 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 2.09 2.25 0.00 141 H 7.78 4.09 0.00 2.02 2.56 0.00 5.87 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 L 8.06 4.06 0.00 1.65 1.69 0.91 0.94 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 0.00 143 E 8.40 3.99 0.00 2.12 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 2.33 2.56 0.00 144 A 7.81 4.03 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 0.00 145 I 7.81 3.75 2.09 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.25 1.00 0.00 0.00 146 V 8.10 3.72 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 1.18 0.00 0.00 1.07 0.00 0.00 147 K 8.17 4.18 0.00 2.01 2.01 0.00 1.69 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.45 1.50 7.81 148 I 7.61 3.78 2.08 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.94 0.93 0.00 0.00 149 I 7.65 3.74 2.10 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.73 0.86 0.00 0.00 150 E 8.58 4.01 0.00 2.21 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 2.59 2.60 0.00 151 K 7.95 3.98 0.00 1.89 1.88 0.00 1.72 0.00 0.00 1.64 0.00 0.00 2.99 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.76 1.60 7.81 152 Q 7.65 4.08 0.00 2.01 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.97 0.00 0.00 0.00 0.00 0.00 2.44 2.42 0.00 153 L 7.83 4.21 0.00 1.68 1.70 0.87 0.81 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 0.00 154 A 7.95 4.31 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