NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3999 8.2893 120.3537 53.0600 34.3773 175.2084 2 K 4.4721 7.6947 123.4278 54.2990 33.5064 173.2220 3 T 4.0423 8.7965 116.9844 62.1536 70.0840 174.9411 4 F 3.8737 8.1538 124.7509 58.1866 40.3241 175.5674 5 T 3.4478 5.7900 111.3872 60.2012 68.0777 171.3019 6 A 3.5376 6.8756 127.6114 51.6657 19.4133 177.3042 7 K 4.4376 7.8986 120.9284 54.0091 33.5423 176.1784 8 P 4.3423 0.0000 0.0000 64.5432 31.7759 176.2917 9 E 4.4953 8.1671 116.8048 58.2987 31.0434 178.8326 10 T 4.2728 7.6546 107.7657 61.3388 68.2547 174.2939 11 V 4.2820 7.4658 120.3976 62.5380 33.3841 175.0478 12 K 4.1622 8.5863 124.7832 58.9321 33.7089 177.5936 13 R 4.3695 8.0907 120.1027 52.5880 28.3888 172.6430 14 D 4.9928 8.6908 125.6634 54.1133 41.7590 173.9429 15 W 4.7917 8.5056 122.3519 56.5567 30.7049 174.5861 16 Y 5.0525 8.4187 117.9144 57.6084 42.6984 173.5833 17 V 5.1008 8.7375 118.4579 62.1355 35.5154 173.6492 18 V 4.6878 8.5916 124.2707 60.6690 35.2601 172.6748 19 D 4.6361 8.6269 121.4563 52.5109 42.6128 175.6777 20 A 3.9719 8.5165 129.7798 52.4412 16.8867 176.6650 21 T 4.7269 7.7902 116.7655 63.6999 69.8833 176.3033 22 G 3.8697 8.4010 115.2591 46.8036 0.0000 173.9648 23 K 4.1394 7.7768 120.7594 56.5879 32.5611 177.5704 24 T 4.0658 8.4485 111.4989 61.3586 69.1322 172.4076 25 L 3.6487 8.3540 128.1717 55.6427 42.4878 172.2789 26 G 4.1494 8.3660 114.1858 46.8722 0.0000 176.0268 27 R 3.3549 7.8604 120.2034 57.8797 30.3401 177.9665 28 L 4.3543 7.7840 118.7630 56.6628 42.6633 177.8821 29 A 3.9603 7.9155 120.3471 55.3484 18.2431 179.0044 30 T 4.0767 8.7971 112.7253 65.4790 67.3806 175.6354 31 E 3.8836 8.1193 120.2893 59.2255 29.6537 178.1598 32 L 3.8664 8.4747 119.2123 57.9906 41.7447 179.4715 33 A 3.9494 8.9345 121.2144 55.3678 18.4185 179.5662 34 R 3.9439 8.5622 117.7191 59.4629 29.9516 178.7750 35 R 3.8862 8.4278 118.8403 59.5270 30.1959 178.4274 36 L 3.8479 8.0958 119.0467 57.7109 41.3524 179.3141 37 R 4.0321 8.4102 117.8419 56.3878 30.3209 176.1331 38 G 3.7035 8.1241 106.9329 46.5755 0.0000 175.6281 39 K 3.8801 8.0117 122.4313 58.4600 32.6137 177.6015 40 H 4.4603 7.9324 113.5656 57.9562 29.5177 176.4470 41 K 4.3501 6.9984 124.5792 56.6552 32.6732 178.0120 42 A 4.5747 8.2858 120.6166 51.6282 18.2948 177.9727 43 E 3.8384 8.0777 123.6295 57.9818 30.1490 173.5056 44 Y 4.8621 7.7973 121.6218 58.0133 39.0343 175.2021 45 T 4.6025 8.6853 135.0000 60.8892 70.4719 171.7852 46 P 4.4674 0.0000 0.0000 65.3699 32.0264 177.3043 47 H 4.8817 7.9464 111.8892 54.7761 28.7332 174.3891 48 V 4.2208 8.0307 119.3299 61.3202 34.0286 174.6613 49 D 4.4269 8.7924 126.7662 54.8487 39.9470 175.0545 50 T 4.4904 8.2011 114.9246 60.9530 69.5269 175.1729 51 G 4.4074 7.7851 110.9096 45.2561 0.0000 175.7924 52 D 5.8177 7.9357 121.0029 53.4537 40.0136 178.1703 53 Y 4.0786 8.8009 124.0938 59.7327 40.7549 173.6417 54 I 3.7694 7.4945 120.5094 59.8693 39.7907 174.1767 55 I 4.7318 8.2670 121.7514 58.9159 40.2070 175.2762 56 V 3.9477 8.6766 126.9156 64.5547 32.2930 174.7259 57 L 4.2176 8.6172 124.9985 55.7669 43.0454 177.1414 58 N 4.8540 6.2377 113.0861 53.1151 40.2443 176.3032 59 A 4.3323 8.5342 124.5236 53.2780 17.7562 179.0909 60 D 4.5447 8.0506 111.0855 55.0846 39.5831 176.3595 61 K 4.8379 7.7661 119.8755 56.2714 33.8486 175.6574 62 V 5.4016 8.3975 119.4941 59.9957 32.9358 175.7420 63 A 4.6410 8.8545 126.0959 51.8731 19.0684 177.5977 64 V 4.2568 7.9534 114.4811 60.3407 33.3801 176.3107 65 T 3.4293 7.9949 111.9939 61.9383 67.4211 172.1543 66 G 4.0657 8.1909 111.3802 46.6642 0.0000 173.4351 67 N 4.7543 8.4196 119.0440 53.2776 38.3135 176.8961 68 K 3.8100 7.5421 120.1343 59.5471 32.5606 179.0439 69 R 4.2488 8.2102 118.8106 58.9500 30.0011 177.3839 70 T 4.7630 8.2206 104.4883 61.4819 69.4909 173.5224 71 D 4.9816 7.5269 121.2705 54.0934 42.8487 176.3862 72 K 4.4340 7.6180 130.0522 56.1439 31.5038 175.0833 73 V 3.9555 7.9145 111.7198 58.1243 40.3000 172.1584 74 Y 3.6998 7.8554 127.4308 58.9283 35.1785 168.0418 75 Y 5.4028 8.0325 119.8152 56.5329 41.0797 174.5937 76 H 4.9219 9.1238 116.2774 55.0029 32.2568 171.8514 77 H 5.2145 8.7806 121.4440 54.8039 31.1428 174.8082 78 T 3.9444 8.2493 114.0784 62.7524 69.2598 175.7692 79 G 3.9853 7.9722 109.5622 45.6124 0.0000 172.4443 80 H 4.6440 7.2572 114.8213 54.7633 31.1892 177.2648 81 I 2.5562 6.8068 117.5801 60.2234 41.3156 174.7049 82 G 3.9499 8.0743 111.6108 46.6481 0.0000 176.9333 83 G 3.5453 9.2345 107.1376 44.9044 0.0000 174.7551 84 I 3.3735 8.6513 110.4870 62.0040 36.7310 172.1611 85 K 4.7241 8.3299 124.6125 55.5147 34.3063 175.8801 86 Q 5.1069 8.4226 118.2860 55.4434 31.8499 173.8558 87 A 4.7346 8.1508 120.9614 51.2988 22.4838 176.6328 88 T 4.1136 9.4656 118.1805 61.2711 68.4150 174.6534 89 F 4.2690 8.9274 126.6688 61.8636 39.2450 176.8827 90 E 3.9093 8.7109 118.4653 59.6962 29.2021 179.0335 91 E 3.9272 8.1180 116.1424 59.6213 29.8773 178.6272 92 M 4.0486 8.1772 118.9524 58.6453 31.8396 178.6743 93 I 3.4563 7.3156 117.9118 64.5001 37.3629 177.7012 94 A 4.2243 7.4100 120.3097 53.8366 18.2235 178.2788 95 R 4.2791 7.3684 112.9691 55.9025 32.5764 175.0152 96 R 4.5089 8.5611 121.7160 56.3500 26.5806 175.4238 97 P 4.0372 0.0000 0.0000 65.1619 32.6646 179.1886 98 E 3.8851 8.3875 117.8672 59.8079 29.1807 179.5876 99 R 4.0669 7.5107 118.6077 58.7337 29.6886 179.0209 100 V 3.2173 7.6567 118.0922 66.0387 30.9499 177.9055 101 I 3.9092 7.6057 118.2253 63.6117 37.6161 177.4455 102 E 4.4375 8.1825 119.7275 59.8953 29.4443 179.7581 103 I 3.8836 8.5722 112.8605 63.4141 37.5132 178.1931 104 A 4.0562 7.5196 122.7569 55.3566 18.2952 180.0595 105 V 3.6645 9.0604 111.8895 64.3522 31.4081 178.8214 106 K 4.2313 8.6624 119.3247 59.2065 32.0324 178.8197 107 G 3.7812 7.9164 105.6870 47.9048 0.0000 175.4288 108 M 4.1982 7.5465 120.0995 57.2993 32.5198 177.3361 109 L 3.9897 7.4822 117.9926 54.6691 42.5839 175.4786 110 P 4.5210 0.0000 0.0000 62.2321 33.8368 176.3309 111 K 4.2508 7.9361 114.4460 56.6785 33.1553 175.1506 112 G 4.0017 8.3961 112.2133 46.9794 0.0000 171.9868 113 P 4.1902 0.0000 0.0000 65.6688 30.8148 177.9505 114 L 4.2142 7.7816 120.0728 56.5981 42.6072 178.4607 115 G 4.3771 8.0283 106.6997 47.5166 0.0000 175.4377 116 R 3.9683 8.3370 121.8935 58.6207 29.8856 178.4463 117 A 4.0793 7.4745 118.6408 55.0737 18.6216 178.8720 118 M 4.1101 8.0439 117.0193 57.4686 32.3179 178.5338 119 F 4.0028 8.0607 120.8501 61.2507 39.5130 177.0069 120 R 3.9588 7.8392 113.8753 59.0127 28.8806 178.6615 121 K 3.7641 7.2935 118.2741 58.0974 32.3416 177.3185 122 L 4.5625 6.6752 119.6403 54.6040 42.7614 176.7075 123 K 4.5041 8.0340 127.4578 56.3301 33.7263 173.9714 124 V 4.3019 7.8347 114.9669 59.1922 40.3000 175.2519 125 Y 3.8213 8.0689 117.5040 58.0830 37.3858 169.7175 126 A 4.0591 8.7398 122.5583 53.0023 18.8175 177.9189 127 G 4.3262 9.0231 107.4635 46.2243 0.0000 173.0109 128 N 4.1568 8.6090 125.7281 53.0988 36.3861 176.2211 129 E 4.9474 7.2380 109.3679 56.0955 30.8253 174.3521 130 H 3.2940 8.0090 119.8418 54.4705 30.5230 175.3761 131 N 4.6486 7.5340 119.5340 54.2004 38.8000 175.2586 132 H 4.9344 7.9010 112.3049 54.6950 29.5725 176.4267 133 A 3.8292 7.8699 125.7483 55.2391 18.1464 180.3210 134 A 3.9906 7.8448 116.9790 54.4175 18.0965 177.7458 135 Q 3.9966 7.8978 113.6564 54.6642 30.0458 175.1346 136 Q 3.3709 8.1508 117.0070 56.3958 26.6527 172.4878 137 P 4.4921 0.0000 0.0000 62.5671 32.8211 178.3708 138 Q 4.3126 8.3993 122.9442 55.4701 30.1251 176.1425 139 V 4.3157 8.3902 115.7149 61.5466 32.6882 175.2589 140 L 4.7745 8.2080 123.9706 53.2534 44.8796 176.1348 141 D 4.3717 9.0119 125.7613 54.7982 39.9990 176.3853 142 I 3.6270 8.3016 124.0367 61.7380 37.3567 174.2808 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 M 8.29 4.40 0.00 2.02 2.01 0.00 0.00 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.56 0.00 2 K 7.69 4.47 0.00 1.96 1.80 0.00 1.66 0.00 0.00 1.74 0.00 0.00 3.00 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.17 1.51 7.81 3 T 8.80 4.04 4.87 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 0.00 0.00 1.37 0.00 0.00 4 F 8.15 3.87 0.00 2.80 2.37 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 5 T 5.79 3.45 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 0.91 0.00 0.00 6 A 6.88 3.54 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 7 K 7.90 4.44 0.00 1.70 1.69 0.00 1.62 0.00 0.00 1.65 0.00 0.00 2.79 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.31 1.50 7.81 8 P 0.00 4.34 0.00 2.03 2.13 0.00 3.62 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.11 0.00 9 E 8.17 4.50 0.00 1.93 1.98 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 2.26 2.27 0.00 10 T 7.65 4.27 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 1.24 0.00 0.00 11 V 7.47 4.28 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 0.95 0.00 0.00 1.01 0.00 0.00 12 K 8.59 4.16 0.00 2.13 1.97 0.00 1.77 0.00 0.00 1.76 0.00 0.00 3.09 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.44 1.54 7.81 13 R 8.09 4.37 0.00 2.25 2.42 0.00 3.80 0.00 0.00 3.59 7.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.80 0.00 14 D 8.69 4.99 0.00 3.14 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 15 W 8.51 4.79 0.00 3.00 3.15 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 16 Y 8.42 5.05 0.00 2.95 2.88 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 0.00 0.00 0.00 17 V 8.74 5.10 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 0.89 0.00 0.00 0.94 0.00 0.00 18 V 8.59 4.69 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 0.64 0.00 0.00 0.95 0.00 0.00 19 D 8.63 4.64 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 20 A 8.52 3.97 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 21 T 7.79 4.73 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 1.26 0.00 0.00 22 G 8.40 3.87 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 0.00 0.00 0.00 0.00 0.00 0.00 23 K 7.78 4.14 0.00 1.83 1.76 0.00 1.69 0.00 0.00 1.88 0.00 0.00 3.11 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.58 1.40 7.81 24 T 8.45 4.07 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 1.21 0.00 0.00 25 L 8.35 3.65 0.00 1.99 1.82 0.96 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 26 G 8.37 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 0.00 0.00 0.00 0.00 27 R 7.86 3.35 0.00 1.79 2.03 0.00 3.19 0.00 0.00 3.15 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.70 0.00 28 L 7.78 4.35 0.00 1.71 1.66 0.94 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 29 A 7.92 3.96 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.80 4.08 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 1.26 0.00 0.00 31 E 8.12 3.88 0.00 2.10 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 0.00 2.34 2.41 0.00 32 L 8.47 3.87 0.00 1.87 1.70 0.96 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 33 A 8.93 3.95 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 34 R 8.56 3.94 0.00 1.97 2.08 0.00 3.30 0.00 0.00 3.15 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.79 0.00 35 R 8.43 3.89 0.00 2.14 1.82 0.00 3.13 0.00 0.00 3.04 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.70 0.00 36 L 8.10 3.85 0.00 1.77 1.62 0.72 0.94 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 37 R 8.41 4.03 0.00 1.84 1.93 0.00 3.37 0.00 0.00 3.22 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.63 0.00 38 G 8.12 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 39 K 8.01 3.88 0.00 1.71 1.84 0.00 1.69 0.00 0.00 1.75 0.00 0.00 3.06 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.45 1.41 7.81 40 H 7.93 4.46 0.00 3.24 3.41 0.00 5.77 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 K 7.00 4.35 0.00 1.84 1.72 0.00 1.81 0.00 0.00 1.75 0.00 0.00 3.07 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.48 1.09 7.81 42 A 8.29 4.57 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 43 E 8.08 3.84 0.00 2.22 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 2.42 2.29 0.00 44 Y 7.80 4.86 0.00 3.12 3.15 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 45 T 8.69 4.60 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 1.36 0.00 0.00 46 P 0.00 4.47 0.00 2.13 2.16 0.00 3.84 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.33 0.00 47 H 7.95 4.88 0.00 3.22 3.38 0.00 5.67 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 V 8.03 4.22 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 0.75 0.00 0.00 0.80 0.00 0.00 49 D 8.79 4.43 0.00 2.63 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 50 T 8.20 4.49 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 1.27 0.00 0.00 51 G 7.79 4.41 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 0.00 52 D 7.94 5.82 0.00 2.65 2.42 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 0.00 0.00 0.00 0.00 53 Y 8.80 4.08 0.00 2.69 1.67 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 54 I 7.49 3.77 1.78 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 1.35 1.19 0.81 0.00 0.00 55 I 8.27 4.73 2.12 0.00 0.00 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 1.65 0.72 1.02 0.00 0.00 56 V 8.68 3.95 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 0.80 0.00 0.00 0.94 0.00 0.00 57 L 8.62 4.22 0.00 1.88 1.40 0.90 1.08 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 58 N 6.24 4.85 0.00 3.07 2.81 0.00 0.00 6.93 7.23 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 59 A 8.53 4.33 1.42 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 0.00 0.00 0.00 0.00 0.00 0.00 60 D 8.05 4.54 0.00 2.77 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 61 K 7.77 4.84 0.00 1.71 1.80 0.00 1.67 0.00 0.00 1.88 0.00 0.00 2.89 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.42 1.41 7.81 62 V 8.40 5.40 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 1.02 0.00 0.00 1.05 0.00 0.00 63 A 8.85 4.64 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 64 V 7.95 4.26 1.61 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 0.49 0.00 0.00 0.24 0.00 0.00 65 T 7.99 3.43 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 1.15 0.00 0.00 66 G 8.19 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 0.00 0.00 0.00 67 N 8.42 4.75 0.00 2.74 2.82 0.00 0.00 6.84 7.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 K 7.54 3.81 0.00 1.64 1.50 0.00 1.72 0.00 0.00 1.34 0.00 0.00 2.72 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.32 1.39 7.81 69 R 8.21 4.25 0.00 1.95 2.01 0.00 3.37 0.00 0.00 3.50 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.95 0.00 70 T 8.22 4.76 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 1.31 0.00 0.00 71 D 7.53 4.98 0.00 2.77 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 72 K 7.62 4.43 0.00 1.92 1.47 0.00 1.05 0.00 0.00 1.36 0.00 0.00 2.50 0.00 0.00 2.54 0.00 0.00 0.00 0.00 1.22 1.61 7.81 73 V 7.91 3.96 1.92 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 0.75 0.00 0.00 0.69 0.00 0.00 74 Y 7.86 3.70 0.00 3.44 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 75 Y 8.03 5.40 0.00 2.90 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 76 H 9.12 4.92 0.00 3.24 3.40 0.00 5.24 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 H 8.78 5.21 0.00 3.15 3.22 0.00 5.72 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 T 8.25 3.94 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 1.11 0.00 0.00 79 G 7.97 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 80 H 7.26 4.64 0.00 3.02 3.19 0.00 5.86 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 I 6.81 2.56 1.89 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 1.37 0.70 0.94 0.00 0.00 82 G 8.07 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 83 G 9.23 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 0.00 0.00 0.00 84 I 8.65 3.37 1.96 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 1.43 0.73 1.03 0.00 0.00 85 K 8.33 4.72 0.00 1.89 1.78 0.00 1.75 0.00 0.00 1.72 0.00 0.00 3.07 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.40 1.60 7.81 86 Q 8.42 5.11 0.00 1.60 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.63 0.00 0.00 0.00 0.00 0.00 2.32 2.37 0.00 87 A 8.15 4.73 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 88 T 9.47 4.11 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 1.35 0.00 0.00 89 F 8.93 4.27 0.00 3.14 3.40 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 90 E 8.71 3.91 0.00 2.40 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 2.33 2.41 0.00 91 E 8.12 3.93 0.00 2.18 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 2.42 0.00 92 M 8.18 4.05 0.00 1.71 2.10 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.71 0.00 93 I 7.32 3.46 1.79 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.12 0.83 0.00 0.00 94 A 7.41 4.22 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 95 R 7.37 4.28 0.00 1.84 1.85 0.00 3.19 0.00 0.00 3.16 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.60 0.00 96 R 8.56 4.51 0.00 2.00 1.97 0.00 3.36 0.00 0.00 3.26 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.55 0.00 97 P 0.00 4.04 0.00 2.12 1.99 0.00 3.60 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.19 0.00 98 E 8.39 3.89 0.00 2.01 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 2.36 2.67 0.00 99 R 7.51 4.07 0.00 1.79 1.88 0.00 3.10 0.00 0.00 3.07 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.63 0.00 100 V 7.66 3.22 2.19 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 1.32 0.00 0.00 0.64 0.00 0.00 101 I 7.61 3.91 2.01 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.03 0.95 0.00 0.00 102 E 8.18 4.44 0.00 2.25 2.42 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 0.00 2.49 2.60 0.00 103 I 8.57 3.88 1.91 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.87 0.84 0.00 0.00 104 A 7.52 4.06 1.52 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 0.00 105 V 9.06 3.66 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 0.86 0.00 0.00 1.26 0.00 0.00 106 K 8.66 4.23 0.00 1.53 1.75 0.00 1.61 0.00 0.00 1.20 0.00 0.00 3.00 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.17 1.38 7.81 107 G 7.92 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 0.00 108 M 7.55 4.20 0.00 1.99 2.26 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 3.09 0.00 109 L 7.48 3.99 0.00 1.74 1.66 1.17 0.98 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 0.00 110 P 0.00 4.52 0.00 2.21 2.20 0.00 3.72 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 2.04 1.98 0.00 111 K 7.94 4.25 0.00 1.83 1.99 0.00 1.58 0.00 0.00 1.71 0.00 0.00 3.11 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.39 1.50 7.81 112 G 8.40 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.19 0.00 2.27 2.31 0.00 3.69 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 2.08 2.04 0.00 114 L 7.78 4.21 0.00 1.65 1.73 0.93 1.01 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 0.00 115 G 8.03 4.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.34 3.97 0.00 1.92 2.05 0.00 2.96 0.00 0.00 2.99 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.73 0.00 117 A 7.47 4.08 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 0.00 118 M 8.04 4.11 0.00 2.03 2.25 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.86 2.64 0.00 119 F 8.06 4.00 0.00 3.05 3.22 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 0.00 120 R 7.84 3.96 0.00 2.06 2.18 0.00 3.23 0.00 0.00 3.26 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.67 0.00 121 K 7.29 3.76 0.00 1.49 1.02 0.00 0.94 0.00 0.00 1.34 0.00 0.00 2.90 0.00 0.00 2.75 0.00 0.00 0.00 0.00 0.66 1.08 7.81 122 L 6.68 4.56 0.00 1.39 1.32 0.83 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 123 K 8.03 4.50 0.00 1.92 1.82 0.00 1.68 0.00 0.00 1.76 0.00 0.00 3.28 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.83 1.57 7.81 124 V 7.83 4.30 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 0.65 0.00 0.00 0.81 0.00 0.00 125 Y 8.07 3.82 0.00 3.32 3.29 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 0.00 126 A 8.74 4.06 1.42 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 0.00 0.00 0.00 0.00 0.00 0.00 127 G 9.02 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 0.00 0.00 0.00 0.00 128 N 8.61 4.16 0.00 2.92 2.88 0.00 0.00 6.93 6.96 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 0.00 129 E 7.24 4.95 0.00 1.92 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 2.05 2.35 0.00 130 H 8.01 3.29 0.00 2.69 2.82 0.00 5.52 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 0.00 131 N 7.53 4.65 0.00 2.79 2.81 0.00 0.00 6.89 8.04 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 0.00 132 H 7.90 4.93 0.00 3.31 3.06 0.00 5.91 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 A 7.87 3.83 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 A 7.84 3.99 1.16 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 0.00 135 Q 7.90 4.00 0.00 1.36 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.84 6.17 0.00 0.00 0.00 0.00 0.00 1.16 1.67 0.00 136 Q 8.15 3.37 0.00 2.01 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.03 6.83 0.00 0.00 0.00 0.00 0.00 2.24 2.20 0.00 137 P 0.00 4.49 0.00 2.06 2.40 0.00 3.71 0.00 0.00 3.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.16 0.00 138 Q 8.40 4.31 0.00 1.94 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 7.04 0.00 0.00 0.00 0.00 0.00 2.36 2.17 0.00 139 V 8.39 4.32 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 0.67 0.00 0.00 0.97 0.00 0.00 140 L 8.21 4.77 0.00 1.72 1.52 0.39 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 141 D 9.01 4.37 0.00 2.71 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 0.00 142 I 8.30 3.63 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 1.28 0.37 0.91 0.00 0.00