NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9798 8.3549 109.7421 45.3813 0.0000 173.2936 2 L 4.3134 8.1421 122.8580 51.2144 43.7422 175.3550 3 S 4.5693 10.5940 118.9477 57.7219 66.4028 174.7798 4 D 4.6921 8.7368 121.2753 57.4324 40.4310 179.2694 5 G 3.6586 8.0895 105.8122 47.8777 0.0000 175.5078 6 E 3.8926 7.9857 120.7445 58.9119 29.4271 179.3944 7 W 4.3646 8.1556 119.0033 59.7626 29.0881 178.3739 8 Q 4.0512 8.5049 119.5173 59.3535 28.5827 178.2921 9 L 4.0555 7.9164 119.9817 57.6792 41.5271 179.5241 10 V 3.7129 7.8956 118.1583 66.3910 31.4398 178.2281 11 L 4.1823 8.4746 118.6586 57.7402 41.1682 179.4669 12 N 4.4194 8.0945 115.9911 56.5231 38.7920 177.6517 13 V 3.8276 8.1901 113.8484 63.9321 31.6680 178.4288 14 W 4.0980 8.8379 128.6916 60.2013 30.2322 178.2019 15 G 3.6678 7.7364 104.9875 47.6379 0.0000 175.5464 16 K 3.9775 8.0318 120.8863 59.1212 31.8596 179.6482 17 V 2.9245 6.8561 118.1415 65.5616 31.1315 177.7704 18 E 3.8125 7.5147 116.9015 58.7116 29.3178 178.4878 19 A 4.2340 7.2622 118.0717 53.1660 19.6882 177.5019 20 D 4.6199 7.7617 114.7684 52.4234 43.5713 175.8026 21 V 3.5670 7.7723 123.5405 65.7857 32.1590 176.8492 22 A 4.1009 7.9937 120.2038 54.9351 18.1232 179.7621 23 G 3.5309 8.1415 105.6647 47.8074 0.0000 175.8304 24 H 4.1568 8.2674 119.1111 58.0947 28.5656 177.9792 25 G 3.6664 8.3825 108.1266 47.8965 0.0000 175.3223 26 Q 3.8350 7.9337 122.3297 58.9205 29.0674 178.1176 27 E 3.9108 7.7352 119.5634 59.4531 29.3859 179.7587 28 V 3.4901 7.6352 118.0258 65.8855 31.5469 178.1972 29 L 3.3981 7.8891 118.8693 57.6267 41.3705 179.4504 30 I 3.6561 7.9106 120.1223 64.4231 36.9826 178.7449 31 R 3.8398 8.0524 118.9682 58.9917 29.8504 178.8169 32 L 3.8992 7.8047 120.1904 58.3632 41.8569 179.1762 33 F 4.6209 8.0527 117.8968 60.3268 38.5517 177.9745 34 K 4.1363 8.1819 118.0365 59.1713 32.0162 179.2089 35 G 3.7371 7.9011 104.9478 46.2725 0.0000 173.7897 36 H 4.7017 8.1225 117.7216 52.1280 29.9825 171.9509 37 P 4.6541 0.0000 0.0000 64.4136 31.0182 177.3772 38 E 4.1843 8.1652 116.0436 58.8789 29.6062 178.7485 39 T 3.5817 8.2858 111.4637 64.0531 68.9832 176.2173 40 L 3.4355 7.7957 123.4686 58.1852 41.7381 178.6155 41 E 4.1475 7.6855 116.7848 58.4224 29.4755 178.4081 42 K 4.4875 8.0642 116.8932 56.0318 32.9043 176.5555 43 F 4.5507 8.0508 119.8752 55.5671 39.1589 176.0098 44 D 4.4240 8.3638 126.8562 55.6068 39.8031 178.7726 45 K 4.0111 7.7200 117.9278 58.4678 32.2241 177.0927 46 F 5.1937 7.5639 116.7539 56.8869 40.3321 176.9458 47 K 4.0882 7.9307 122.5859 59.7369 32.4333 177.5525 48 H 4.4682 8.1424 114.7113 56.3703 29.0861 174.9038 49 L 4.4811 7.6301 120.8606 54.1718 41.9141 176.8614 50 K 4.3586 9.0235 123.2441 57.0996 33.3413 176.5888 51 S 4.6226 7.4305 112.6308 55.8130 67.2371 174.2408 52 E 3.9298 8.6734 121.4297 59.5362 28.7080 178.3031 53 D 4.3857 7.9895 118.5650 57.3007 40.9970 178.3981 54 E 4.0289 7.8853 119.2492 59.4328 29.1983 179.2527 55 M 3.9540 7.7518 118.0407 58.4074 32.1526 178.8159 56 K 4.0277 8.3299 117.2661 58.6677 32.2116 178.4436 57 A 4.4328 7.2429 118.6565 51.9956 19.5701 177.4950 58 S 4.1113 7.3247 113.4145 58.3832 63.0893 174.8314 59 E 4.0258 8.9027 126.8163 59.5885 29.5851 178.7448 60 D 4.4878 8.1379 119.4164 56.8900 40.9263 178.3214 61 L 3.4898 7.7205 120.3925 57.9419 42.0832 178.8296 62 K 3.8710 7.6376 119.4908 59.5849 32.0493 178.8670 63 K 4.0293 8.1445 118.6644 59.4008 32.0242 179.6154 64 V 3.8336 8.4076 119.1110 65.9791 31.4681 178.2378 65 G 3.6774 8.6048 106.0032 47.7341 0.0000 175.1116 66 N 4.3167 8.1792 119.2224 56.8241 39.1569 177.0660 67 T 3.9069 8.0728 117.0238 66.7143 68.7038 176.5872 68 I 3.7699 7.8854 121.4658 64.6826 37.2530 178.6719 69 L 4.2500 8.2582 119.7582 57.8362 41.2082 179.6687 70 T 3.9613 8.3406 115.9657 66.6615 68.4877 176.4070 71 A 4.0077 7.8960 122.0522 54.9876 18.4141 179.2200 72 L 3.6209 7.7932 118.6900 58.3174 42.1196 179.2980 73 G 3.4556 8.2150 105.5712 47.7361 0.0000 175.7883 74 G 3.5581 7.5237 106.8287 47.5609 0.0000 175.6508 75 I 3.8489 7.5222 122.4151 64.0629 37.1720 178.4408 76 L 3.9660 7.7005 119.7992 57.8605 41.1887 179.7865 77 K 3.9958 7.6293 116.7753 58.7129 32.1308 179.1589 78 K 3.8915 7.9285 118.9285 56.5188 32.7884 176.6212 79 K 2.0000 8.0361 117.6318 56.3125 29.3355 175.7068 80 G 3.9935 7.8012 105.7546 45.6983 0.0000 172.8883 81 H 4.7398 7.1119 118.3781 55.4500 27.8237 174.7618 82 H 5.7018 7.0845 109.2464 54.5132 29.8658 176.7081 83 E 3.9327 8.6538 121.8912 60.6969 29.0281 178.2019 84 A 4.0538 7.9294 118.3783 55.1365 18.6432 178.8613 85 E 4.1557 8.1440 116.5547 58.9529 29.7617 178.9186 86 L 4.0232 8.3414 121.0038 58.2081 42.0770 178.7542 87 T 3.8924 7.9527 115.8270 66.6332 68.5060 174.6185 88 P 4.2906 0.0000 0.0000 65.4445 31.2312 178.5031 89 L 4.0484 7.5377 116.3569 57.9955 42.0451 178.9014 90 A 4.2172 8.1668 120.8739 55.2421 18.3871 179.2896 91 Q 3.9466 8.5007 117.2156 59.3782 28.7738 179.4171 92 S 4.0745 8.2217 114.8770 61.9932 62.6850 176.1660 93 H 4.1928 8.8129 119.5949 57.8444 27.9461 177.6555 94 A 3.1903 7.8093 123.1904 54.7880 18.0774 179.4020 95 T 3.7875 7.3440 105.9033 62.4257 68.1759 175.5621 96 K 4.2082 7.5131 120.3111 58.2623 33.7807 177.0433 97 H 4.0969 8.1168 113.4555 55.8071 29.6185 175.2986 98 K 3.8088 6.7297 117.4177 55.9444 29.5628 174.8902 99 I 4.2321 8.8006 118.9203 59.0245 38.8432 175.2061 100 P 4.5836 0.0000 0.0000 61.6745 32.0546 177.5041 101 V 3.3326 8.4231 120.6504 66.0094 31.2985 178.5931 102 K 3.9626 7.8327 117.8286 59.8463 32.3294 178.4801 103 Y 4.0483 8.0081 117.9955 60.4898 37.8781 177.8676 104 L 4.1791 7.9176 120.3682 57.6474 41.7413 179.2228 105 E 4.0518 7.7962 118.3062 59.2828 29.5575 179.1185 106 F 4.5508 7.6240 117.9139 60.5331 38.9073 177.5913 107 I 3.8303 8.0519 118.5240 63.9425 37.6858 178.0688 108 S 4.1923 8.1065 116.0035 61.6483 62.6658 176.5209 109 E 4.0142 8.2749 119.8119 59.4371 29.1821 179.0307 110 A 4.4858 7.9885 122.9068 54.3790 18.3631 179.5535 111 I 3.6490 8.2207 118.7427 64.7446 37.1893 178.6886 112 I 3.7318 8.0726 120.6943 64.5263 36.9022 178.5294 113 Q 4.0298 8.4796 119.2540 58.9867 28.4791 179.1134 114 V 3.5293 8.1020 119.5927 65.7728 31.5313 178.0362 115 L 3.7234 7.9065 118.9696 57.6083 41.1096 179.1950 116 Q 4.1528 7.9045 118.3855 59.4710 29.1383 178.2479 117 S 4.2404 8.0924 114.9047 61.6164 62.9869 176.4824 118 K 4.0973 8.0845 119.7257 57.6894 33.5412 177.0495 119 H 5.0689 8.3794 115.6618 53.8918 29.5709 172.7070 120 P 4.3838 0.0000 0.0000 65.8502 31.8549 179.6664 121 G 3.6779 8.1944 106.6402 47.6134 0.0000 173.4987 122 D 4.7800 7.9034 117.0424 54.1457 41.9681 176.3609 123 F 4.9809 7.7534 120.7594 56.6501 39.0834 174.5399 124 G 3.8505 7.4657 110.0964 43.6370 0.0000 171.0063 125 A 3.8969 8.4725 120.6806 55.5728 18.0833 179.4846 126 D 4.1509 7.9674 116.2719 57.5672 41.0087 178.6527 127 A 3.9453 7.8019 120.4940 55.1975 18.3372 179.4467 128 Q 3.2876 7.8955 116.9128 58.8895 28.7500 179.3426 129 G 3.4996 7.8363 106.2534 47.6287 0.0000 175.4232 130 A 3.8359 8.0472 123.4844 55.0871 18.3395 179.3655 131 M 4.0127 8.1642 116.6632 58.9491 32.2577 178.6251 132 S 4.1541 8.2999 115.3447 61.5186 63.0070 176.7576 133 K 3.8680 8.1828 121.0238 59.3883 31.7992 179.1835 134 A 3.8075 7.8992 120.9140 55.2253 18.2665 179.7598 135 L 4.0782 8.2949 117.8029 57.7015 41.5780 179.4011 136 E 3.9362 8.5779 119.8832 59.1194 29.6344 178.5078 137 L 3.9437 8.0709 120.4512 58.0872 42.1514 178.6607 138 F 4.0887 8.3820 120.4175 61.3957 39.3494 177.0562 139 R 3.5491 8.3550 117.9554 59.3587 29.9172 178.7881 140 N 4.2236 8.1790 115.9664 56.5074 38.4922 177.2649 141 D 4.3465 8.0179 120.1674 57.4351 40.8147 178.8193 142 M 3.7851 7.6524 118.8872 58.3203 31.8746 178.5064 143 A 3.6527 7.9771 120.9711 55.1290 18.5621 179.6066 144 A 3.9291 7.9512 119.1128 55.2814 18.6089 180.0640 145 K 4.0457 8.3711 117.3996 59.5884 32.0457 179.2253 146 Y 4.1925 8.3346 117.2246 61.2208 37.7459 178.5224 147 K 4.3008 8.3520 120.7906 59.0462 32.0085 178.8514 148 E 4.0486 8.0279 117.4161 58.3143 29.7073 177.7130 149 L 4.3734 7.6180 116.5745 54.6282 41.9585 177.3762 150 G 3.6295 7.4493 107.2358 45.7449 0.0000 173.5316 151 F 4.7097 8.1891 119.0510 55.0728 41.4784 174.3167 152 Q 3.9906 9.3547 123.5240 62.3542 29.4347 177.3182 153 G 4.3376 7.1314 110.7862 44.7830 0.0000 174.3343 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 3.98 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 2 L 8.14 4.31 0.00 0.82 0.91 0.51 -0.54 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 3 S 10.59 4.57 0.00 3.88 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 4 D 8.74 4.69 0.00 2.77 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 5 G 8.09 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 0.00 0.00 0.00 6 E 7.99 3.89 0.00 2.03 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 2.27 0.00 7 W 8.16 4.36 0.00 3.60 3.19 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 8 Q 8.50 4.05 0.00 2.41 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.80 0.00 0.00 0.00 0.00 0.00 2.41 2.51 0.00 9 L 7.92 4.06 0.00 1.93 1.74 0.89 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 10 V 7.90 3.71 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 1.30 0.00 0.00 0.84 0.00 0.00 11 L 8.47 4.18 0.00 1.90 1.81 0.95 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 12 N 8.09 4.42 0.00 2.94 2.93 0.00 0.00 7.06 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 13 V 8.19 3.83 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 1.14 0.00 0.00 14 W 8.84 4.10 0.00 3.60 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 15 G 7.74 3.67 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 0.00 0.00 0.00 16 K 8.03 3.98 0.00 1.49 1.47 0.00 1.58 0.00 0.00 1.51 0.00 0.00 2.86 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.43 1.36 7.81 17 V 6.86 2.92 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 0.00 0.00 0.10 0.00 0.00 -0.00 0.00 0.00 18 E 7.51 3.81 0.00 2.05 1.97 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 2.42 2.38 0.00 19 A 7.26 4.23 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 20 D 7.76 4.62 0.00 2.68 2.52 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 21 V 7.77 3.57 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 1.10 0.00 0.00 0.93 0.00 0.00 22 A 7.99 4.10 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 G 8.14 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 24 H 8.27 4.16 0.00 3.11 3.23 0.00 5.83 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 25 G 8.38 3.67 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 0.00 0.00 0.00 26 Q 7.93 3.84 0.00 2.08 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.71 0.00 0.00 0.00 0.00 0.00 2.26 2.31 0.00 27 E 7.74 3.91 0.00 2.05 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.49 0.00 28 V 7.64 3.49 2.04 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 1.07 0.00 0.00 0.97 0.00 0.00 29 L 7.89 3.40 0.00 1.64 1.10 0.84 0.57 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 30 I 7.91 3.66 1.84 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.54 0.87 0.00 0.00 31 R 8.05 3.84 0.00 1.89 1.93 0.00 3.25 0.00 0.00 3.05 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.72 0.00 32 L 7.80 3.90 0.00 1.67 1.35 1.08 0.98 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 33 F 8.05 4.62 0.00 3.05 2.87 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 34 K 8.18 4.14 0.00 1.78 1.84 0.00 1.68 0.00 0.00 1.82 0.00 0.00 3.00 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.48 1.59 7.81 35 G 7.90 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 H 8.12 4.70 0.00 2.85 2.53 0.00 5.63 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 P 0.00 4.65 0.00 2.15 2.09 0.00 3.80 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 2.08 1.97 0.00 38 E 8.17 4.18 0.00 2.26 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 2.36 2.55 0.00 39 T 8.29 3.58 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 0.92 0.00 0.00 40 L 7.80 3.44 0.00 1.48 1.71 0.39 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 41 E 7.69 4.15 0.00 2.09 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 2.37 2.37 0.00 42 K 8.06 4.49 0.00 1.45 1.78 0.00 1.83 0.00 0.00 2.05 0.00 0.00 3.18 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.87 1.95 7.81 43 F 8.05 4.55 0.00 3.25 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 D 8.36 4.42 0.00 2.87 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 45 K 7.72 4.01 0.00 1.11 1.91 0.00 1.84 0.00 0.00 1.67 0.00 0.00 3.00 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.21 1.33 7.81 46 F 7.56 5.19 0.00 2.94 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 47 K 7.93 4.09 0.00 1.77 1.94 0.00 1.60 0.00 0.00 1.67 0.00 0.00 2.84 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.65 1.29 7.81 48 H 8.14 4.47 0.00 3.18 3.42 0.00 5.89 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 49 L 7.63 4.48 0.00 1.58 1.58 0.83 1.26 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 50 K 9.02 4.36 0.00 1.97 1.84 0.00 1.70 0.00 0.00 1.76 0.00 0.00 3.21 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.39 1.35 7.81 51 S 7.43 4.62 0.00 3.97 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 52 E 8.67 3.93 0.00 2.04 1.97 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 2.35 2.37 0.00 53 D 7.99 4.39 0.00 2.71 2.68 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 0.00 0.00 0.00 0.00 54 E 7.89 4.03 0.00 2.10 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 2.32 2.33 0.00 55 M 7.75 3.95 0.00 1.94 2.27 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.51 0.00 56 K 8.33 4.03 0.00 1.86 1.84 0.00 1.65 0.00 0.00 1.66 0.00 0.00 3.16 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.42 1.53 7.81 57 A 7.24 4.43 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 58 S 7.32 4.11 0.00 3.92 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 59 E 8.90 4.03 0.00 2.24 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 0.00 2.39 2.43 0.00 60 D 8.14 4.49 0.00 2.96 3.14 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 61 L 7.72 3.49 0.00 1.09 1.53 0.53 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 62 K 7.64 3.87 0.00 1.80 1.96 0.00 1.66 0.00 0.00 1.63 0.00 0.00 2.90 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.43 1.46 7.81 63 K 8.14 4.03 0.00 2.05 1.90 0.00 1.77 0.00 0.00 1.61 0.00 0.00 2.93 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.49 1.79 7.81 64 V 8.41 3.83 2.46 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 1.36 0.00 0.00 1.27 0.00 0.00 65 G 8.60 3.68 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 N 8.18 4.32 0.00 2.89 3.03 0.00 0.00 7.20 7.26 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 67 T 8.07 3.91 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 1.29 0.00 0.00 68 I 7.89 3.77 2.09 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 1.67 1.43 0.99 0.00 0.00 69 L 8.26 4.25 0.00 1.78 1.95 0.89 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 70 T 8.34 3.96 4.45 0.00 0.00 0.00 0.00 0.00 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 71 A 7.90 4.01 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 72 L 7.79 3.62 0.00 1.61 1.74 0.17 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 73 G 8.21 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 0.00 0.00 0.00 74 G 7.52 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 75 I 7.52 3.85 1.89 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.83 0.89 0.00 0.00 76 L 7.70 3.97 0.00 1.40 1.48 -0.09 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 77 K 7.63 4.00 0.00 1.68 1.81 0.00 1.70 0.00 0.00 1.71 0.00 0.00 3.17 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.46 1.63 7.81 78 K 7.93 3.89 0.00 1.75 1.81 0.00 1.85 0.00 0.00 1.73 0.00 0.00 2.87 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.63 1.81 7.81 79 K 8.04 2.00 0.00 1.20 0.74 0.00 1.43 0.00 0.00 1.28 0.00 0.00 2.93 0.00 0.00 2.94 0.00 0.00 0.00 0.00 0.32 0.91 7.81 80 G 7.80 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 81 H 7.11 4.74 0.00 3.02 3.20 0.00 5.64 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 82 H 7.08 5.70 0.00 3.31 3.47 0.00 5.67 0.00 0.00 0.00 0.00 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 E 8.65 3.93 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 2.40 2.49 0.00 84 A 7.93 4.05 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 85 E 8.14 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 2.39 2.43 0.00 86 L 8.34 4.02 0.00 2.00 1.69 0.98 0.95 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 87 T 7.95 3.89 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 1.24 0.00 0.00 88 P 0.00 4.29 0.00 2.19 2.13 0.00 3.66 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.17 0.00 89 L 7.54 4.05 0.00 1.89 1.82 0.99 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 90 A 8.17 4.22 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 91 Q 8.50 3.95 0.00 2.25 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.74 0.00 0.00 0.00 0.00 0.00 2.42 2.57 0.00 92 S 8.22 4.07 0.00 4.06 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 93 H 8.81 4.19 0.00 3.52 3.58 0.00 5.81 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 94 A 7.81 3.19 0.24 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 95 T 7.34 3.79 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 1.19 0.00 0.00 96 K 7.51 4.21 0.00 1.66 1.75 0.00 1.60 0.00 0.00 1.69 0.00 0.00 2.83 0.00 0.00 3.04 0.00 0.00 0.00 0.00 0.89 1.20 7.81 97 H 8.12 4.10 0.00 2.98 3.09 0.00 5.86 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 K 6.73 3.81 0.00 1.87 1.68 0.00 1.55 0.00 0.00 1.50 0.00 0.00 3.11 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.42 1.40 7.81 99 I 8.80 4.23 2.02 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 1.29 0.84 1.09 0.00 0.00 100 P 0.00 4.58 0.00 1.69 1.70 0.00 3.17 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.54 1.56 0.00 101 V 8.42 3.33 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 0.89 0.00 0.00 0.40 0.00 0.00 102 K 7.83 3.96 0.00 1.60 1.88 0.00 1.52 0.00 0.00 1.93 0.00 0.00 3.08 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.42 1.44 7.81 103 Y 8.01 4.05 0.00 3.13 3.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 L 7.92 4.18 0.00 1.80 1.74 0.58 0.87 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 0.00 105 E 7.80 4.05 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 2.35 2.27 0.00 106 F 7.62 4.55 0.00 3.18 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 0.00 107 I 8.05 3.83 2.12 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.45 1.08 0.00 0.00 108 S 8.11 4.19 0.00 4.21 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 0.00 109 E 8.27 4.01 0.00 2.32 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.41 0.00 110 A 7.99 4.49 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.22 3.65 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 1.62 0.73 1.04 0.00 0.00 112 I 8.07 3.73 2.11 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.90 1.15 0.00 0.00 113 Q 8.48 4.03 0.00 2.24 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.81 0.00 0.00 0.00 0.00 0.00 2.40 2.54 0.00 114 V 8.10 3.53 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 1.00 0.00 0.00 0.98 0.00 0.00 115 L 7.91 3.72 0.00 1.02 0.26 0.70 0.83 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 0.00 116 Q 7.90 4.15 0.00 2.28 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.95 0.00 0.00 0.00 0.00 0.00 2.46 2.52 0.00 117 S 8.09 4.24 0.00 3.77 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 0.00 118 K 8.08 4.10 0.00 1.35 1.47 0.00 1.40 0.00 0.00 1.41 0.00 0.00 2.43 0.00 0.00 2.56 0.00 0.00 0.00 0.00 1.27 1.41 7.81 119 H 8.38 5.07 0.00 3.18 3.18 0.00 5.62 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 0.00 120 P 0.00 4.38 0.00 2.25 2.45 0.00 3.78 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 1.98 0.00 121 G 8.19 3.68 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 D 7.90 4.78 0.00 2.78 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 0.00 123 F 7.75 4.98 0.00 3.05 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 G 7.47 3.85 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 0.00 0.00 0.00 125 A 8.47 3.90 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 0.00 126 D 7.97 4.15 0.00 2.65 2.68 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 0.00 0.00 0.00 0.00 127 A 7.80 3.95 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 Q 7.90 3.29 0.00 1.96 1.92 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 1.82 1.46 0.00 129 G 7.84 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.05 3.84 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 0.00 131 M 8.16 4.01 0.00 2.46 2.39 0.00 0.00 0.00 0.00 0.00 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.76 2.90 0.00 132 S 8.30 4.15 0.00 3.89 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 0.00 133 K 8.18 3.87 0.00 1.82 1.69 0.00 1.55 0.00 0.00 1.47 0.00 0.00 2.88 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.38 1.49 7.81 134 A 7.90 3.81 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 L 8.29 4.08 0.00 1.74 1.81 0.99 0.83 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 0.00 136 E 8.58 3.94 0.00 2.12 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 2.42 2.31 0.00 137 L 8.07 3.94 0.00 1.84 1.93 1.05 1.05 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 0.00 138 F 8.38 4.09 0.00 3.20 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 0.00 139 R 8.36 3.55 0.00 1.90 1.86 0.00 3.15 0.00 0.00 3.34 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.86 0.00 140 N 8.18 4.22 0.00 2.73 2.82 0.00 0.00 7.10 7.78 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 0.00 141 D 8.02 4.35 0.00 2.63 2.71 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 0.00 142 M 7.65 3.79 0.00 1.49 1.63 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.90 0.00 143 A 7.98 3.65 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 0.00 144 A 7.95 3.93 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 0.00 145 K 8.37 4.05 0.00 2.03 1.98 0.00 1.72 0.00 0.00 1.68 0.00 0.00 2.99 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.65 1.66 7.81 146 Y 8.33 4.19 0.00 3.17 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 0.00 147 K 8.35 4.30 0.00 2.03 1.90 0.00 1.68 0.00 0.00 1.68 0.00 0.00 2.82 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.49 1.37 7.81 148 E 8.03 4.05 0.00 2.02 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 0.00 2.34 2.35 0.00 149 L 7.62 4.37 0.00 2.07 1.89 0.99 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 150 G 7.45 3.63 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 0.00 0.00 0.00 151 F 8.19 4.71 0.00 2.93 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 0.00 152 Q 9.35 3.99 0.00 2.14 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.56 0.00 0.00 0.00 0.00 0.00 2.56 2.45 0.00 153 G 7.13 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