NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 E 4.5608 8.2876 120.2364 56.3606 32.5250 177.3676 2 Y 4.1813 8.2993 117.6296 59.9877 38.2481 176.9788 3 Q 3.0570 7.2117 122.3384 58.3745 29.1822 179.5959 4 L 3.5471 7.4053 119.2598 57.5450 41.6768 179.5195 5 V 4.1675 7.9223 118.1105 66.1897 31.6830 178.1350 6 V 3.7301 8.5311 118.2901 66.3535 31.3101 177.7347 7 N 4.3093 8.5247 116.1629 56.0494 38.0291 177.3612 8 A 4.0028 7.6697 122.4238 55.0312 18.0907 179.6734 9 V 3.3838 7.7769 116.8454 66.0037 31.3668 178.0392 10 R 3.9252 7.7959 118.0850 59.5334 29.7030 178.4327 11 K 3.9718 7.4036 116.3225 59.0765 32.4571 178.2779 12 L 4.1695 8.9832 122.2212 58.1060 42.0180 178.9502 13 Q 4.1876 9.3531 118.4599 59.2140 28.3177 177.9436 14 E 3.8984 7.7819 120.5058 58.9732 29.6079 178.4694 15 S 4.2678 7.8066 112.2867 59.5936 62.4631 174.8981 16 G 3.9683 8.5807 110.3609 45.1817 0.0000 174.6267 17 F 4.4591 7.8193 119.6591 59.7689 39.7847 174.0182 18 Y 4.0618 7.7892 123.3073 56.7272 39.9910 174.1412 19 W 4.7468 8.4475 126.5569 55.3021 30.4069 175.9375 20 S 4.8357 8.8934 121.9332 58.3038 62.5447 174.8716 21 A 5.5445 8.1518 135.0000 53.0108 19.6321 176.2243 22 V 4.5986 7.3855 110.0569 60.3061 34.1212 174.6696 23 T 4.4411 8.1420 117.9975 62.5577 69.5383 174.3052 24 G 3.8552 8.0798 107.4378 49.4107 0.0000 175.5410 25 G 3.9581 7.9785 106.1706 46.1785 0.0000 175.1937 26 E 4.1616 8.2493 120.0820 59.0209 29.1829 179.2616 27 A 3.9363 7.8485 120.3556 55.2499 18.8433 179.1649 28 N 4.3005 7.6242 114.7212 56.4265 38.5494 177.7005 29 L 4.0359 8.4332 121.0234 57.5467 41.6455 179.3655 30 L 3.8876 7.7257 119.7096 58.5321 39.7806 179.3886 31 L 3.7235 7.4719 120.5193 58.7497 40.2996 179.1998 32 S 4.1983 8.0321 114.2845 60.9367 63.0853 175.8970 33 A 4.2054 7.7527 122.5804 54.1314 18.4800 176.0974 34 E 4.4043 7.9728 113.9965 57.0010 33.4998 175.4312 35 P 4.4497 0.0000 0.0000 61.2475 30.2739 175.8114 36 A 3.9508 7.6574 124.5130 54.6734 19.1020 177.9143 37 G 3.9078 8.8305 108.4873 46.4803 0.0000 173.4772 38 T 3.8172 7.2606 113.8844 60.8795 72.0319 173.3947 39 F 5.1734 7.3767 121.2002 55.7655 41.7468 174.3605 40 L 4.3216 8.1642 123.5720 53.1416 44.6959 174.4847 41 I 4.6255 6.9385 121.9852 59.0437 40.8123 174.1811 42 R 4.8199 8.6441 128.4906 54.4200 33.5579 174.3820 43 D 5.5688 8.9722 122.6720 52.6515 41.3628 175.6044 44 S 4.2033 9.2804 122.1022 58.5549 63.6263 175.8034 45 S 4.6672 8.6603 120.2150 58.0404 62.8122 171.4152 46 D 4.3991 8.6087 117.5218 55.2645 39.1452 175.8292 47 Q 3.9015 8.4618 114.2238 56.3954 28.7394 176.9484 48 R 4.4656 7.7224 116.2041 57.4952 29.0357 175.6840 49 H 5.2736 7.3411 112.2962 54.6697 29.4704 174.4699 50 F 4.5586 7.6419 119.1868 57.2142 43.2503 172.5618 51 F 5.7379 6.8049 118.5116 55.5001 41.0858 173.9781 52 T 4.9960 9.0679 116.7733 61.8035 72.2510 172.6527 53 L 5.5457 9.1970 126.8477 52.3797 44.7847 175.2229 54 S 5.7210 8.4158 116.7097 56.1475 67.2552 172.9425 55 V 5.0955 8.3760 113.1710 59.6347 35.7532 174.0357 56 K 4.7972 9.0490 121.8586 55.2562 33.7264 174.5917 57 T 4.6053 7.8942 118.0460 61.2327 70.3318 173.2288 58 Q 4.4048 8.6215 121.9608 56.7317 28.9064 175.8493 59 S 4.6028 8.4375 111.8877 58.2005 64.6263 173.2016 60 G 4.1673 6.9831 104.3097 43.3441 0.0000 173.5712 61 T 4.7815 8.1735 119.1727 62.3270 69.3849 174.0737 62 K 4.7366 8.7602 126.4212 54.5585 36.0317 173.8794 63 N 5.6443 8.7424 123.4389 52.0113 42.1497 173.0007 64 L 5.4692 9.8454 124.5334 53.1363 46.5689 175.6955 65 R 5.0662 8.6251 116.5317 54.2163 32.6081 174.6726 66 I 4.1339 7.8357 118.8036 60.5628 39.4411 174.5827 67 Q 4.7674 9.4197 127.5294 54.0727 31.3966 174.3494 68 C 4.7342 8.6803 119.4444 57.3218 31.1599 172.8387 69 E 4.3004 9.4525 126.5389 54.4960 29.1111 175.1015 70 G 4.2382 8.5520 115.4988 45.8772 0.0000 172.2539 71 G 4.2247 8.0343 102.0342 44.2712 0.0000 171.7090 72 S 4.9468 8.6456 114.1316 55.8458 65.8435 172.4230 73 F 5.0664 8.2178 123.1372 56.5299 40.9426 174.7374 74 S 4.6802 8.2537 120.5870 57.1573 65.3778 174.2767 75 L 4.3125 8.3962 126.5516 56.0306 42.3980 176.5571 76 Q 4.2888 8.1353 116.3582 56.1583 31.5338 174.8059 77 S 4.6259 8.6514 116.2596 59.0377 64.4715 173.1025 78 D 4.7827 7.8802 121.4584 52.0976 41.9995 175.9150 79 P 4.5924 0.0000 0.0000 62.5999 30.3654 176.3583 80 R 4.3906 7.6939 114.2702 57.2071 30.9434 176.2410 81 S 4.5904 7.4413 109.3286 57.3655 62.2442 174.0851 82 T 4.4283 7.7358 111.6868 62.2630 67.7272 174.4129 83 Q 4.0862 7.5948 121.3809 58.7785 29.1296 176.3682 84 P 4.4839 0.0000 0.0000 62.4021 32.4854 175.3337 85 V 4.3715 8.0585 110.9042 59.1797 33.7823 173.1724 86 P 4.5632 0.0000 0.0000 64.0227 31.6089 176.4821 87 R 4.5231 9.1067 116.5021 57.0262 27.9603 178.4475 88 F 4.4709 7.4080 111.9418 57.1048 37.1031 174.4751 89 D 4.5194 9.4249 121.5415 54.7902 42.3771 176.0309 90 C 3.0862 8.4140 116.7128 61.6692 27.2054 177.6138 91 V 4.1068 9.3564 134.1963 66.8992 30.7637 175.5521 92 L 4.2504 7.3403 117.8492 57.9994 41.3663 179.0589 93 K 4.1146 8.4521 118.8794 59.3893 32.0338 178.6628 94 L 4.1009 8.1699 120.6037 57.8786 42.0244 178.8668 95 V 3.7541 8.9939 120.4311 65.3378 30.8392 177.6516 96 H 4.1411 7.7245 117.9675 58.7948 29.6077 176.2682 97 H 4.2801 8.2234 119.4140 59.1420 29.8388 176.4826 98 Y 3.9682 7.5333 116.7360 60.2971 38.2522 174.4450 99 M 4.5950 8.7026 119.3173 53.8654 36.4554 171.8336 100 P 4.8329 0.0000 0.0000 61.6257 32.3711 173.9349 101 P 4.4806 0.0000 0.0000 61.6348 32.2104 175.8979 102 P 4.4197 0.0000 0.0000 63.4936 32.4410 174.0375 103 G 3.6081 8.6075 104.9955 45.4146 0.0000 172.9302 104 T 3.9925 7.9917 115.8658 61.0441 69.3693 173.9283 105 P 4.3191 0.0000 0.0000 64.5683 31.7981 177.0021 106 S 4.4055 7.2749 114.1017 58.5248 63.5998 174.5123 107 F 4.1980 8.6315 122.0236 58.4542 39.2637 172.7398 108 S 3.6931 7.7290 121.5492 56.8880 62.1638 173.1287 109 L 4.8407 7.6239 134.1066 55.8986 43.7565 172.9479 110 P 4.4067 0.0000 0.0000 61.6442 31.8828 174.8358 111 P 4.4554 0.0000 0.0000 62.4337 29.9433 175.5620 112 T 3.8722 8.4105 122.8715 66.4416 68.5529 173.9257 113 E 4.4259 7.6912 120.5046 53.3272 31.2567 172.9752 114 P 4.5172 0.0000 0.0000 62.7699 32.3813 175.8863 115 S 4.8071 8.1045 112.6822 57.8253 63.5003 175.5534 116 S 4.4241 7.8850 119.2964 57.3461 62.8979 174.1776 117 E 3.9439 8.0366 123.1528 57.4784 29.0884 178.2264 118 V 4.5410 7.6784 119.8919 59.8389 33.6494 172.3788 119 P 4.4247 0.0000 0.0000 62.5332 32.8085 176.9336 120 E 3.7881 8.5518 116.6589 56.8021 26.1358 173.8808 121 Q 4.4816 7.4754 116.1717 53.4910 33.3674 173.0153 122 P 4.3640 0.0000 0.0000 61.8926 31.7609 175.8479 123 P 4.4908 0.0000 0.0000 62.1085 29.2624 176.8907 124 A 4.4982 7.4040 121.7653 51.0436 19.2302 175.7864 125 Q 4.0347 7.7675 119.4142 57.7190 29.9607 177.3291 126 A 4.3594 7.6387 126.1598 50.5398 18.0736 178.4815 127 L 4.5326 7.0610 125.1906 52.5396 43.4242 174.8486 128 P 4.4976 0.0000 0.0000 62.6715 30.4409 176.6806 129 G 3.8222 7.9022 102.0961 46.6120 0.0000 174.2736 130 S 4.2388 7.7773 114.4453 58.0606 65.5219 175.2751 131 T 4.3036 8.1397 121.8881 60.5778 68.0774 171.9813 132 P 4.4313 0.0000 0.0000 62.4941 31.7140 172.9006 133 K 3.8024 7.7446 125.8272 56.0527 32.3834 174.9679 134 R 4.6917 8.6618 118.2482 53.6715 32.6556 174.4688 135 A 4.6568 7.1180 124.5393 52.1775 21.2235 175.2078 136 Y 4.5818 7.5702 123.2351 55.8402 41.4163 174.1255 137 Y 4.9788 7.8240 123.0092 56.3203 41.5094 173.5438 138 I 4.5877 8.2640 119.1763 60.0682 39.7024 174.6385 139 Y 4.7371 8.7847 123.3402 56.2425 39.1381 176.3091 140 S 4.4101 9.7875 121.7762 59.6055 61.8713 174.1770 141 G 4.3920 8.2477 102.3049 44.6282 0.0000 174.5018 142 G 5.0995 6.6911 122.2361 45.9046 0.0000 173.4861 143 E 4.4925 7.3383 120.3152 53.9079 31.4904 174.9479 144 K 4.0361 8.4919 124.0746 56.3912 32.9151 176.9894 145 I 4.0717 8.2008 128.6263 58.9887 37.9620 173.6209 146 P 4.1186 0.0000 0.0000 62.3036 31.8198 175.8021 147 L 4.8181 8.5377 122.0946 52.8120 45.4450 175.7626 148 V 4.3883 8.5226 123.3461 61.1573 32.2393 174.8006 149 L 4.9536 7.9801 127.2287 54.2967 43.0488 176.9632 150 S 4.8017 8.5613 113.0824 57.8848 63.1297 175.6450 151 R 4.6006 7.8267 120.3755 53.6552 33.3386 174.0325 152 P 4.5596 0.0000 0.0000 62.0928 32.4234 175.4192 153 L 4.3382 8.7296 122.3681 54.6583 42.9458 176.9685 154 S 4.6560 8.4201 120.4394 57.7118 62.0403 174.2298 155 S 3.4332 9.2561 118.0243 60.6133 62.6820 172.1905 156 N 4.6602 9.0487 116.8367 54.7696 38.5807 174.0798 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 E 8.29 4.56 0.00 2.21 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 0.00 2.39 2.39 0.00 2 Y 8.30 4.18 0.00 3.45 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 3 Q 7.21 3.06 0.00 1.27 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.82 0.00 0.00 0.00 0.00 0.00 1.93 2.07 0.00 4 L 7.41 3.55 0.00 1.98 0.27 0.98 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 5 V 7.92 4.17 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 1.26 0.00 0.00 0.15 0.00 0.00 6 V 8.53 3.73 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 1.26 0.00 0.00 7 N 8.52 4.31 0.00 2.83 2.73 0.00 0.00 6.92 7.04 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 8 A 7.67 4.00 1.34 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 9 V 7.78 3.38 2.26 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 0.57 0.00 0.00 1.06 0.00 0.00 10 R 7.80 3.93 0.00 1.92 2.08 0.00 3.12 0.00 0.00 3.07 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.62 0.00 11 K 7.40 3.97 0.00 1.81 1.79 0.00 1.83 0.00 0.00 1.61 0.00 0.00 2.98 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.44 1.42 7.81 12 L 8.98 4.17 0.00 1.70 1.78 0.83 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 13 Q 9.35 4.19 0.00 2.14 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.44 0.00 0.00 0.00 0.00 0.00 2.54 2.30 0.00 14 E 7.78 3.90 0.00 2.16 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 2.31 2.30 0.00 15 S 7.81 4.27 0.00 3.92 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 0.00 16 G 8.58 3.97 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 0.00 0.00 0.00 17 F 7.82 4.46 0.00 3.21 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 18 Y 7.79 4.06 0.00 3.39 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 19 W 8.45 4.75 0.00 3.05 3.24 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 20 S 8.89 4.84 0.00 3.78 3.88 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 21 A 8.15 5.54 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 22 V 7.39 4.60 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 0.89 0.00 0.00 1.00 0.00 0.00 23 T 8.14 4.44 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 1.23 0.00 0.00 24 G 8.08 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 0.00 0.00 0.00 25 G 7.98 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 26 E 8.25 4.16 0.00 2.03 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.39 0.00 27 A 7.85 3.94 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 N 7.62 4.30 0.00 2.78 3.05 0.00 0.00 7.20 6.59 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 29 L 8.43 4.04 0.00 1.82 1.71 1.00 0.57 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 30 L 7.73 3.89 0.00 1.76 2.03 0.44 0.71 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 31 L 7.47 3.72 0.00 1.77 1.64 0.96 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 32 S 8.03 4.20 0.00 4.04 4.05 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 33 A 7.75 4.21 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 34 E 7.97 4.40 0.00 1.93 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.27 0.00 35 P 0.00 4.45 0.00 2.04 2.08 0.00 3.71 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 1.80 1.54 0.00 36 A 7.66 3.95 1.24 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 37 G 8.83 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 T 7.26 3.82 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 39 F 7.38 5.17 0.00 3.05 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 40 L 8.16 4.32 0.00 1.21 1.01 0.22 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 41 I 6.94 4.63 1.72 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 1.19 1.31 -0.19 0.00 0.00 42 R 8.64 4.82 0.00 1.85 1.76 0.00 3.51 0.00 0.00 3.22 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.75 0.00 43 D 8.97 5.57 0.00 2.95 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 S 9.28 4.20 0.00 4.18 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 45 S 8.66 4.67 0.00 3.93 3.64 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 46 D 8.61 4.40 0.00 2.82 2.40 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 47 Q 8.46 3.90 0.00 1.96 1.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.64 5.82 0.00 0.00 0.00 0.00 0.00 2.35 2.27 0.00 48 R 7.72 4.47 0.00 2.00 2.10 0.00 3.15 0.00 0.00 3.38 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.60 0.00 49 H 7.34 5.27 0.00 3.47 3.53 0.00 5.76 0.00 0.00 0.00 0.00 7.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 F 7.64 4.56 0.00 3.18 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 51 F 6.80 5.74 0.00 3.19 3.33 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 52 T 9.07 5.00 4.32 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 1.37 0.00 0.00 53 L 9.20 5.55 0.00 0.94 0.13 0.50 0.81 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 54 S 8.42 5.72 0.00 4.07 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 55 V 8.38 5.10 1.09 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 0.17 0.00 0.00 0.89 0.00 0.00 56 K 9.05 4.80 0.00 1.79 1.81 0.00 1.80 0.00 0.00 1.66 0.00 0.00 2.94 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.38 1.42 7.81 57 T 7.89 4.61 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 1.26 0.00 0.00 58 Q 8.62 4.40 0.00 2.08 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.62 0.00 0.00 0.00 0.00 0.00 2.36 2.34 0.00 59 S 8.44 4.60 0.00 3.85 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 60 G 6.98 4.17 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 0.00 61 T 8.17 4.78 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 1.28 0.00 0.00 62 K 8.76 4.74 0.00 1.84 1.67 0.00 1.66 0.00 0.00 1.68 0.00 0.00 2.77 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.45 1.42 7.81 63 N 8.74 5.64 0.00 2.86 2.67 0.00 0.00 7.03 6.95 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 64 L 9.85 5.47 0.00 2.09 1.81 0.75 0.64 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 65 R 8.63 5.07 0.00 2.12 2.03 0.00 3.19 0.00 0.00 3.24 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.76 0.00 66 I 7.84 4.13 1.93 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 -0.30 0.16 0.13 0.00 0.00 67 Q 9.42 4.77 0.00 2.02 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.67 0.00 0.00 0.00 0.00 0.00 2.28 2.38 0.00 68 C 8.68 4.73 0.00 3.12 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 69 E 9.45 4.30 0.00 1.96 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 0.00 2.22 2.38 0.00 70 G 8.55 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 71 G 8.03 4.22 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 0.00 0.00 0.00 72 S 8.65 4.95 0.00 4.10 4.03 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 73 F 8.22 5.07 0.00 2.52 3.18 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 0.00 0.00 0.00 0.00 74 S 8.25 4.68 0.00 3.95 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 75 L 8.40 4.31 0.00 1.54 1.52 0.71 0.64 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 76 Q 8.14 4.29 0.00 1.91 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.79 6.51 0.00 0.00 0.00 0.00 0.00 2.18 2.35 0.00 77 S 8.65 4.63 0.00 3.77 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 D 7.88 4.78 0.00 2.64 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 79 P 0.00 4.59 0.00 2.19 2.14 0.00 3.76 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 1.99 1.96 0.00 80 R 7.69 4.39 0.00 1.77 1.94 0.00 3.25 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 1.58 1.67 0.00 81 S 7.44 4.59 0.00 3.81 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 82 T 7.74 4.43 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 1.21 0.00 0.00 83 Q 7.59 4.09 0.00 2.04 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.60 0.00 0.00 0.00 0.00 0.00 2.37 2.46 0.00 84 P 0.00 4.48 0.00 1.97 1.85 0.00 3.70 0.00 0.00 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.41 0.00 85 V 8.06 4.37 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 1.04 0.00 0.00 1.05 0.00 0.00 86 P 0.00 4.56 0.00 2.22 2.12 0.00 3.91 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 2.03 1.99 0.00 87 R 9.11 4.52 0.00 2.05 2.18 0.00 2.63 0.00 0.00 3.94 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.50 0.00 88 F 7.41 4.47 0.00 3.22 3.38 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 89 D 9.42 4.52 0.00 3.06 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 C 8.41 3.09 0.00 2.43 1.18 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 0.00 0.00 0.00 0.00 91 V 9.36 4.11 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 1.16 0.00 0.00 1.12 0.00 0.00 92 L 7.34 4.25 0.00 1.79 1.83 0.89 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 93 K 8.45 4.11 0.00 1.42 2.24 0.00 1.61 0.00 0.00 1.90 0.00 0.00 2.89 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.39 1.05 7.81 94 L 8.17 4.10 0.00 1.98 1.99 0.87 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 95 V 8.99 3.75 2.35 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 0.79 0.00 0.00 0.87 0.00 0.00 96 H 7.72 4.14 0.00 3.20 3.51 0.00 5.61 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 H 8.22 4.28 0.00 3.16 3.21 0.00 6.00 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 98 Y 7.53 3.97 0.00 3.07 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 99 M 8.70 4.59 0.00 1.95 1.93 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.52 0.00 100 P 0.00 4.83 0.00 2.20 2.12 0.00 3.80 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.99 0.00 101 P 0.00 4.48 0.00 2.16 1.96 0.00 3.79 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 1.98 1.94 0.00 102 P 0.00 4.42 0.00 2.19 2.11 0.00 3.77 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.95 0.00 103 G 8.61 3.61 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 T 7.99 3.99 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 1.22 0.00 0.00 105 P 0.00 4.32 0.00 2.23 2.24 0.00 3.78 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.97 0.00 106 S 7.27 4.41 0.00 4.02 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 F 8.63 4.20 0.00 3.03 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 0.00 108 S 7.73 3.69 0.00 4.10 3.80 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 0.00 109 L 7.62 4.84 0.00 1.60 1.67 0.94 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 0.00 0.00 0.00 0.00 0.00 0.00 110 P 0.00 4.41 0.00 2.26 2.06 0.00 3.81 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 2.06 1.99 0.00 111 P 0.00 4.46 0.00 2.19 2.15 0.00 3.82 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.99 0.00 112 T 8.41 3.87 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 1.24 0.00 0.00 113 E 7.69 4.43 0.00 1.79 1.73 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 2.14 2.23 0.00 114 P 0.00 4.52 0.00 2.21 2.02 0.00 3.74 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.94 0.00 115 S 8.10 4.81 0.00 3.77 3.79 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 0.00 116 S 7.88 4.42 0.00 4.01 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 0.00 117 E 8.04 3.94 0.00 1.95 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.44 0.00 118 V 7.68 4.54 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 0.85 0.00 0.00 0.93 0.00 0.00 119 P 0.00 4.42 0.00 2.17 2.05 0.00 3.91 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.98 0.00 120 E 8.55 3.79 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 2.22 2.30 0.00 121 Q 7.48 4.48 0.00 2.11 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 7.03 0.00 0.00 0.00 0.00 0.00 2.26 2.34 0.00 122 P 0.00 4.36 0.00 2.17 2.08 0.00 3.75 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.94 0.00 123 P 0.00 4.49 0.00 2.19 2.13 0.00 3.69 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.95 0.00 124 A 7.40 4.50 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 Q 7.77 4.03 0.00 2.02 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 7.48 0.00 0.00 0.00 0.00 0.00 2.27 2.31 0.00 126 A 7.64 4.36 1.24 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 0.00 127 L 7.06 4.53 0.00 1.54 1.55 0.92 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 0.00 128 P 0.00 4.50 0.00 2.21 2.08 0.00 3.96 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.96 0.00 129 G 7.90 3.82 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 0.00 130 S 7.78 4.24 0.00 3.82 3.76 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 0.00 131 T 8.14 4.30 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 1.22 0.00 0.00 132 P 0.00 4.43 0.00 2.23 2.14 0.00 4.00 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 2.05 2.00 0.00 133 K 7.74 3.80 0.00 1.97 1.90 0.00 1.54 0.00 0.00 1.85 0.00 0.00 3.22 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.38 1.41 7.81 134 R 8.66 4.69 0.00 1.62 1.60 0.00 3.39 0.00 0.00 3.24 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.42 0.00 135 A 7.12 4.66 1.34 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 0.00 136 Y 7.57 4.58 0.00 2.91 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 Y 7.82 4.98 0.00 3.00 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 0.00 138 I 8.26 4.59 1.95 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.82 0.99 0.00 0.00 139 Y 8.78 4.74 0.00 2.79 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 S 9.79 4.41 0.00 3.97 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 0.00 141 G 8.25 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 0.00 0.00 0.00 0.00 142 G 6.69 5.10 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 0.00 0.00 0.00 143 E 7.34 4.49 0.00 1.99 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.25 0.00 144 K 8.49 4.04 0.00 1.25 1.71 0.00 1.47 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.20 1.07 7.81 145 I 8.20 4.07 2.04 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 1.25 0.95 0.89 0.00 0.00 146 P 0.00 4.12 0.00 1.86 1.50 0.00 3.44 0.00 0.00 3.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.69 0.00 147 L 8.54 4.82 0.00 1.94 1.60 1.03 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 148 V 8.52 4.39 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 0.83 0.00 0.00 0.95 0.00 0.00 149 L 7.98 4.95 0.00 0.51 1.30 0.84 0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 150 S 8.56 4.80 0.00 3.87 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 0.00 151 R 7.83 4.60 0.00 1.42 1.53 0.00 3.28 0.00 0.00 3.31 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.49 0.00 152 P 0.00 4.56 0.00 2.23 2.04 0.00 3.74 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.96 0.00 153 L 8.73 4.34 0.00 1.75 1.85 0.54 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 154 S 8.42 4.66 0.00 3.89 3.79 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 0.00 155 S 9.26 3.43 0.00 4.05 3.82 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 0.00 156 N 9.05 4.66 0.00 2.90 2.81 0.00 0.00 6.67 7.60 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