NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 K 4.2783 8.3144 120.1355 56.6846 33.0359 174.2419 5 T 4.4225 8.1159 118.3680 59.1139 70.4387 172.0573 6 C 5.6302 9.1591 120.5166 57.2538 42.5366 172.8136 7 D 5.1588 8.8490 121.4331 52.7353 43.2142 175.8328 8 L 5.2787 8.6688 122.5102 51.9046 44.3809 176.5732 9 V 3.6424 8.1841 120.4863 62.8549 31.8852 176.7621 10 G 3.9659 8.8459 110.9137 44.9079 0.0000 172.6925 11 E 4.0816 8.5770 121.4638 55.2431 30.3456 176.0862 12 K 4.2706 8.3052 123.2839 57.9588 32.7414 174.8940 13 G 4.2128 8.7899 113.8274 46.0550 0.0000 174.4651 14 K 4.3723 7.4912 115.6372 56.1489 32.1932 176.9240 15 E 4.2057 7.7597 118.8026 55.6743 30.3757 177.0146 16 S 4.2173 8.4808 116.2385 58.3096 63.5149 175.0039 17 E 4.0170 8.8595 129.6587 58.8792 29.5624 178.9548 18 K 3.9618 7.9505 118.4222 59.6501 32.3185 178.9725 19 E 4.0758 8.0505 118.2804 59.2874 29.2917 179.5930 20 L 4.0202 8.1754 118.9795 57.7905 41.6220 179.3027 21 A 4.0264 8.2337 120.7308 55.0574 18.2140 179.7482 22 L 3.9761 7.8337 117.5042 57.7729 41.5435 179.4150 23 L 4.1213 7.8952 118.0374 57.8230 41.4092 179.1336 24 K 4.0253 8.2531 119.5236 59.5394 31.8523 178.8315 25 R 3.8793 7.4552 118.2765 59.1004 30.2924 177.7365 26 L 4.1981 7.9165 116.7157 55.3123 41.6814 178.7095 27 T 2.0000 6.9464 117.1862 65.6180 68.2318 173.9647 28 P 4.1819 0.0000 0.0000 64.8852 31.4685 177.0267 29 L 4.4976 7.9454 118.3222 55.1913 41.9165 178.1730 30 F 4.6656 8.2935 120.2707 60.0329 38.9788 176.5776 31 Q 4.0795 8.0298 114.3924 58.0352 28.9551 176.5106 32 K 4.0450 7.3604 117.9731 55.8935 32.8810 175.9534 33 S 4.2645 7.4605 114.3534 56.4096 65.6185 172.9838 34 F 5.0409 8.7437 124.4905 55.6948 42.2521 173.7717 35 E 5.5333 8.6865 121.7855 54.1258 33.2116 174.2191 36 S 4.8240 8.6740 115.8278 57.8496 66.1291 173.6916 37 T 5.6384 8.8255 122.9534 61.5227 70.3697 173.4577 38 V 4.4236 8.7424 126.1115 61.4017 35.1708 174.7238 39 G 4.5462 8.9304 109.0574 46.1197 0.0000 172.9612 40 Q 4.4192 8.1825 115.1964 57.0449 30.1377 176.6212 41 S 4.5678 7.2115 111.9693 59.4934 68.7952 173.7799 42 P 4.3764 0.0000 0.0000 63.0891 31.0964 176.0064 43 D 4.2877 7.5443 115.8252 53.8425 42.8441 174.5362 44 M 4.6211 7.4956 119.1555 56.7940 30.6286 174.4344 45 Y 5.3120 9.2565 120.7241 55.9194 41.9303 174.4845 46 S 5.0641 9.1241 116.7692 56.9628 65.7164 172.1258 47 Y 5.1462 9.7519 126.3104 56.6488 39.8532 174.8069 48 V 4.8336 8.9311 125.2488 61.1314 33.8140 174.1029 49 F 5.6139 9.3266 130.1617 56.6593 42.2720 173.9331 50 R 4.3871 8.5406 122.8690 54.4895 34.3768 175.3201 51 V 4.0025 7.9503 120.8689 62.2953 31.2362 176.1215 52 C 3.3684 9.3148 124.7638 57.3462 37.9563 173.6909 53 R 3.9978 6.6426 115.8934 53.4999 33.5688 174.6034 54 E 4.1637 8.6156 120.9417 57.0510 29.4322 176.4965 55 A 4.3268 9.2003 129.5791 52.1350 19.3228 176.3183 56 G 4.2012 7.8416 104.2999 44.0337 0.0000 173.1646 57 Q 4.6964 9.0405 115.8019 56.0753 28.8696 176.4032 58 H 4.7533 7.9669 111.9159 54.6617 30.2883 174.0734 59 S 4.4726 8.1974 113.6146 59.6107 60.2555 172.8013 60 S 4.3968 7.6575 112.0373 58.0547 62.7133 173.8848 61 G 3.4052 8.7751 109.3754 46.6507 0.0000 173.2716 62 A 4.4373 8.7781 122.0223 51.3303 19.6308 179.5488 63 G 3.5269 9.1139 109.2260 46.7620 0.0000 173.3698 64 L 5.1799 7.5407 121.6409 54.4331 45.4815 174.0516 65 V 4.8720 9.0985 119.9372 59.5454 35.6785 174.5583 66 Q 4.5893 9.1936 124.8942 54.5802 31.1818 174.1480 67 I 4.7133 8.7685 128.9844 59.8835 39.3998 175.0555 68 Q 4.5421 8.6936 129.1962 54.9845 28.9403 175.9000 69 K 3.7819 8.7012 129.6457 59.6796 32.3597 177.8436 70 S 4.2334 8.1652 111.7451 61.1464 62.4643 174.8916 71 N 4.7721 8.1149 116.5288 50.8091 37.3934 174.9917 72 G 4.0378 8.4387 104.7287 46.4475 0.0000 174.0503 73 K 4.1089 7.6321 119.5855 56.2598 33.1107 175.5588 74 E 4.6509 8.7313 126.2629 55.2679 30.7903 174.9221 75 T 4.5724 8.5966 123.9952 61.7040 71.6015 173.7260 76 V 4.1473 9.1237 126.7838 62.2119 31.9672 176.6352 77 V 3.5760 8.8599 129.4998 65.4415 32.8052 175.8382 78 G 4.3196 7.7689 104.7158 45.1989 0.0000 172.2210 79 R 4.9634 9.4886 120.9281 52.5806 33.2605 176.8218 80 F 4.8496 8.1462 115.8487 56.9892 37.6836 175.7382 81 N 4.9647 7.6067 116.2836 53.1012 38.0719 174.5188 82 E 4.8540 8.0613 117.5145 56.0758 29.9620 175.0380 83 T 5.3269 8.4514 116.8458 62.5972 71.4661 175.5985 84 Q 5.0225 9.0289 125.4440 54.5713 32.7647 173.7605 85 I 5.4727 9.3097 118.1907 59.3861 41.0620 174.0012 86 F 5.0361 8.0220 116.4801 56.1891 40.6455 172.5325 87 Q 3.9603 8.6253 117.6471 54.2039 31.3655 175.5945 88 G 3.6721 5.5238 110.0085 44.7416 0.0000 174.4635 89 S 4.2287 8.9162 114.8670 61.0478 63.5111 175.6171 90 N 5.3550 8.2332 118.3290 49.9207 38.3630 173.3585 91 W 5.6334 7.3917 114.3592 56.6146 32.3166 173.0268 92 I 4.6816 9.1216 120.9476 59.8539 40.9089 173.9200 93 M 4.8942 8.8431 127.4699 53.7414 34.2887 174.1273 94 L 5.0260 8.7598 128.0668 53.2919 45.3639 174.9769 95 I 5.1427 8.7089 125.8797 59.8478 41.3068 173.6313 96 Y 5.3279 8.8949 124.7096 56.6477 40.3688 175.3053 97 K 4.8624 8.7757 125.4365 55.5455 35.8785 177.5054 98 G 3.9648 8.9355 111.8064 47.3156 0.0000 173.9955 99 G 4.0417 7.6981 106.8444 44.3811 0.0000 173.9249 100 D 4.6361 8.8084 120.0753 54.1916 41.8243 176.6783 101 E 4.6296 8.6569 121.6785 56.7780 30.4868 176.5379 102 Y 4.2906 8.8309 120.9642 58.3608 38.8801 176.2867 103 D 4.6821 9.0215 121.1384 55.8584 42.1101 177.2322 104 N 5.1498 8.0541 114.3857 52.7347 40.2207 173.4916 105 H 4.6966 8.1152 113.0149 55.2923 32.9843 173.6886 106 C 4.8257 8.9831 115.1039 57.0467 37.7321 174.3899 107 G 3.9709 8.5975 102.1429 46.1922 0.0000 174.2310 108 R 4.4885 8.3041 115.3343 55.6861 28.4469 176.4145 109 E 4.5652 7.8537 114.4330 55.4423 31.7937 176.1832 110 Q 4.6437 8.6153 119.3847 56.1833 29.7114 176.7788 111 R 4.3657 8.4230 121.0383 56.4926 31.7373 175.5756 112 R 5.2394 8.7576 119.3209 54.8614 34.3626 173.2793 113 A 5.4482 9.1412 126.5302 50.2722 22.1756 174.9792 114 V 4.7062 9.7083 123.6405 61.2595 34.0222 174.5298 115 V 4.7879 8.8757 129.2522 61.3228 33.7344 174.0187 116 M 4.4862 8.9482 129.5595 54.9388 33.5069 174.9198 117 I 4.6135 9.0601 128.6268 60.0222 38.9259 175.2608 118 S 5.0993 8.6757 123.9385 57.3066 64.9814 173.1501 119 C 4.8754 8.5705 123.5904 56.7790 40.4436 172.6835 120 N 4.8892 8.9750 124.5411 52.0214 40.7818 175.1037 121 R 3.9497 8.8640 126.3516 59.1462 30.3523 177.8904 122 H 4.5247 8.2360 113.6257 57.3904 29.4145 175.1925 123 T 4.5641 7.5713 113.1125 60.4951 70.6223 173.8593 124 L 3.9045 9.0097 128.9137 57.3666 42.4335 176.8638 125 A 5.0272 6.9924 115.1536 52.1218 21.7557 174.5033 126 D 4.4483 8.4306 120.4888 55.0706 43.7042 174.9551 127 N 4.4026 8.3123 115.7587 54.1691 35.4954 174.6842 128 F 4.6033 8.4835 120.4848 58.3693 39.6845 173.3191 129 N 4.8060 8.9148 127.2542 50.9319 42.0920 171.7869 130 P 4.2446 0.0000 0.0000 62.8573 31.7579 175.5490 131 V 4.1576 7.9075 123.5116 63.9362 33.4297 175.2094 132 S 4.4095 6.8995 112.0160 57.7197 66.0603 173.3997 133 E 4.2512 8.2344 120.0659 54.2887 32.3051 174.3310 134 E 4.2013 8.4628 129.4064 53.9341 30.4221 175.7938 135 R 4.3690 8.0583 125.9970 55.8620 30.0389 176.4536 136 G 4.0132 9.0730 105.2014 46.0627 0.0000 173.7155 137 K 4.6476 7.4702 118.4045 54.0416 34.9565 177.5784 138 V 3.8069 8.2379 113.2329 63.4562 31.7894 176.0289 139 Q 4.4401 7.9437 115.2852 56.0915 30.8858 172.7211 140 D 4.3996 8.8941 115.2396 55.7815 37.8150 173.8913 141 C 5.0058 8.6908 116.5283 55.8311 39.8097 174.1697 142 F 5.0433 7.4570 114.6698 57.5064 41.1130 172.1482 143 Y 4.7736 8.8920 117.3777 56.0784 40.5394 174.7555 144 L 5.2592 8.3885 125.5984 53.5218 45.0150 175.0680 145 F 5.0526 8.9151 122.3671 56.2128 44.1961 173.0770 146 E 5.3190 8.9649 119.0727 55.5107 34.3027 174.4428 147 M 5.0492 8.5116 116.6350 55.7637 35.0487 173.4902 148 D 5.3388 8.7368 120.3996 53.6961 43.8492 175.5707 149 S 5.1793 8.3662 111.1456 58.6428 65.7051 177.1724 150 S 4.4436 8.6372 120.9071 60.4325 63.3586 176.4094 151 L 4.0066 7.7337 120.6028 57.3003 41.1832 177.6949 152 A 4.2088 7.9204 119.7468 52.8337 18.8469 177.6593 153 C 4.7033 7.7359 113.7240 56.0217 41.6655 174.1226 154 S 4.2208 8.2102 116.1597 58.9380 63.4152 174.2823 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 4 K 8.31 4.28 0.00 1.83 2.03 0.00 1.70 0.00 0.00 1.72 0.00 0.00 2.99 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.37 1.43 7.81 5 T 8.12 4.42 4.18 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 1.24 0.00 0.00 6 C 9.16 5.63 0.00 2.98 3.17 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 7 D 8.85 5.16 0.00 2.67 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 8 L 8.67 5.28 0.00 1.57 1.65 0.98 1.20 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 9 V 8.18 3.64 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 0.73 0.00 0.00 0.95 0.00 0.00 10 G 8.85 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 11 E 8.58 4.08 0.00 2.02 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 2.39 2.31 0.00 12 K 8.31 4.27 0.00 1.75 1.71 0.00 2.03 0.00 0.00 1.73 0.00 0.00 3.10 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.44 1.52 7.81 13 G 8.79 4.21 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 0.00 14 K 7.49 4.37 0.00 1.89 1.85 0.00 1.73 0.00 0.00 1.71 0.00 0.00 2.86 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.45 1.55 7.81 15 E 7.76 4.21 0.00 1.98 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 2.34 2.48 0.00 16 S 8.48 4.22 0.00 3.91 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 17 E 8.86 4.02 0.00 2.13 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.47 0.00 18 K 7.95 3.96 0.00 1.86 1.86 0.00 1.73 0.00 0.00 1.82 0.00 0.00 2.94 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.53 1.53 7.81 19 E 8.05 4.08 0.00 2.20 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 2.59 2.40 0.00 20 L 8.18 4.02 0.00 1.88 1.74 0.97 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 21 A 8.23 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 22 L 7.83 3.98 0.00 1.99 1.74 0.91 0.48 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 23 L 7.90 4.12 0.00 1.88 1.90 1.02 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 24 K 8.25 4.03 0.00 1.96 1.97 0.00 1.63 0.00 0.00 1.56 0.00 0.00 2.89 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.40 1.44 7.81 25 R 7.46 3.88 0.00 1.88 2.12 0.00 3.26 0.00 0.00 3.18 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.62 0.00 26 L 7.92 4.20 0.00 1.85 1.76 0.99 0.61 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 27 T 6.95 2.00 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 0.92 0.00 0.00 28 P 0.00 4.18 0.00 2.16 2.10 0.00 3.54 0.00 0.00 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.97 0.00 29 L 7.95 4.50 0.00 1.89 1.88 1.02 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 30 F 8.29 4.67 0.00 2.92 2.95 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 31 Q 8.03 4.08 0.00 2.12 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.53 7.05 0.00 0.00 0.00 0.00 0.00 2.29 2.32 0.00 32 K 7.36 4.05 0.00 1.75 1.08 0.00 1.75 0.00 0.00 1.74 0.00 0.00 2.94 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.34 1.31 7.81 33 S 7.46 4.26 0.00 3.58 3.42 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 34 F 8.74 5.04 0.00 2.62 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 E 8.69 5.53 0.00 1.96 1.85 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 2.28 2.13 0.00 36 S 8.67 4.82 0.00 4.41 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 37 T 8.83 5.64 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 1.28 0.00 0.00 38 V 8.74 4.42 2.41 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 1.01 0.00 0.00 1.11 0.00 0.00 39 G 8.93 4.55 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 40 Q 8.18 4.42 0.00 2.02 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.77 0.00 0.00 0.00 0.00 0.00 2.28 2.29 0.00 41 S 7.21 4.57 0.00 3.79 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 P 0.00 4.38 0.00 2.16 2.11 0.00 3.66 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.93 0.00 43 D 7.54 4.29 0.00 2.62 2.67 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 44 M 7.50 4.62 0.00 1.91 2.02 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.72 0.00 45 Y 9.26 5.31 0.00 2.78 2.23 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 46 S 9.12 5.06 0.00 3.84 3.69 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 47 Y 9.75 5.15 0.00 3.33 3.13 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 48 V 8.93 4.83 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 1.00 0.00 0.00 0.98 0.00 0.00 49 F 9.33 5.61 0.00 2.58 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 0.00 0.00 0.00 0.00 50 R 8.54 4.39 0.00 1.63 1.47 0.00 3.05 0.00 0.00 3.16 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.41 0.00 51 V 7.95 4.00 2.23 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 1.22 0.00 0.00 0.86 0.00 0.00 52 C 9.31 3.37 0.00 1.88 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 53 R 6.64 4.00 0.00 1.41 1.50 0.00 3.19 0.00 0.00 2.82 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 1.55 0.00 54 E 8.62 4.16 0.00 1.99 1.89 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 2.31 2.63 0.00 55 A 9.20 4.33 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 56 G 7.84 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 0.00 0.00 0.00 0.00 57 Q 9.04 4.70 0.00 2.09 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.85 0.00 0.00 0.00 0.00 0.00 2.29 2.30 0.00 58 H 7.97 4.75 0.00 3.16 3.25 0.00 5.96 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 59 S 8.20 4.47 0.00 3.98 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 60 S 7.66 4.40 0.00 3.86 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 G 8.78 3.41 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 62 A 8.78 4.44 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 G 9.11 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 64 L 7.54 5.18 0.00 2.04 1.59 -0.05 0.93 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 65 V 9.10 4.87 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 0.65 0.00 0.00 0.98 0.00 0.00 66 Q 9.19 4.59 0.00 2.03 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.81 0.00 0.00 0.00 0.00 0.00 1.88 1.26 0.00 67 I 8.77 4.71 1.95 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 1.10 0.51 0.92 0.00 0.00 68 Q 8.69 4.54 0.00 2.29 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.70 0.00 0.00 0.00 0.00 0.00 2.36 2.23 0.00 69 K 8.70 3.78 0.00 1.89 1.82 0.00 1.77 0.00 0.00 1.77 0.00 0.00 3.16 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.46 1.46 7.81 70 S 8.17 4.23 0.00 3.99 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 71 N 8.11 4.77 0.00 2.86 3.03 0.00 0.00 6.03 7.19 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 72 G 8.44 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 0.00 0.00 0.00 0.00 73 K 7.63 4.11 0.00 1.75 1.77 0.00 1.67 0.00 0.00 1.59 0.00 0.00 2.88 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.47 1.41 7.81 74 E 8.73 4.65 0.00 1.89 1.64 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 2.11 2.27 0.00 75 T 8.60 4.57 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 1.17 0.00 0.00 76 V 9.12 4.15 2.28 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 0.93 0.00 0.00 0.87 0.00 0.00 77 V 8.86 3.58 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.00 0.00 0.65 0.00 0.00 78 G 7.77 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 0.00 0.00 0.00 0.00 79 R 9.49 4.96 0.00 1.67 1.61 0.00 3.21 0.00 0.00 3.14 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.34 0.00 80 F 8.15 4.85 0.00 3.22 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 81 N 7.61 4.96 0.00 2.89 2.61 0.00 0.00 5.93 7.66 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 82 E 8.06 4.85 0.00 2.05 1.93 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 2.24 2.27 0.00 83 T 8.45 5.33 4.56 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 1.35 0.00 0.00 84 Q 9.03 5.02 0.00 2.19 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.71 0.00 0.00 0.00 0.00 0.00 2.50 2.57 0.00 85 I 9.31 5.47 1.89 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 1.00 1.87 0.98 0.00 0.00 86 F 8.02 5.04 0.00 3.07 3.10 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 87 Q 8.63 3.96 0.00 1.69 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.75 0.00 0.00 0.00 0.00 0.00 2.06 2.11 0.00 88 G 5.52 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 89 S 8.92 4.23 0.00 4.01 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 0.00 90 N 8.23 5.35 0.00 2.78 3.04 0.00 0.00 6.25 8.88 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 91 W 7.39 5.63 0.00 3.46 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 92 I 9.12 4.68 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 0.92 0.47 0.87 0.00 0.00 93 M 8.84 4.89 0.00 0.91 1.81 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.34 0.00 94 L 8.76 5.03 0.00 1.72 1.52 0.72 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 95 I 8.71 5.14 1.98 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 1.27 0.89 1.01 0.00 0.00 96 Y 8.89 5.33 0.00 2.99 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 97 K 8.78 4.86 0.00 1.86 1.81 0.00 1.86 0.00 0.00 1.72 0.00 0.00 2.91 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.46 1.47 7.81 98 G 8.94 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 99 G 7.70 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 0.00 0.00 0.00 0.00 100 D 8.81 4.64 0.00 2.50 2.55 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 0.00 101 E 8.66 4.63 0.00 1.87 1.93 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 2.51 2.37 0.00 102 Y 8.83 4.29 0.00 3.05 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 D 9.02 4.68 0.00 2.75 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 0.00 104 N 8.05 5.15 0.00 2.66 2.67 0.00 0.00 6.68 8.16 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 0.00 105 H 8.12 4.70 0.00 2.60 2.52 0.00 5.96 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 C 8.98 4.83 0.00 2.96 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 0.00 107 G 8.60 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 0.00 108 R 8.30 4.49 0.00 1.98 2.12 0.00 3.24 0.00 0.00 3.16 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.56 0.00 109 E 7.85 4.57 0.00 2.08 2.30 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 2.51 2.45 0.00 110 Q 8.62 4.64 0.00 2.01 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.63 7.08 0.00 0.00 0.00 0.00 0.00 2.47 2.43 0.00 111 R 8.42 4.37 0.00 1.78 1.90 0.00 2.84 0.00 0.00 3.16 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 1.54 0.00 112 R 8.76 5.24 0.00 2.02 2.11 0.00 3.38 0.00 0.00 3.42 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.78 0.00 113 A 9.14 5.45 1.41 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 0.00 114 V 9.71 4.71 2.24 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 0.89 0.00 0.00 0.87 0.00 0.00 115 V 8.88 4.79 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 0.77 0.00 0.00 0.44 0.00 0.00 116 M 8.95 4.49 0.00 2.13 1.85 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.47 0.00 117 I 9.06 4.61 2.00 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 1.26 0.74 0.93 0.00 0.00 118 S 8.68 5.10 0.00 3.82 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 0.00 119 C 8.57 4.88 0.00 3.10 3.10 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 0.00 120 N 8.97 4.89 0.00 2.82 2.65 0.00 0.00 6.79 7.22 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 0.00 121 R 8.86 3.95 0.00 1.67 1.91 0.00 3.39 0.00 0.00 3.20 7.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.56 0.00 122 H 8.24 4.52 0.00 3.41 3.36 0.00 5.70 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 T 7.57 4.56 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 0.00 124 L 9.01 3.90 0.00 1.78 1.70 0.92 1.24 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 0.00 125 A 6.99 5.03 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 0.00 126 D 8.43 4.45 0.00 2.82 2.55 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 0.00 127 N 8.31 4.40 0.00 3.11 2.93 0.00 0.00 6.44 8.13 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 0.00 128 F 8.48 4.60 0.00 2.89 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 0.00 129 N 8.91 4.81 0.00 2.63 2.49 0.00 0.00 6.83 7.57 0.00 0.00 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 P 0.00 4.24 0.00 1.91 1.57 0.00 3.64 0.00 0.00 3.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.11 0.00 131 V 7.91 4.16 1.89 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 0.69 0.00 0.00 0.84 0.00 0.00 132 S 6.90 4.41 0.00 3.67 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 0.00 133 E 8.23 4.25 0.00 1.41 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 1.47 1.47 0.00 134 E 8.46 4.20 0.00 1.40 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 0.00 0.00 0.00 2.15 2.12 0.00 135 R 8.06 4.37 0.00 1.32 1.70 0.00 2.38 0.00 0.00 2.93 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 1.35 0.00 136 G 9.07 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 0.00 137 K 7.47 4.65 0.00 1.88 1.72 0.00 1.69 0.00 0.00 1.85 0.00 0.00 3.06 0.00 0.00 3.36 0.00 0.00 0.00 0.00 1.40 1.39 7.81 138 V 8.24 3.81 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 0.71 0.00 0.00 0.93 0.00 0.00 139 Q 7.94 4.44 0.00 2.13 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.89 0.00 0.00 0.00 0.00 0.00 2.19 2.35 0.00 140 D 8.89 4.40 0.00 2.91 2.83 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 0.00 0.00 0.00 141 C 8.69 5.01 0.00 3.09 3.21 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 0.00 142 F 7.46 5.04 0.00 3.27 3.25 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 0.00 143 Y 8.89 4.77 0.00 3.05 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 L 8.39 5.26 0.00 1.57 1.28 0.92 0.80 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 0.00 145 F 8.92 5.05 0.00 2.79 2.39 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 0.00 146 E 8.96 5.32 0.00 1.76 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 2.16 2.15 0.00 147 M 8.51 5.05 0.00 2.14 2.07 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.33 0.00 148 D 8.74 5.34 0.00 2.75 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 0.00 149 S 8.37 5.18 0.00 3.85 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 0.00 150 S 8.64 4.44 0.00 4.08 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 0.00 151 L 7.73 4.01 0.00 1.67 1.75 0.92 0.77 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 0.00 152 A 7.92 4.21 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 0.00 153 C 7.74 4.70 0.00 3.05 3.01 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 0.00 154 S 8.21 4.22 0.00 3.76 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00