NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.5474 8.3044 118.2040 55.3963 32.5742 174.1935 2 Q 4.4042 8.0268 120.0566 54.0225 31.6800 171.1635 3 K 4.2880 8.8887 119.9267 57.8277 35.9825 174.6614 4 G 3.9901 9.0176 105.7635 45.4404 0.0000 172.5146 5 L 5.0241 7.2183 117.6170 52.8291 46.6971 174.7567 6 E 4.9550 8.5880 120.3379 54.8775 31.0819 175.6883 7 I 4.5881 8.6409 117.1801 59.0823 41.3901 173.9095 8 A 5.4308 8.4451 124.7401 50.2258 22.1959 175.0155 9 F 5.2559 9.1729 122.3581 56.5006 42.6868 173.6088 10 Q 4.8414 8.0308 125.9286 54.7769 31.6818 174.7673 11 T 4.7186 8.9333 119.6071 61.4022 70.2522 173.8088 12 I 4.5983 8.3002 121.0299 60.3345 39.6717 174.3308 13 N 4.0595 8.0999 116.0146 54.6572 42.6194 173.0313 14 G 3.7602 8.2707 103.4592 47.6286 0.0000 173.7644 15 L 4.0252 8.1901 114.6011 55.1671 39.6758 176.9920 16 D 4.4550 7.6401 120.3502 57.1083 40.5555 177.7771 17 E 3.9053 8.2527 118.0469 59.7929 29.0795 179.5109 18 S 3.8775 7.8739 115.2207 61.2065 62.8591 176.3928 19 L 3.7928 7.5917 122.5292 57.8981 41.9392 178.9178 20 V 3.6026 7.8944 118.2021 66.2675 31.5520 178.1188 21 Q 3.9406 8.0942 117.5207 58.6704 28.5272 178.5457 22 A 3.7726 8.0078 122.3732 55.0565 18.4972 179.7020 23 L 3.8371 8.3214 118.4328 58.9216 40.3714 179.3451 24 A 3.9129 8.1629 121.7750 54.6404 18.2780 179.9241 25 G 3.6037 8.1801 104.7218 47.8085 0.0000 176.5101 26 V 3.6474 7.8792 121.8380 64.7611 31.4610 178.4807 27 T 3.6056 7.8298 113.6577 64.6234 66.8890 176.1491 28 A 3.9250 7.5400 121.6898 55.1865 18.4781 179.2633 29 S 4.2290 8.0518 110.8188 61.3171 62.5769 175.5200 30 D 4.6000 8.5337 120.1750 55.3863 42.5502 176.3799 31 F 4.6569 8.0674 119.6371 55.0690 38.1905 174.2070 32 P 4.4572 0.0000 0.0000 64.9547 31.9650 178.4705 33 D 4.3760 8.0870 118.6362 55.2408 40.8492 177.2229 34 L 3.8515 8.0405 117.7743 55.5652 39.6682 175.3903 35 D 4.4183 7.7511 117.2874 55.3382 41.3892 176.1216 36 I 4.1082 7.4106 119.8916 61.7868 38.5089 176.4204 37 K 4.8157 9.0856 130.5275 55.1401 30.6155 174.0103 38 Y 5.5249 7.7977 119.8373 55.3236 42.1302 175.1534 39 N 3.7887 8.1368 114.8682 52.9523 44.1968 173.9752 40 I 4.6651 7.6370 120.5916 59.4157 40.7125 174.7456 41 F 5.5114 7.8650 121.2543 55.0483 41.7754 173.3539 42 L 4.6377 9.1258 122.9738 53.4260 44.1572 175.2970 43 V 4.7019 8.5608 120.1111 59.6105 34.3626 174.8713 44 D 4.9675 8.3509 123.1931 51.8949 41.3733 174.3198 45 L 4.2781 8.6442 124.4843 54.7544 45.3181 174.5699 46 Y 3.6068 8.5789 117.7090 59.2173 35.0587 171.1668 47 G 3.9615 8.4909 105.0749 45.9489 0.0000 174.1701 48 Q 4.4671 7.9808 118.7690 53.4445 32.1056 173.9731 49 K 4.7312 8.3600 121.4003 55.2658 34.5309 175.0862 50 Y 5.2382 8.6929 121.2739 56.2771 42.4717 174.1831 51 F 4.9642 9.1547 120.7750 56.1805 41.3789 175.2476 52 R 5.2281 8.8407 121.9788 54.2249 34.4010 174.2093 53 I 4.5562 8.6948 116.3359 58.7851 40.8354 173.9194 54 L 5.3266 8.7423 127.3002 53.2902 44.8465 174.5469 55 F 5.6917 9.3420 128.3049 56.7639 42.1924 173.6846 56 Q 4.5587 9.4985 124.4657 54.2786 33.0580 174.7313 57 S 4.9644 7.7770 114.2440 57.2386 64.7616 174.5319 58 K 4.1509 8.6076 120.4920 58.5292 32.4539 178.0614 59 K 4.1048 8.0346 114.5740 56.5359 32.3424 176.9483 60 L 4.5193 6.9054 118.7466 55.8434 40.3362 176.9389 61 S 4.8911 8.3524 118.5815 56.4365 65.3311 174.3157 62 E 4.0814 8.6759 122.4639 58.9395 29.6386 177.2779 63 L 4.3207 7.4520 117.4535 54.8995 43.9265 174.7027 64 H 4.0955 8.5304 112.4408 56.9402 25.2466 173.7827 65 P 4.3019 0.0000 0.0000 65.5657 31.6241 178.1855 66 E 3.9640 8.2801 118.7147 59.2911 29.3271 178.5546 67 E 4.0261 7.9958 118.0515 58.9960 29.5343 179.1561 68 R 3.9200 7.8311 118.3682 59.2776 30.2021 179.1994 69 K 4.0193 8.0000 117.9344 59.6746 32.6248 178.7309 70 K 4.1575 7.6272 122.2258 59.0228 32.1847 179.2764 71 V 3.7498 8.0852 112.6470 64.0608 31.4088 178.5247 72 R 4.2447 8.1372 118.9617 59.6723 29.4727 178.4893 73 E 3.9415 8.4035 117.4178 59.0430 29.6658 178.7695 74 K 3.9157 8.2487 120.8763 59.3854 32.3175 178.8420 75 F 4.2599 8.8479 115.2860 59.7909 37.7732 177.0859 76 D 3.3700 7.3901 119.2956 56.8619 40.5926 178.7201 77 E 3.8096 8.0419 118.8861 59.4292 29.3106 178.6492 78 N 4.2068 7.8410 115.9179 56.8279 38.9278 176.6532 79 S 4.1230 7.7842 114.8122 61.2065 63.4603 176.2492 80 R 4.0187 7.7991 117.4167 56.4181 29.6880 176.5509 81 M 3.8851 7.0925 119.4385 55.6685 32.8347 176.9209 82 Q 4.1866 8.5801 120.3058 56.4109 30.9255 177.6689 83 Y 3.7861 8.6278 122.1165 60.7953 38.7835 178.4865 84 S 4.1790 8.2506 115.8219 61.8954 63.0415 176.2870 85 E 3.9747 8.1263 121.1849 59.0134 28.0949 178.1885 86 L 3.9589 8.1729 120.7097 58.3325 42.0745 178.8193 87 M 4.5247 8.7598 118.7703 58.2163 32.1441 178.8796 88 T 3.8856 8.1368 116.0107 66.5446 68.5689 176.4096 89 K 4.1851 8.4990 118.9747 58.0804 32.2222 177.0765 90 Y 4.5527 7.1457 116.2034 60.2818 39.8031 176.0735 91 H 4.0859 8.5626 118.8345 58.5763 30.3734 176.5237 92 D 4.6386 8.0859 119.5718 56.9121 40.9860 177.5142 93 L 4.1909 7.8494 119.6667 56.4986 41.9435 178.1061 94 K 4.1747 8.1789 119.5972 59.3968 32.3279 178.1309 95 K 3.8815 7.5070 120.4593 59.4462 32.0816 176.9878 96 Q 4.4065 7.9151 115.4132 56.0750 31.3147 176.2123 97 G 3.9862 8.0276 107.1618 44.3950 0.0000 171.6873 98 K 4.5475 8.2919 117.5709 55.9398 35.5148 174.8786 99 I 4.7094 7.9339 117.0805 59.4738 40.9096 173.9536 100 K 4.7923 8.5863 124.8378 54.6639 35.2895 176.0958 101 D 4.8729 8.2667 121.1491 51.3279 38.9002 175.9920 102 R 4.2227 7.9504 126.2430 55.5413 31.2343 174.8162 103 P 4.4470 0.0000 0.0000 62.6246 32.0152 176.3834 104 V 4.2288 8.1948 121.2882 61.5438 32.6809 175.5926 105 K 4.4516 8.8046 123.7688 55.6489 33.6320 176.1051 106 E 4.5141 8.7473 123.9568 56.3220 30.2585 176.2001 107 V 4.2919 8.2263 123.7068 61.4901 33.7054 174.3360 108 H 4.8607 8.3588 122.6263 53.4258 32.2470 172.7814 109 E 4.0272 8.4973 120.0675 56.1201 29.4902 176.7876 110 E 4.2158 7.1651 121.7424 56.8772 34.1358 176.0932 111 Y 5.2374 7.8185 116.1978 56.0404 37.6619 173.8129 112 D 4.5410 7.7630 120.3258 54.9515 43.9011 178.3685 113 L 4.0238 7.2931 120.4235 55.2165 41.1843 176.3800 114 W 4.5283 8.9047 117.5004 59.6453 29.5676 176.5711 115 E 3.8161 8.3386 112.2921 55.6862 27.4443 172.8354 116 D 4.5431 7.5206 132.8313 55.5988 45.8978 176.3927 117 P 4.3476 0.0000 0.0000 65.8196 31.6568 178.6032 118 I 3.9389 7.8519 111.4181 62.4365 37.9776 176.8819 119 W 4.3935 8.4076 130.2736 59.5726 30.1767 175.5026 120 Q 3.8860 6.9822 116.2690 55.8168 29.5828 174.6356 121 Y 4.8333 7.9798 116.1395 56.7767 42.8233 175.0734 122 I 4.0935 8.8078 114.6088 61.7177 37.3946 175.8056 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 8.30 4.55 0.00 2.19 2.21 0.00 0.00 0.00 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.57 0.00 2 Q 8.03 4.40 0.00 2.12 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.90 0.00 0.00 0.00 0.00 0.00 2.25 2.56 0.00 3 K 8.89 4.29 0.00 2.17 2.27 0.00 1.99 0.00 0.00 1.77 0.00 0.00 2.92 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.57 1.48 7.81 4 G 9.02 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 5 L 7.22 5.02 0.00 1.46 1.40 0.89 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 6 E 8.59 4.96 0.00 1.80 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.37 0.00 7 I 8.64 4.59 1.24 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 1.01 0.65 0.00 0.00 8 A 8.45 5.43 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 9 F 9.17 5.26 0.00 3.13 2.97 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 10 Q 8.03 4.84 0.00 2.06 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.37 0.00 0.00 0.00 0.00 0.00 2.19 2.34 0.00 11 T 8.93 4.72 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 12 I 8.30 4.60 1.87 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.88 0.65 0.00 0.00 13 N 8.10 4.06 0.00 2.70 2.76 0.00 0.00 7.10 8.02 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 14 G 8.27 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 0.00 0.00 0.00 15 L 8.19 4.03 0.00 1.95 1.84 0.95 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 16 D 7.64 4.45 0.00 2.92 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 17 E 8.25 3.91 0.00 2.04 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 2.31 2.37 0.00 18 S 7.87 3.88 0.00 3.96 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 19 L 7.59 3.79 0.00 1.66 1.81 0.93 0.70 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 20 V 7.89 3.60 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 1.12 0.00 0.00 1.05 0.00 0.00 21 Q 8.09 3.94 0.00 1.92 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.60 0.00 0.00 0.00 0.00 0.00 2.37 2.44 0.00 22 A 8.01 3.77 1.05 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 0.00 0.00 23 L 8.32 3.84 0.00 1.72 1.90 0.72 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 24 A 8.16 3.91 1.59 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 0.00 0.00 25 G 8.18 3.60 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 0.00 0.00 0.00 26 V 7.88 3.65 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 0.93 0.00 0.00 27 T 7.83 3.61 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 0.57 0.00 0.00 28 A 7.54 3.92 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 29 S 8.05 4.23 0.00 4.20 3.92 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 0.00 0.00 0.00 30 D 8.53 4.60 0.00 2.85 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 31 F 8.07 4.66 0.00 3.21 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 32 P 0.00 4.46 0.00 2.18 2.20 0.00 3.72 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.97 0.00 33 D 8.09 4.38 0.00 2.83 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 34 L 8.04 3.85 0.00 1.94 1.83 0.96 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 35 D 7.75 4.42 0.00 2.83 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 36 I 7.41 4.11 1.73 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.93 1.01 0.00 0.00 37 K 9.09 4.82 0.00 1.87 1.82 0.00 1.79 0.00 0.00 1.79 0.00 0.00 2.94 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.66 1.57 7.81 38 Y 7.80 5.52 0.00 3.23 3.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 N 8.14 3.79 0.00 2.71 2.77 0.00 0.00 7.10 6.97 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 40 I 7.64 4.67 1.86 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 1.28 0.81 0.89 0.00 0.00 41 F 7.86 5.51 0.00 3.16 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 42 L 9.13 4.64 0.00 1.25 1.35 0.67 -0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 43 V 8.56 4.70 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 0.90 0.00 0.00 1.05 0.00 0.00 44 D 8.35 4.97 0.00 2.48 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 45 L 8.64 4.28 0.00 1.48 1.23 0.15 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 46 Y 8.58 3.61 0.00 3.21 3.04 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 47 G 8.49 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 48 Q 7.98 4.47 0.00 1.89 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.30 6.84 0.00 0.00 0.00 0.00 0.00 2.53 2.57 0.00 49 K 8.36 4.73 0.00 1.56 1.61 0.00 1.45 0.00 0.00 1.69 0.00 0.00 2.80 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.28 1.37 7.81 50 Y 8.69 5.24 0.00 2.91 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 51 F 9.15 4.96 0.00 3.27 2.97 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 52 R 8.84 5.23 0.00 1.80 1.89 0.00 3.43 0.00 0.00 3.37 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.92 0.00 53 I 8.69 4.56 1.91 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 1.36 1.21 0.97 0.00 0.00 54 L 8.74 5.33 0.00 2.25 1.84 0.69 0.89 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 55 F 9.34 5.69 0.00 3.14 3.04 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 56 Q 9.50 4.56 0.00 2.09 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.60 6.20 0.00 0.00 0.00 0.00 0.00 2.44 2.38 0.00 57 S 7.78 4.96 0.00 3.93 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 58 K 8.61 4.15 0.00 2.02 1.95 0.00 1.69 0.00 0.00 1.86 0.00 0.00 3.02 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.55 1.54 7.81 59 K 8.03 4.10 0.00 1.83 1.87 0.00 1.88 0.00 0.00 1.78 0.00 0.00 3.10 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.48 1.40 7.81 60 L 6.91 4.52 0.00 1.88 1.73 0.99 0.83 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 61 S 8.35 4.89 0.00 3.92 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 62 E 8.68 4.08 0.00 1.93 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 2.34 2.43 0.00 63 L 7.45 4.32 0.00 1.27 1.50 0.86 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 64 H 8.53 4.10 0.00 3.39 3.32 0.00 5.64 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 P 0.00 4.30 0.00 2.26 2.30 0.00 3.74 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 2.08 2.02 0.00 66 E 8.28 3.96 0.00 2.07 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 2.39 2.42 0.00 67 E 8.00 4.03 0.00 2.14 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 2.46 2.51 0.00 68 R 7.83 3.92 0.00 2.06 1.98 0.00 3.07 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.61 0.00 69 K 8.00 4.02 0.00 1.99 2.08 0.00 1.52 0.00 0.00 1.75 0.00 0.00 2.92 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.67 1.53 7.81 70 K 7.63 4.16 0.00 1.83 2.09 0.00 1.70 0.00 0.00 1.76 0.00 0.00 2.95 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.47 1.38 7.81 71 V 8.09 3.75 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 0.75 0.00 0.00 1.03 0.00 0.00 72 R 8.14 4.24 0.00 2.29 2.01 0.00 3.15 0.00 0.00 3.40 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.91 0.00 73 E 8.40 3.94 0.00 2.22 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 0.00 2.66 2.32 0.00 74 K 8.25 3.92 0.00 2.03 2.11 0.00 1.54 0.00 0.00 1.71 0.00 0.00 3.10 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.50 1.56 7.81 75 F 8.85 4.26 0.00 3.27 3.52 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 76 D 7.39 3.37 0.00 2.68 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 77 E 8.04 3.81 0.00 1.90 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 2.37 2.40 0.00 78 N 7.84 4.21 0.00 2.82 2.81 0.00 0.00 7.32 6.99 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 79 S 7.78 4.12 0.00 3.59 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 80 R 7.80 4.02 0.00 1.93 2.16 0.00 3.12 0.00 0.00 3.19 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.88 0.00 81 M 7.09 3.89 0.00 1.99 2.20 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.84 0.00 82 Q 8.58 4.19 0.00 2.11 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.91 0.00 0.00 0.00 0.00 0.00 2.48 2.44 0.00 83 Y 8.63 3.79 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 84 S 8.25 4.18 0.00 3.94 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 85 E 8.13 3.97 0.00 2.08 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 2.37 2.42 0.00 86 L 8.17 3.96 0.00 1.78 1.35 0.74 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 87 M 8.76 4.52 0.00 2.20 2.44 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.98 3.06 0.00 88 T 8.14 3.89 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 1.23 0.00 0.00 89 K 8.50 4.19 0.00 1.92 1.85 0.00 1.68 0.00 0.00 1.64 0.00 0.00 3.07 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.46 1.50 7.81 90 Y 7.15 4.55 0.00 2.90 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 91 H 8.56 4.09 0.00 3.31 3.16 0.00 5.66 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 D 8.09 4.64 0.00 2.89 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 93 L 7.85 4.19 0.00 1.78 1.62 0.94 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 94 K 8.18 4.17 0.00 1.85 2.08 0.00 1.67 0.00 0.00 1.48 0.00 0.00 2.97 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.42 1.29 7.81 95 K 7.51 3.88 0.00 1.89 1.87 0.00 1.75 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.45 1.65 7.81 96 Q 7.92 4.41 0.00 2.03 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.69 0.00 0.00 0.00 0.00 0.00 2.24 2.30 0.00 97 G 8.03 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 98 K 8.29 4.55 0.00 1.82 1.78 0.00 1.49 0.00 0.00 1.65 0.00 0.00 3.08 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.35 1.43 7.81 99 I 7.93 4.71 2.00 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.50 0.95 0.00 0.00 100 K 8.59 4.79 0.00 1.80 1.70 0.00 1.78 0.00 0.00 1.80 0.00 0.00 2.86 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.36 1.42 7.81 101 D 8.27 4.87 0.00 2.77 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 R 7.95 4.22 0.00 1.81 1.88 0.00 3.25 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 1.63 1.63 0.00 103 P 0.00 4.45 0.00 2.19 2.06 0.00 3.76 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.96 0.00 104 V 8.19 4.23 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 0.79 0.00 0.00 1.08 0.00 0.00 105 K 8.80 4.45 0.00 1.95 1.79 0.00 1.57 0.00 0.00 1.69 0.00 0.00 2.90 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.45 1.47 7.81 106 E 8.75 4.51 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 2.26 2.28 0.00 107 V 8.23 4.29 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 0.79 0.00 0.00 0.91 0.00 0.00 108 H 8.36 4.86 0.00 3.01 3.08 0.00 5.94 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 E 8.50 4.03 0.00 1.81 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 2.14 2.06 0.00 110 E 7.17 4.22 0.00 1.79 1.71 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 1.76 1.89 0.00 111 Y 7.82 5.24 0.00 2.91 2.91 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 0.00 112 D 7.76 4.54 0.00 2.46 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 0.00 113 L 7.29 4.02 0.00 1.76 1.39 1.14 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 114 W 8.90 4.53 0.00 3.44 3.26 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 0.00 115 E 8.34 3.82 0.00 2.17 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 2.64 2.37 0.00 116 D 7.52 4.54 0.00 2.88 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 0.00 117 P 0.00 4.35 0.00 2.28 2.21 0.00 3.97 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 2.21 1.75 0.00 118 I 7.85 3.94 1.99 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.10 1.11 0.00 0.00 119 W 8.41 4.39 0.00 3.28 3.52 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 0.00 120 Q 6.98 3.89 0.00 2.21 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.84 6.11 0.00 0.00 0.00 0.00 0.00 2.06 2.42 0.00 121 Y 7.98 4.83 0.00 2.97 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 0.00 122 I 8.81 4.09 2.24 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 1.40 0.61 1.16 0.00 0.00