NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 D 4.5011 8.3649 120.2739 52.9376 40.8829 175.2707 6 F 4.3391 8.0301 118.8055 56.9955 40.4738 171.7111 7 E 4.3032 9.3103 121.0092 56.5838 31.0588 174.8660 8 E 5.2347 8.3893 124.7290 54.6685 33.3498 174.5182 9 K 4.4803 8.5260 124.4264 55.8641 36.2225 174.9355 10 M 4.6751 8.8659 125.1374 55.4404 32.4449 175.9724 11 I 4.3340 8.7426 121.0993 62.8688 38.1802 175.9713 12 L 4.5675 7.4621 119.3592 55.0822 43.7022 173.6806 13 I 5.7092 8.4921 119.8695 59.1598 40.7568 175.2691 14 R 4.5187 8.7419 124.1591 54.6247 32.5626 175.6717 15 R 4.5821 8.0140 116.9530 54.5099 29.3576 173.7952 16 T 4.2349 7.8753 117.9951 62.2106 69.4337 171.9998 17 A 4.9061 8.0535 124.3316 50.6758 23.0568 175.6573 18 R 4.5806 8.6852 117.4597 54.6907 33.9759 175.4047 19 M 4.5427 8.4062 121.8768 54.6811 33.7119 175.6544 20 Q 4.3806 8.4427 117.7087 55.3081 32.9206 172.8093 21 A 4.0225 8.5748 126.2469 53.6406 19.0368 175.9111 22 G 4.3170 10.7882 113.2521 45.4718 0.0000 173.0902 23 G 3.9933 7.5098 106.3142 44.5673 0.0000 171.1234 24 R 5.0011 8.2949 115.8138 53.3921 31.4518 175.4737 25 R 4.4786 8.3687 122.8641 55.2191 32.2580 175.5874 26 F 5.0724 8.6196 119.4236 56.2070 42.4104 175.7382 27 R 4.4745 8.0868 118.7354 55.5683 33.3929 175.4443 28 F 4.6627 9.2670 123.7771 57.1152 40.7609 175.0999 29 G 4.6918 8.9706 107.9555 44.6319 0.0000 171.7422 30 A 5.4035 8.5828 122.8869 50.3467 22.9148 174.9725 31 L 5.0948 9.0960 125.5712 54.2574 43.9788 175.6494 32 V 4.8833 8.9561 124.6078 61.3905 35.9035 173.7969 33 V 4.8656 8.6131 124.4988 61.1213 35.2432 174.3528 34 V 4.9048 8.9553 126.5044 61.3186 35.1567 174.4314 35 G 4.3171 8.5201 109.8189 45.9012 0.0000 173.9595 36 D 4.8959 9.1735 121.7388 53.3081 39.8122 176.5354 37 R 3.9510 8.4395 118.5415 57.4641 27.5165 175.6669 38 Q 4.6916 8.4444 113.0132 56.1451 30.6298 172.0462 39 G 4.2705 8.5015 115.7428 45.3559 0.0000 171.2774 40 R 4.2195 7.6412 120.8516 55.4848 30.8760 176.4341 41 V 4.8366 8.1548 115.9470 60.1221 36.6723 174.2487 42 G 4.4089 9.1401 109.5300 44.9807 0.0000 171.4743 43 L 5.2618 8.3248 123.3143 53.1872 45.3002 175.7279 44 G 4.3220 8.8925 109.8316 44.9718 0.0000 171.5605 45 F 5.5441 8.8378 125.4465 56.1499 42.0025 174.1541 46 G 3.9533 8.6934 113.2571 44.1928 0.0000 171.2643 47 K 4.9666 8.0523 123.8292 54.7304 34.3499 175.5913 48 A 4.5200 8.6102 122.9766 50.3969 22.9488 175.6400 49 P 4.5044 0.0000 0.0000 63.8479 31.7403 175.7049 50 E 4.5553 8.5452 119.1110 53.6084 32.5113 175.2511 51 V 3.3854 7.9171 122.5235 65.6000 31.4492 176.7180 52 P 4.2629 0.0000 0.0000 65.2949 31.3661 178.8319 53 L 3.9772 7.8503 117.3718 57.8065 41.6626 179.1748 54 A 4.0435 8.1486 120.6745 55.0007 18.1721 179.9448 55 V 3.5527 7.6383 116.8138 66.2187 31.2790 177.8016 56 Q 4.0020 8.1772 119.3358 59.3143 28.7933 178.7954 57 K 4.0743 8.3395 118.9677 59.6323 32.2075 179.0367 58 A 4.3485 8.3272 121.1239 55.1902 18.1902 179.7368 59 G 3.6934 8.4763 104.5719 48.4265 0.0000 175.2661 60 Y 4.2357 7.7633 122.1308 60.4527 38.7366 177.6670 61 Y 3.7753 8.0827 117.5110 60.7077 37.6828 178.3559 62 A 4.0260 8.3412 121.4278 55.3807 18.6511 179.7483 63 R 4.0055 7.8838 115.2276 59.7088 30.1533 178.1140 64 R 3.6114 7.9185 118.2834 58.5954 30.2487 175.9172 65 N 4.4381 8.1265 116.3995 54.1665 40.6854 173.2718 66 M 4.5257 8.0387 121.8460 55.6529 34.7873 174.3787 67 V 4.5924 8.1985 122.1099 60.0183 35.2016 173.4320 68 E 4.2559 8.8280 122.8500 56.4120 30.3401 176.4784 69 V 4.1594 8.2807 122.8589 60.3045 33.8576 172.6844 70 P 4.4578 0.0000 0.0000 62.8654 30.2743 176.7423 71 L 4.4444 7.9631 124.6881 55.8254 44.2521 176.5488 72 Q 4.5890 8.1627 109.6018 57.1945 31.1782 173.9683 73 N 4.0503 9.3480 113.6449 54.7649 38.0542 174.5340 74 G 4.0742 8.2665 104.6255 45.6671 0.0000 174.0064 75 T 4.7903 7.5466 113.8030 59.9010 69.5777 173.2182 76 I 4.2624 7.8687 124.5645 59.5448 38.8454 173.7929 77 P 4.4588 0.0000 0.0000 65.6587 31.6574 175.4732 78 H 4.7835 7.4293 111.4667 54.4757 30.7889 173.4641 79 E 4.9225 9.0487 117.3580 55.6827 31.1250 176.0443 80 I 4.5389 7.9514 113.1065 59.8701 41.1653 173.2181 81 E 4.6404 8.8641 126.0576 55.0961 30.6806 175.6717 82 V 4.3031 8.5911 125.7989 61.1443 34.1717 174.1765 83 E 4.7047 8.8721 128.3870 54.2535 30.4212 177.3653 84 F 4.6657 8.3698 132.4370 56.8864 37.7790 173.5508 85 G 3.6624 7.3789 110.3814 46.7489 0.0000 173.6733 86 A 4.0456 7.5614 119.2818 54.3901 20.1393 178.7026 87 S 4.5758 7.8851 110.3645 57.9698 65.3533 172.7007 88 K 5.0804 8.3925 120.8047 55.4379 35.9933 174.5340 89 I 5.0720 8.6626 125.8060 59.5320 42.0722 173.5284 90 V 5.5373 8.3215 128.1046 60.2401 34.5784 174.4827 91 L 5.1919 8.2657 126.5740 53.4391 45.3138 175.2594 92 K 4.7346 8.4941 119.7800 54.6538 36.0258 173.0126 93 P 4.6878 0.0000 0.0000 63.5262 31.6612 175.3516 94 A 4.8678 8.4362 122.5218 49.7500 22.1464 176.0204 95 A 4.0778 8.6348 123.3914 51.1881 19.2219 176.0461 96 P 5.1362 0.0000 0.0000 63.7485 31.8510 176.9928 97 G 3.9020 8.9785 108.7457 46.0816 0.0000 174.6957 98 T 4.0040 7.5031 116.3533 63.1539 69.3143 174.7889 99 G 4.2281 7.7235 104.8156 42.6249 0.0000 173.0585 100 V 4.6190 7.8850 121.4328 61.5692 29.9885 173.1923 101 I 4.2548 8.1520 116.5945 59.9595 38.9457 175.0210 102 A 4.4816 8.0057 128.0020 51.3024 22.2571 175.3210 103 G 4.1966 8.7330 105.7683 44.2766 0.0000 174.5953 104 A 3.9770 8.7773 121.0004 55.7999 17.9349 179.8462 105 V 3.6684 7.7754 116.3506 65.3356 31.9390 176.0158 106 P 4.3461 0.0000 0.0000 64.9016 31.1052 178.2419 107 R 3.8013 8.0473 119.3403 59.5019 30.1329 177.9072 108 A 3.9747 7.5973 119.0401 55.4436 17.8451 179.2334 109 I 3.5906 7.4742 118.1472 64.9882 37.2465 178.7293 110 L 4.0510 7.9745 119.0738 57.4572 41.3668 179.3984 111 E 3.9158 8.4109 119.8766 59.2169 29.8094 178.3377 112 L 4.3201 8.0640 116.8109 55.7956 41.2678 177.7517 113 A 4.4624 7.5320 120.4280 51.4130 18.6979 178.5687 114 G 3.9991 7.7119 105.1002 46.4792 0.0000 174.6962 115 V 4.1273 7.4592 119.4492 63.1273 31.8973 175.8698 116 T 4.7390 9.0730 112.4726 61.3584 71.8206 172.9638 117 D 4.8926 7.8289 122.8933 53.7484 44.6112 173.9684 118 I 4.5941 8.6026 121.7898 60.0461 42.4769 172.7413 119 L 4.9875 9.1614 130.0324 53.4845 43.5185 175.7745 120 T 5.6876 7.7418 112.5904 60.3898 72.5166 172.7101 121 K 4.3245 8.1590 118.8742 55.9104 35.6046 173.1169 122 E 4.8427 8.4153 125.1415 55.3380 31.4045 175.0362 123 L 5.0296 8.5860 122.4804 52.2127 46.9045 180.3466 124 G 3.7625 8.9384 110.7089 46.7932 0.0000 177.3287 125 S 4.4057 8.0717 119.5709 58.2027 62.6779 173.7104 126 R 4.5613 8.1296 116.3592 55.0164 32.8201 175.3190 127 N 4.2080 8.1464 117.6721 53.5711 39.6546 173.1321 128 P 4.2127 0.0000 0.0000 65.9257 31.4028 178.2610 129 I 3.5659 7.5797 117.7607 64.8055 37.1530 178.3081 130 N 4.4983 8.0799 116.4071 56.3842 38.4558 177.4387 131 I 3.7790 8.5281 121.4855 64.2662 37.1397 177.9778 132 A 3.9359 8.1355 121.6573 55.5486 18.2554 179.0130 133 Y 3.6927 8.1458 114.4411 61.1232 37.7571 179.3574 134 A 3.9448 7.8214 121.2612 55.4671 18.5628 179.8590 135 T 3.8067 7.9259 114.2630 66.9777 68.5000 176.6429 136 M 3.9282 7.9659 120.5391 58.5098 31.8759 178.3646 137 E 4.0016 7.9272 117.6987 58.1462 30.0410 178.5195 138 A 4.1307 7.5911 120.8198 55.6567 18.7461 179.5257 139 L 3.9200 7.8698 117.4991 57.8718 41.4650 179.6663 140 R 3.9723 7.9733 117.3768 58.5676 30.0414 177.5030 141 Q 4.3665 7.7287 115.6821 55.4239 29.7339 175.9585 142 L 4.1477 7.0829 120.1077 55.2425 42.2539 177.1668 143 R 4.5131 8.4953 119.9761 53.8553 33.5131 176.0660 144 T 4.1470 8.3732 113.8860 60.9288 71.1273 174.9279 145 K 3.7456 8.6645 122.1866 59.8282 31.9509 178.5233 146 A 4.4778 7.8355 121.4224 54.9795 18.3501 179.0475 147 D 4.2931 8.0523 117.3433 57.6902 40.7295 179.2154 148 V 3.5668 7.8157 118.9757 65.9352 31.7395 177.9767 149 E 3.9726 8.2266 116.8573 58.9049 29.0418 179.1223 150 R 3.8585 8.2101 120.5862 59.4972 29.9791 178.3361 151 L 4.0625 7.5177 117.0805 57.3478 41.8558 178.8695 152 R 4.0877 8.1799 117.6186 58.4936 30.4508 177.7855 153 K 4.0940 8.2235 120.4625 57.6396 31.9415 177.7716 154 G 3.9326 7.5553 105.3570 46.2477 0.0000 172.8887 155 E 4.1046 7.6902 124.4632 56.0631 29.5803 176.2492 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 5 D 8.36 4.50 0.00 2.70 2.73 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 0.00 0.00 0.00 6 F 8.03 4.34 0.00 3.01 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 7 E 9.31 4.30 0.00 2.16 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 2.33 2.33 0.00 8 E 8.39 5.23 0.00 2.00 1.77 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 2.21 2.27 0.00 9 K 8.53 4.48 0.00 1.89 1.60 0.00 1.69 0.00 0.00 1.71 0.00 0.00 2.90 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.32 1.36 7.81 10 M 8.87 4.68 0.00 2.20 2.24 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.53 0.00 11 I 8.74 4.33 1.89 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.86 0.92 0.00 0.00 12 L 7.46 4.57 0.00 1.68 1.74 0.93 0.64 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 13 I 8.49 5.71 1.94 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 1.09 0.47 1.09 0.00 0.00 14 R 8.74 4.52 0.00 1.94 2.15 0.00 2.97 0.00 0.00 3.34 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.71 0.00 15 R 8.01 4.58 0.00 1.84 1.82 0.00 2.30 0.00 0.00 3.06 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.52 0.00 16 T 7.88 4.23 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 1.32 0.00 0.00 17 A 8.05 4.91 0.64 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 0.00 0.00 18 R 8.69 4.58 0.00 1.57 1.70 0.00 3.08 0.00 0.00 3.13 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.47 0.00 19 M 8.41 4.54 0.00 1.85 1.93 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.40 0.00 20 Q 8.44 4.38 0.00 2.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.77 0.00 0.00 0.00 0.00 0.00 2.08 2.26 0.00 21 A 8.57 4.02 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 22 G 10.79 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 23 G 7.51 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 24 R 8.29 5.00 0.00 1.47 1.74 0.00 2.66 0.00 0.00 3.67 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.26 0.00 25 R 8.37 4.48 0.00 1.77 1.87 0.00 3.08 0.00 0.00 3.30 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.74 0.00 26 F 8.62 5.07 0.00 2.61 2.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 R 8.09 4.47 0.00 1.66 1.82 0.00 3.15 0.00 0.00 3.23 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.62 0.00 28 F 9.27 4.66 0.00 3.05 3.12 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 0.00 0.00 0.00 29 G 8.97 4.69 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 0.00 0.00 0.00 30 A 8.58 5.40 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 L 9.10 5.09 0.00 1.80 1.58 0.86 0.50 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 32 V 8.96 4.88 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 1.01 0.00 0.00 1.00 0.00 0.00 33 V 8.61 4.87 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 0.91 0.00 0.00 0.91 0.00 0.00 34 V 8.96 4.90 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 0.82 0.00 0.00 0.96 0.00 0.00 35 G 8.52 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 36 D 9.17 4.90 0.00 3.04 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 37 R 8.44 3.95 0.00 2.15 2.13 0.00 3.19 0.00 0.00 3.11 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.58 0.00 38 Q 8.44 4.69 0.00 1.97 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.86 0.00 0.00 0.00 0.00 0.00 2.14 2.23 0.00 39 G 8.50 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 0.00 0.00 0.00 0.00 40 R 7.64 4.22 0.00 1.81 1.47 0.00 3.20 0.00 0.00 3.11 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.86 0.00 41 V 8.15 4.84 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 0.59 0.00 0.00 0.92 0.00 0.00 42 G 9.14 4.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 L 8.32 5.26 0.00 1.51 1.35 0.79 0.64 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 44 G 8.89 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 45 F 8.84 5.54 0.00 2.89 2.94 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 46 G 8.69 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 K 8.05 4.97 0.00 1.45 1.62 0.00 0.61 0.00 0.00 0.76 0.00 0.00 2.55 0.00 0.00 2.57 0.00 0.00 0.00 0.00 1.15 1.08 7.81 48 A 8.61 4.52 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 49 P 0.00 4.50 0.00 2.13 2.20 0.00 3.74 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 2.08 2.14 0.00 50 E 8.55 4.56 0.00 1.99 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 2.16 2.17 0.00 51 V 7.92 3.39 1.83 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 0.84 0.00 0.00 0.13 0.00 0.00 52 P 0.00 4.26 0.00 2.16 2.05 0.00 3.55 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.10 0.00 53 L 7.85 3.98 0.00 1.70 1.73 0.93 0.74 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 54 A 8.15 4.04 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 55 V 7.64 3.55 2.25 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 1.10 0.00 0.00 1.03 0.00 0.00 56 Q 8.18 4.00 0.00 2.37 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.58 0.00 0.00 0.00 0.00 0.00 2.38 2.57 0.00 57 K 8.34 4.07 0.00 2.16 2.20 0.00 1.81 0.00 0.00 1.85 0.00 0.00 3.31 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.56 1.71 7.81 58 A 8.33 4.35 1.49 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 0.00 0.00 59 G 8.48 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 0.00 0.00 0.00 60 Y 7.76 4.24 0.00 2.94 2.92 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 61 Y 8.08 3.78 0.00 3.17 2.89 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 62 A 8.34 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 63 R 7.88 4.01 0.00 1.84 2.08 0.00 3.29 0.00 0.00 3.26 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.90 0.00 64 R 7.92 3.61 0.00 1.17 1.70 0.00 3.14 0.00 0.00 3.06 8.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.58 0.00 65 N 8.13 4.44 0.00 2.82 2.75 0.00 0.00 6.90 7.25 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 66 M 8.04 4.53 0.00 1.93 1.75 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.11 0.00 67 V 8.20 4.59 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 0.64 0.00 0.00 0.88 0.00 0.00 68 E 8.83 4.26 0.00 1.98 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 2.25 2.29 0.00 69 V 8.28 4.16 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 0.95 0.00 0.00 0.98 0.00 0.00 70 P 0.00 4.46 0.00 2.09 2.04 0.00 3.72 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 2.04 2.11 0.00 71 L 7.96 4.44 0.00 1.64 1.65 0.97 0.98 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 72 Q 8.16 4.59 0.00 2.17 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.61 6.21 0.00 0.00 0.00 0.00 0.00 2.14 2.21 0.00 73 N 9.35 4.05 0.00 2.89 2.86 0.00 0.00 7.54 7.98 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 74 G 8.27 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 T 7.55 4.79 4.31 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 1.25 0.00 0.00 76 I 7.87 4.26 1.85 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.91 0.95 0.00 0.00 77 P 0.00 4.46 0.00 2.33 2.20 0.00 3.83 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.00 0.00 78 H 7.43 4.78 0.00 3.14 3.25 0.00 5.52 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 E 9.05 4.92 0.00 1.94 2.17 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 2.27 2.22 0.00 80 I 7.95 4.54 1.86 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 1.28 0.53 0.87 0.00 0.00 81 E 8.86 4.64 0.00 1.88 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 2.25 2.30 0.00 82 V 8.59 4.30 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 1.08 0.00 0.00 0.94 0.00 0.00 83 E 8.87 4.70 0.00 1.91 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 2.25 2.30 0.00 84 F 8.37 4.67 0.00 2.93 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 85 G 7.38 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 86 A 7.56 4.05 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 S 7.89 4.58 0.00 3.90 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 K 8.39 5.08 0.00 1.80 1.59 0.00 1.61 0.00 0.00 1.58 0.00 0.00 2.77 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.35 1.40 7.81 89 I 8.66 5.07 1.89 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 1.37 0.97 0.00 0.00 90 V 8.32 5.54 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 0.96 0.00 0.00 0.94 0.00 0.00 91 L 8.27 5.19 0.00 1.63 1.51 0.90 0.50 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 92 K 8.49 4.73 0.00 1.82 1.68 0.00 1.65 0.00 0.00 1.70 0.00 0.00 2.88 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.32 1.36 7.81 93 P 0.00 4.69 0.00 2.11 2.27 0.00 3.76 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.01 0.00 94 A 8.44 4.87 1.19 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 0.00 0.00 95 A 8.63 4.08 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 96 P 0.00 5.14 0.00 2.05 2.02 0.00 3.76 0.00 0.00 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.07 0.00 97 G 8.98 3.90 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 0.00 0.00 0.00 0.00 0.00 0.00 98 T 7.50 4.00 4.35 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 0.00 0.00 0.00 1.21 0.00 0.00 99 G 7.72 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 V 7.88 4.62 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 0.83 0.00 0.00 0.93 0.00 0.00 101 I 8.15 4.25 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.69 0.91 0.00 0.00 102 A 8.01 4.48 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 G 8.73 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 0.00 104 A 8.78 3.98 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 0.00 105 V 7.78 3.67 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 1.07 0.00 0.00 0.93 0.00 0.00 106 P 0.00 4.35 0.00 2.29 2.28 0.00 3.76 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 2.27 2.02 0.00 107 R 8.05 3.80 0.00 1.97 2.23 0.00 3.11 0.00 0.00 3.17 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.64 0.00 108 A 7.60 3.97 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 0.00 109 I 7.47 3.59 1.99 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.27 0.87 0.00 0.00 110 L 7.97 4.05 0.00 1.72 1.70 0.91 0.62 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 0.00 111 E 8.41 3.92 0.00 2.15 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 2.31 2.35 0.00 112 L 8.06 4.32 0.00 1.73 1.68 0.93 0.84 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 0.00 113 A 7.53 4.46 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 0.00 114 G 7.71 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 V 7.46 4.13 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 0.87 0.00 0.00 0.97 0.00 0.00 116 T 9.07 4.74 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 1.21 0.00 0.00 117 D 7.83 4.89 0.00 2.60 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 0.00 118 I 8.60 4.59 1.86 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 1.21 0.96 0.90 0.00 0.00 119 L 9.16 4.99 0.00 1.58 1.56 0.92 0.54 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 0.00 120 T 7.74 5.69 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 1.24 0.00 0.00 121 K 8.16 4.32 0.00 1.80 1.62 0.00 1.70 0.00 0.00 1.82 0.00 0.00 2.83 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.31 1.36 7.81 122 E 8.42 4.84 0.00 1.96 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.33 0.00 123 L 8.59 5.03 0.00 1.53 1.51 0.92 1.20 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 0.00 124 G 8.94 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 0.00 125 S 8.07 4.41 0.00 3.86 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 0.00 126 R 8.13 4.56 0.00 1.78 1.85 0.00 3.28 0.00 0.00 3.15 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.61 0.00 127 N 8.15 4.21 0.00 2.76 2.72 0.00 0.00 7.18 7.47 0.00 0.00 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 P 0.00 4.21 0.00 2.16 2.09 0.00 3.65 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.19 0.00 129 I 7.58 3.57 1.84 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.60 0.59 0.00 0.00 130 N 8.08 4.50 0.00 2.91 3.07 0.00 0.00 7.02 7.25 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 0.00 131 I 8.53 3.78 2.03 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 1.70 1.24 0.92 0.00 0.00 132 A 8.14 3.94 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 0.00 133 Y 8.15 3.69 0.00 2.43 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 0.00 0.00 0.00 0.00 134 A 7.82 3.94 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.93 3.81 4.28 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 1.18 0.00 0.00 136 M 7.97 3.93 0.00 1.88 2.04 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.72 0.00 137 E 7.93 4.00 0.00 2.10 1.95 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 2.28 2.46 0.00 138 A 7.59 4.13 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 0.00 139 L 7.87 3.92 0.00 1.77 1.69 0.87 0.58 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 0.00 140 R 7.97 3.97 0.00 1.90 2.23 0.00 3.22 0.00 0.00 3.19 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.64 0.00 141 Q 7.73 4.37 0.00 2.22 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.60 0.00 0.00 0.00 0.00 0.00 2.33 2.65 0.00 142 L 7.08 4.15 0.00 1.76 1.65 0.89 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 143 R 8.50 4.51 0.00 1.68 1.77 0.00 3.37 0.00 0.00 3.28 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.55 0.00 144 T 8.37 4.15 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 1.34 0.00 0.00 145 K 8.66 3.75 0.00 1.87 1.86 0.00 1.60 0.00 0.00 1.81 0.00 0.00 3.03 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.51 1.83 7.81 146 A 7.84 4.48 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 0.00 147 D 8.05 4.29 0.00 2.93 2.74 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 0.00 148 V 7.82 3.57 2.22 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 1.12 0.00 0.00 0.93 0.00 0.00 149 E 8.23 3.97 0.00 2.27 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 2.53 2.31 0.00 150 R 8.21 3.86 0.00 1.99 2.10 0.00 3.08 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.67 0.00 151 L 7.52 4.06 0.00 1.63 1.70 0.95 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 152 R 8.18 4.09 0.00 1.86 1.94 0.00 3.26 0.00 0.00 3.15 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.62 0.00 153 K 8.22 4.09 0.00 2.30 1.83 0.00 1.72 0.00 0.00 1.65 0.00 0.00 3.02 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.43 1.50 7.81 154 G 7.56 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 0.00 0.00 0.00 155 E 7.69 4.10 0.00 2.05 1.83 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 2.31 2.25 0.00