NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4429 8.3049 120.3258 54.9519 33.4242 174.6935 2 I 3.8996 8.0594 122.3206 60.5007 37.9460 175.2210 3 S 4.3087 9.0599 121.8281 59.3085 64.4981 175.0817 4 G 3.8803 7.2118 106.0725 45.9639 0.0000 170.5549 5 L 4.3062 8.0824 124.3522 54.3223 43.2667 176.9237 6 S 4.4902 8.4938 120.9923 59.3297 63.0021 173.0857 7 H 4.5234 6.7259 111.5605 55.2350 30.2784 172.7453 8 I 4.4539 7.6379 118.9488 59.6875 40.3255 174.9208 9 T 5.0035 8.3940 122.0426 61.7576 71.1691 173.2366 10 L 4.7955 8.7997 126.1273 52.9557 44.9416 175.3973 11 I 4.9619 8.4070 123.3472 60.1163 38.5753 175.4252 12 V 4.7523 8.7680 119.5254 59.4336 35.4790 176.8078 13 K 3.7595 9.2641 122.9270 57.8667 32.4970 176.8179 14 D 4.7736 7.7928 116.8724 51.1744 43.1812 175.0428 15 L 4.0598 9.0182 129.4784 58.4977 42.0919 178.5756 16 N 4.4338 8.2523 115.7472 56.1519 38.3612 177.2383 17 K 3.9876 8.3626 121.1405 59.7942 32.2266 179.1605 18 T 4.2559 8.2373 116.0769 66.6460 68.3242 177.0460 19 T 3.8514 8.2681 117.8570 66.7417 68.5228 176.5621 20 A 4.2723 7.9717 122.6152 55.0388 18.2339 179.4033 21 F 4.1873 8.2634 119.3096 61.7306 39.6163 177.4476 22 L 3.8561 8.3988 118.5968 57.7476 41.3079 179.6725 23 Q 4.1277 8.1294 118.1318 58.7312 28.5080 178.2560 24 N 4.2837 8.2059 117.0379 56.1089 38.6834 177.2503 25 I 3.6624 7.3461 119.8984 63.4308 37.4930 177.0671 26 F 4.4299 7.4987 114.0581 56.1217 39.1189 175.0442 27 N 4.8544 8.3614 116.7316 52.9736 37.2684 174.0046 28 A 4.3856 7.8148 117.0614 52.0185 19.7656 177.7292 29 E 4.6685 8.8771 122.0670 54.1575 31.7409 174.8315 30 E 4.0921 9.1342 129.3525 56.2197 30.0172 176.0844 31 I 4.6099 8.5417 119.0405 60.4430 39.1898 174.5700 32 Y 4.6297 7.4220 121.7076 57.1444 41.9208 172.6758 33 S 4.6755 7.2267 119.1174 57.0764 65.9146 172.4547 34 S 4.2426 8.8725 120.0662 57.2340 66.4881 171.9812 35 G 4.2190 8.2474 108.8003 43.5561 0.0000 173.6628 36 D 4.4804 9.2933 123.4193 52.2933 43.0870 175.5737 37 K 3.9352 8.9047 129.6188 59.6608 32.3361 178.6840 38 T 4.1867 8.1574 107.3517 63.2349 69.0468 174.8465 39 F 5.0067 8.2403 122.2804 57.1731 40.0278 174.5585 40 S 3.6498 7.6493 110.6330 60.2634 60.9580 172.4543 41 L 4.8092 8.1818 120.3806 52.4634 44.1961 177.6814 42 S 4.4897 8.8411 119.0580 58.8620 64.1262 174.0165 43 K 4.6801 8.7100 121.8171 56.7051 33.2742 175.6512 44 E 5.3711 8.9677 120.4020 55.7284 33.3747 174.1025 45 K 5.0108 9.4070 119.3876 54.9695 37.2737 175.1759 46 F 5.9748 8.9533 121.4529 56.1205 42.0180 174.6773 47 F 5.5033 10.2316 121.0994 55.7638 43.7780 173.6018 48 L 5.3539 8.8298 120.2613 53.2261 44.6261 175.8338 49 I 4.3493 8.5968 123.7254 59.2476 40.3876 175.5066 50 A 3.7665 9.6348 132.1760 53.2901 15.8659 178.0002 51 G 3.9698 8.5117 106.2392 46.7830 0.0000 173.7963 52 L 4.5499 7.8751 121.0337 52.5903 43.0933 175.4276 53 W 4.9511 8.9088 134.1810 57.6410 31.7256 174.4485 54 I 4.9763 9.4713 129.3407 59.7610 39.5894 174.6165 55 C 5.6510 9.0697 124.4908 58.1519 31.3610 173.0235 56 I 5.2206 9.3823 123.0293 59.8676 40.6386 173.9267 57 M 5.1634 8.9860 126.9407 53.4484 35.0628 174.0959 58 E 4.6300 9.0216 128.1552 56.4077 30.4540 175.8941 59 G 4.1999 9.7566 114.2765 45.9252 0.0000 172.7365 60 D 5.0457 8.6068 117.6426 53.8985 41.6297 176.5755 61 S 4.3201 7.9849 116.7562 58.1030 63.1854 173.5634 62 L 4.3725 8.4110 125.9947 53.6733 42.5366 175.7320 63 Q 4.5323 8.3617 124.4855 53.8783 30.5498 175.0754 64 E 4.1893 8.4818 123.0833 55.6601 30.5886 176.1631 65 R 4.1424 8.2983 120.7100 56.3182 30.5309 175.5630 66 T 4.7160 8.1312 114.0373 60.8546 71.9353 172.5526 67 Y 4.6153 8.4691 120.0261 57.5065 38.8145 174.8688 68 N 4.3670 7.9387 117.3221 54.0962 38.9524 173.7539 69 H 4.6456 7.8176 116.6899 54.9683 31.8193 172.3960 70 I 4.3849 7.7555 117.3078 59.2055 40.0932 174.8121 71 A 5.1890 8.2183 127.2363 50.2044 21.3011 175.3808 72 F 4.8148 9.5080 121.4186 55.8612 42.1069 175.1195 73 Q 5.0707 8.7212 120.2551 55.5362 30.0658 174.9928 74 I 4.7703 8.4085 115.3735 59.7121 42.1436 173.6290 75 Q 4.7937 8.3915 120.6246 54.6638 30.0371 177.8534 76 S 4.1581 8.7606 117.2225 61.7330 62.7247 176.6124 77 E 3.9896 8.1639 120.9734 58.9725 29.5794 178.0000 78 E 4.3760 7.9838 116.2828 56.3996 29.6588 178.3556 79 V 3.6951 7.5531 120.8580 66.2624 31.5960 177.6843 80 D 4.3293 8.0494 118.0724 57.2636 40.7377 178.1870 81 E 3.9692 8.0418 119.2807 59.6397 29.6258 178.4022 82 Y 3.9867 8.0054 116.6785 61.1070 37.8408 178.5391 83 T 3.8256 8.2426 117.3852 66.5827 68.4991 176.5198 84 E 3.9870 8.1431 119.5865 59.0768 29.4831 179.0021 85 R 3.7610 7.6739 118.8606 59.3177 30.4450 178.2751 86 I 3.6344 7.7846 119.6701 64.2332 37.0687 178.2637 87 K 3.8923 8.0319 120.2125 59.6165 31.7205 178.6172 88 A 4.0662 8.1345 120.3984 54.8711 18.3538 179.1014 89 L 4.2320 7.7267 116.2507 55.5968 41.8358 178.3718 90 G 3.9988 7.8444 106.5756 45.5802 0.0000 174.2473 91 V 4.0192 7.5096 112.1053 60.4165 32.6264 175.3473 92 E 4.3073 8.7888 123.1665 56.8398 30.4604 175.3819 93 M 5.5414 8.7590 125.6254 53.5645 35.6522 175.1161 94 K 4.6560 8.9704 122.3453 54.5691 33.5007 175.3359 95 P 4.3640 0.0000 0.0000 62.4068 31.8470 175.8997 96 E 4.0751 8.7855 122.5738 56.6692 30.0959 176.2598 97 R 4.5925 8.2045 123.6864 53.4964 32.4761 174.2827 98 P 4.3099 0.0000 0.0000 62.5578 31.5935 176.9500 99 R 3.8923 8.5984 121.7256 56.9209 30.6651 175.8198 100 V 4.2891 8.1861 120.9193 60.5455 33.4801 174.3392 101 Q 4.1000 8.7223 126.2529 59.2555 28.5288 176.6331 102 G 4.0615 9.3080 111.0308 45.1791 0.0000 172.2092 103 E 4.7471 8.3191 118.9340 54.1398 32.4165 176.9010 104 G 4.0212 8.6137 114.7236 45.4791 0.0000 171.8229 105 R 4.3985 8.4563 118.3493 56.1190 31.5938 176.0195 106 S 5.1573 8.6934 117.8560 56.7958 66.8139 173.3047 107 I 4.6317 8.5787 124.2890 59.7123 40.1066 174.0166 108 Y 5.3092 8.7487 124.2204 56.2065 40.8630 174.6672 109 F 5.4687 8.8286 117.5426 56.2752 41.7662 172.6541 110 Y 5.7062 9.2575 117.4970 55.8892 40.4478 176.1957 111 D 3.8334 8.5159 121.7281 52.9232 41.0358 176.8138 112 F 4.7557 7.8491 119.6530 58.2262 39.1273 175.1998 113 D 4.8702 8.5743 121.8691 54.4318 41.6245 175.9724 114 N 4.7590 8.4177 111.0926 54.5316 36.7974 173.7514 115 H 4.6569 7.9177 116.0450 54.6041 30.3513 174.1680 116 L 4.2511 8.2803 126.2269 54.2788 43.2463 175.4369 117 F 4.9279 9.0505 125.3972 55.7201 42.5624 174.2744 118 E 4.9843 8.9428 120.8068 54.6315 33.3287 173.8670 119 L 5.1779 8.8671 126.8104 53.4557 44.0053 174.7437 120 H 5.2645 9.4184 124.6049 54.2335 32.3087 173.5637 121 A 5.0682 8.3307 126.7379 51.3251 19.5394 176.8011 122 G 4.0329 6.6721 106.6277 44.5043 0.0000 172.5849 123 T 4.7551 7.8328 107.4749 58.7934 72.2411 174.5926 124 L 3.9850 8.5270 122.6269 58.2696 42.0045 178.2910 125 E 3.9260 8.1956 118.0180 59.8350 29.3768 179.1053 126 E 3.9332 8.0085 118.3434 59.4518 29.2628 179.6226 127 R 4.1701 7.3985 119.4033 58.4571 30.4790 177.8718 128 L 4.3466 8.0877 118.0548 56.2699 41.7448 179.0247 129 K 3.9051 8.0290 120.3685 59.3490 31.9241 179.7293 130 R 4.0708 7.0113 118.3184 61.2803 29.4141 180.8219 131 Y 4.5563 7.1983 119.9486 57.0745 37.9750 175.6186 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 4.44 0.00 2.02 2.07 0.00 0.00 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.51 0.00 2 I 8.06 3.90 1.86 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.07 0.89 0.00 0.00 3 S 9.06 4.31 0.00 3.87 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 4 G 7.21 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 0.00 0.00 0.00 5 L 8.08 4.31 0.00 1.57 1.58 0.83 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 6 S 8.49 4.49 0.00 3.89 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 7 H 6.73 4.52 0.00 2.34 2.10 0.00 5.52 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 I 7.64 4.45 1.83 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.73 0.83 0.00 0.00 9 T 8.39 5.00 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 10 L 8.80 4.80 0.00 1.61 1.37 1.01 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 11 I 8.41 4.96 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 1.39 0.85 1.01 0.00 0.00 12 V 8.77 4.75 2.33 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 0.95 0.00 0.00 1.10 0.00 0.00 13 K 9.26 3.76 0.00 1.84 1.87 0.00 1.61 0.00 0.00 1.50 0.00 0.00 2.84 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.46 1.35 7.81 14 D 7.79 4.77 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 15 L 9.02 4.06 0.00 1.89 1.81 1.13 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 16 N 8.25 4.43 0.00 2.80 2.90 0.00 0.00 6.72 7.02 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 17 K 8.36 3.99 0.00 1.72 1.65 0.00 0.90 0.00 0.00 1.28 0.00 0.00 2.50 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.54 1.15 7.81 18 T 8.24 4.26 4.54 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 1.35 0.00 0.00 19 T 8.27 3.85 4.59 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 1.58 0.00 0.00 20 A 7.97 4.27 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 21 F 8.26 4.19 0.00 3.40 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 22 L 8.40 3.86 0.00 1.44 1.35 0.49 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 23 Q 8.13 4.13 0.00 2.28 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.82 0.00 0.00 0.00 0.00 0.00 2.69 2.69 0.00 24 N 8.21 4.28 0.00 2.75 2.79 0.00 0.00 7.07 7.70 0.00 0.00 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 I 7.35 3.66 0.71 0.00 0.00 0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 -0.03 -0.13 0.00 0.00 26 F 7.50 4.43 0.00 2.76 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 27 N 8.36 4.85 0.00 2.78 2.84 0.00 0.00 7.31 7.96 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 28 A 7.81 4.39 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 29 E 8.88 4.67 0.00 2.14 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 2.27 2.28 0.00 30 E 9.13 4.09 0.00 2.00 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 2.11 1.82 0.00 31 I 8.54 4.61 1.89 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.02 0.98 0.00 0.00 32 Y 7.42 4.63 0.00 2.95 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 33 S 7.23 4.68 0.00 3.81 3.37 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 34 S 8.87 4.24 0.00 3.42 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 35 G 8.25 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 36 D 9.29 4.48 0.00 2.70 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 37 K 8.90 3.94 0.00 1.85 1.82 0.00 1.78 0.00 0.00 1.88 0.00 0.00 2.97 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.53 1.46 7.81 38 T 8.16 4.19 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 1.23 0.00 0.00 39 F 8.24 5.01 0.00 3.15 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 S 7.65 3.65 0.00 4.07 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 41 L 8.18 4.81 0.00 1.75 1.57 1.12 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 42 S 8.84 4.49 0.00 3.94 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 43 K 8.71 4.68 0.00 1.78 1.79 0.00 1.88 0.00 0.00 1.89 0.00 0.00 2.92 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.54 1.46 7.81 44 E 8.97 5.37 0.00 2.32 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.36 0.00 45 K 9.41 5.01 0.00 1.87 1.31 0.00 1.81 0.00 0.00 1.73 0.00 0.00 2.95 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.21 1.42 7.81 46 F 8.95 5.97 0.00 3.05 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 47 F 10.23 5.50 0.00 3.06 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 L 8.83 5.35 0.00 1.68 1.62 0.93 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 49 I 8.60 4.35 1.83 0.00 0.00 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.72 0.50 0.00 0.00 50 A 9.63 3.77 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 51 G 8.51 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 52 L 7.88 4.55 0.00 1.99 1.72 1.10 0.81 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 53 W 8.91 4.95 0.00 3.37 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 54 I 9.47 4.98 2.09 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.16 1.02 0.00 0.00 55 C 9.07 5.65 0.00 2.76 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 56 I 9.38 5.22 2.23 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.31 1.09 0.00 0.00 57 M 8.99 5.16 0.00 2.15 1.99 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.51 0.00 58 E 9.02 4.63 0.00 2.11 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 2.41 2.39 0.00 59 G 9.76 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 60 D 8.61 5.05 0.00 2.66 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 S 7.98 4.32 0.00 3.88 3.83 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 62 L 8.41 4.37 0.00 1.63 1.59 0.92 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 63 Q 8.36 4.53 0.00 1.97 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 7.05 0.00 0.00 0.00 0.00 0.00 2.23 2.30 0.00 64 E 8.48 4.19 0.00 2.11 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 2.28 2.24 0.00 65 R 8.30 4.14 0.00 1.76 1.88 0.00 3.15 0.00 0.00 3.33 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.84 0.00 66 T 8.13 4.72 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 1.29 0.00 0.00 67 Y 8.47 4.62 0.00 2.85 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 68 N 7.94 4.37 0.00 2.72 2.65 0.00 0.00 6.70 8.32 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 69 H 7.82 4.65 0.00 3.02 2.94 0.00 5.47 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 I 7.76 4.38 1.64 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.38 0.35 0.00 0.00 71 A 8.22 5.19 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 F 9.51 4.81 0.00 3.13 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 73 Q 8.72 5.07 0.00 2.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.79 0.00 0.00 0.00 0.00 0.00 2.36 2.39 0.00 74 I 8.41 4.77 1.90 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 1.17 0.73 0.49 0.00 0.00 75 Q 8.39 4.79 0.00 1.94 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.07 6.83 0.00 0.00 0.00 0.00 0.00 2.51 2.47 0.00 76 S 8.76 4.16 0.00 4.05 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 0.00 77 E 8.16 3.99 0.00 1.95 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.47 0.00 78 E 7.98 4.38 0.00 2.29 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 2.23 2.31 0.00 79 V 7.55 3.70 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 1.01 0.00 0.00 80 D 8.05 4.33 0.00 2.71 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 81 E 8.04 3.97 0.00 1.87 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 2.23 2.14 0.00 82 Y 8.01 3.99 0.00 3.28 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 T 8.24 3.83 4.40 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 1.22 0.00 0.00 84 E 8.14 3.99 0.00 2.18 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 2.43 2.23 0.00 85 R 7.67 3.76 0.00 1.92 2.08 0.00 3.31 0.00 0.00 3.01 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.54 0.00 86 I 7.78 3.63 1.69 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.66 0.07 0.63 0.00 0.00 87 K 8.03 3.89 0.00 2.04 1.90 0.00 1.64 0.00 0.00 1.67 0.00 0.00 2.98 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.45 1.49 7.81 88 A 8.13 4.07 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 89 L 7.73 4.23 0.00 1.85 1.88 0.83 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 90 G 7.84 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 91 V 7.51 4.02 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 0.79 0.00 0.00 1.14 0.00 0.00 92 E 8.79 4.31 0.00 2.13 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 2.65 2.45 0.00 93 M 8.76 5.54 0.00 2.02 2.01 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.70 0.00 94 K 8.97 4.66 0.00 1.81 1.80 0.00 1.64 0.00 0.00 1.73 0.00 0.00 2.90 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.62 1.53 7.81 95 P 0.00 4.36 0.00 2.21 2.11 0.00 3.84 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 2.02 1.99 0.00 96 E 8.79 4.08 0.00 2.02 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 2.35 2.42 0.00 97 R 8.20 4.59 0.00 1.88 1.86 0.00 3.44 0.00 0.00 3.33 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.55 0.00 98 P 0.00 4.31 0.00 2.05 2.02 0.00 3.73 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 2.04 2.13 0.00 99 R 8.60 3.89 0.00 1.81 1.94 0.00 3.35 0.00 0.00 3.19 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.62 0.00 100 V 8.19 4.29 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 1.20 0.00 0.00 0.99 0.00 0.00 101 Q 8.72 4.10 0.00 2.09 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.66 0.00 0.00 0.00 0.00 0.00 2.38 2.39 0.00 102 G 9.31 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 E 8.32 4.75 0.00 1.97 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 2.28 2.26 0.00 104 G 8.61 4.02 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 0.00 0.00 0.00 105 R 8.46 4.40 0.00 1.77 1.89 0.00 3.27 0.00 0.00 3.36 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.62 0.00 106 S 8.69 5.16 0.00 3.89 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 0.00 107 I 8.58 4.63 1.88 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 1.25 0.73 0.92 0.00 0.00 108 Y 8.75 5.31 0.00 3.00 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 0.00 109 F 8.83 5.47 0.00 3.39 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 0.00 110 Y 9.26 5.71 0.00 2.85 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 0.00 111 D 8.52 3.83 0.00 1.81 2.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 F 7.85 4.76 0.00 3.04 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 0.00 113 D 8.57 4.87 0.00 2.68 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 0.00 114 N 8.42 4.76 0.00 2.88 2.88 0.00 0.00 7.15 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 0.00 115 H 7.92 4.66 0.00 3.32 2.83 0.00 5.80 0.00 0.00 0.00 0.00 6.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 L 8.28 4.25 0.00 1.49 1.48 0.50 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 117 F 9.05 4.93 0.00 1.95 2.66 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 0.00 118 E 8.94 4.98 0.00 1.58 1.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.47 0.00 119 L 8.87 5.18 0.00 1.58 1.40 0.22 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 120 H 9.42 5.26 0.00 3.26 3.12 0.00 5.76 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 A 8.33 5.07 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 G 6.67 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 0.00 0.00 0.00 123 T 7.83 4.76 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 1.21 0.00 0.00 124 L 8.53 3.99 0.00 1.80 1.71 0.95 0.89 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 0.00 125 E 8.20 3.93 0.00 2.04 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.41 0.00 126 E 8.01 3.93 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 2.32 2.47 0.00 127 R 7.40 4.17 0.00 1.97 2.20 0.00 3.19 0.00 0.00 3.19 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.62 0.00 128 L 8.09 4.35 0.00 1.66 1.63 1.03 1.34 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 0.00 129 K 8.03 3.91 0.00 1.63 1.76 0.00 1.64 0.00 0.00 1.60 0.00 0.00 3.07 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.64 1.53 7.81 130 R 7.01 4.07 0.00 1.98 1.85 0.00 3.27 0.00 0.00 3.27 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.51 0.00 131 Y 7.20 4.56 0.00 3.01 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00