NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 8 S 4.3627 8.3344 116.7919 57.9818 64.2662 172.6761 9 K 3.8738 8.4394 123.7428 55.7176 32.2696 174.7587 10 C 4.4858 9.2505 126.2310 57.8266 29.0870 171.3668 11 P 4.5300 0.0000 0.0000 64.7180 32.2579 176.4242 12 L 5.0426 7.4832 120.5931 53.5660 44.8128 175.1177 13 M 4.9951 9.3474 125.6970 53.6993 36.3139 173.8638 14 V 4.9068 8.2736 123.0388 60.9249 35.0920 174.1386 15 K 4.9617 9.0033 127.8424 54.6108 35.5708 174.7170 16 V 4.7859 8.8828 127.3453 61.0624 34.3389 174.2058 17 L 5.0336 8.9892 127.1997 52.8799 45.9182 174.8123 18 D 5.3166 9.0682 121.3340 52.7730 42.5955 176.5683 19 A 4.3116 9.2507 128.3725 53.7818 18.6806 178.6649 20 V 3.8428 8.5791 114.7702 65.1532 31.9242 176.8616 21 R 4.4275 8.8213 116.0716 55.2320 30.8613 176.0511 22 G 3.8971 8.4735 106.2110 46.1472 0.0000 173.0699 23 S 4.7513 7.5961 111.8203 55.7206 67.1998 171.5635 24 P 4.5996 0.0000 0.0000 62.6202 31.9117 176.7050 25 A 4.2920 8.8001 125.5193 50.9154 19.4616 176.2778 26 I 4.1939 8.2813 122.3295 61.6790 38.6903 175.9770 27 N 4.2720 8.6464 122.4090 54.2359 36.6441 174.2530 28 V 4.0070 7.7798 118.7966 62.2650 32.9334 175.0948 29 A 4.7209 8.5417 129.4926 51.8470 20.0840 176.2185 30 V 4.8102 8.7221 121.0854 61.3769 35.2581 173.8605 31 H 4.9635 9.3648 124.7481 53.8636 31.9166 172.7663 32 V 4.8519 8.7593 123.1803 61.2328 33.8731 174.4495 33 F 5.4771 9.4476 125.3860 55.7006 43.5623 173.6381 34 R 4.6609 9.0021 121.2735 54.0730 32.6165 174.7003 35 K 3.9156 8.7084 128.6174 56.2136 32.5482 176.6850 36 A 4.2609 9.1977 131.6498 50.5597 20.0963 177.6112 37 A 3.8830 8.6607 122.4628 55.7097 18.0258 179.1469 38 D 4.3411 7.8618 110.6342 54.0286 39.2704 175.6306 39 D 4.1930 8.0694 118.8284 55.5968 40.0162 172.9404 40 T 4.3993 7.4235 105.7615 58.9328 72.5562 172.3887 41 W 5.1467 8.4242 121.8823 55.7376 30.2189 175.7343 42 E 4.8300 9.1371 125.2233 54.0157 31.0463 174.0678 43 P 4.3153 0.0000 0.0000 63.7520 31.5570 174.9808 44 F 4.7969 8.9192 124.2297 59.4727 41.5900 174.5814 45 A 4.6100 7.6491 117.5284 51.4259 22.4354 174.6232 46 S 4.6188 7.5697 112.3844 57.8096 65.8936 174.2965 47 G 3.9431 7.3667 105.4810 46.3948 0.0000 171.6610 48 K 5.2360 8.4788 118.4842 54.2506 35.2254 176.9546 49 T 4.1842 8.5300 115.1692 61.9351 70.2104 175.0927 50 S 4.8982 8.7631 118.6985 57.5363 65.0183 174.4406 51 E 3.9603 8.7158 118.7937 59.0587 29.1944 177.9099 52 S 4.5062 7.8835 111.8815 57.5179 63.3508 174.4913 53 G 3.8544 8.3307 108.8239 46.0190 0.0000 173.0783 54 E 5.1361 7.7671 117.6273 54.0754 33.7424 175.0943 55 L 4.7565 8.4229 123.1611 54.1535 45.1365 174.9279 56 H 5.1275 8.6533 122.4917 53.5032 32.5710 173.4837 57 G 3.9434 8.6078 104.5719 46.8954 0.0000 175.4795 58 L 4.0299 8.0664 121.3821 57.2613 42.0097 176.6709 59 T 4.5967 7.5356 109.6456 61.6755 70.4437 171.4643 60 T 4.7653 8.0338 111.4843 59.2023 71.6578 174.7064 61 E 4.1272 8.8341 121.3757 59.6026 29.6757 178.5860 62 E 4.1222 8.2408 118.4801 58.7900 29.9063 177.1006 63 E 4.3318 8.0462 117.9767 57.9712 30.1749 175.4605 64 F 5.1034 8.1844 121.8483 57.4325 37.5085 174.8802 65 V 4.1499 7.6465 118.5048 59.1140 33.3356 175.6836 66 E 4.3075 8.0530 120.3659 55.7109 30.0937 177.5583 67 G 3.7700 7.8468 108.1287 46.7194 0.0000 170.1469 68 I 4.8026 7.1965 120.1611 59.8789 39.0254 174.9211 69 Y 4.9907 8.6380 124.7773 55.8089 41.5984 174.5215 70 K 4.7065 8.9998 123.5946 54.5217 35.3441 174.7242 71 V 4.7641 9.1203 127.9079 61.2616 33.6504 173.6596 72 E 5.0333 9.4522 129.9145 54.4878 32.2242 174.3288 73 I 4.5914 8.7335 128.4686 59.8087 39.3931 175.2408 74 D 5.1483 9.1239 128.4393 53.9986 39.2491 176.3347 75 T 3.8607 8.0424 116.2105 63.7090 69.4059 176.5928 76 K 4.0741 8.1586 122.1149 59.7592 32.2676 178.8540 77 S 4.1848 8.1487 115.3748 61.4921 62.1795 176.1504 78 Y 3.8477 7.5442 122.0318 60.4525 38.4732 178.1231 79 W 4.0393 8.0467 119.8842 59.6748 29.1579 178.6974 80 K 3.9820 8.4235 118.2962 59.4719 31.2286 179.1350 81 A 4.0047 7.6473 119.7216 54.2384 18.3621 178.6499 82 L 4.3310 7.1230 115.2180 54.2028 42.1284 177.1233 83 G 3.8881 8.0870 107.0648 46.3969 0.0000 173.2975 84 I 4.4459 7.8867 120.0267 58.8670 39.3673 175.4890 85 S 4.3382 8.7433 120.6291 57.1413 62.5818 171.7516 86 P 4.4888 0.0000 0.0000 61.3272 33.1964 175.5507 87 F 4.0612 8.1533 121.1453 60.8009 39.4896 175.9634 88 H 4.4262 7.7596 115.8109 54.9279 29.5823 175.3991 89 E 4.0031 8.6436 122.9156 59.5826 29.5096 176.3456 90 H 4.7958 7.5458 110.0865 55.8097 31.3310 172.8845 91 A 4.3555 8.3178 120.6779 50.0737 20.9025 175.7350 92 E 5.0777 8.7612 120.9924 54.3838 33.2886 175.5442 93 V 4.4729 9.1426 123.4487 61.1160 34.4327 174.1696 94 V 5.0637 8.6518 127.8486 61.1087 33.7028 174.2887 95 F 5.1386 9.0878 121.8530 56.2230 41.9879 172.8473 96 T 5.0499 8.7471 115.5347 61.9383 70.3012 174.0457 97 A 4.6778 9.2668 128.4627 50.7120 20.6408 175.3745 98 N 5.2180 8.8740 121.2792 51.8322 41.5632 173.6211 99 D 4.8250 10.0062 127.6843 53.5874 41.7262 177.7513 100 S 4.5834 8.5635 117.6769 57.4077 64.6074 175.3649 101 G 4.0934 8.1179 113.8947 45.0836 0.0000 168.6384 102 P 4.5408 0.0000 0.0000 62.7325 31.9921 175.9743 103 R 4.8970 8.2428 118.9886 54.8950 34.6076 174.0023 104 R 4.8110 9.1580 122.3790 54.8257 32.9901 173.9046 105 Y 5.0176 9.3412 123.9663 56.5203 40.7360 174.6312 106 T 4.9618 8.7466 120.8531 61.8754 71.5144 173.1556 107 I 4.6625 8.8817 128.3465 59.7942 39.0255 174.6129 108 A 5.2689 8.9486 129.4016 50.0951 21.8991 175.0833 109 A 5.1758 8.9144 121.9372 50.0300 23.0783 174.7518 110 L 5.0646 8.9820 123.8539 53.3211 44.7188 174.9889 111 L 5.3628 8.8889 126.4331 53.3941 44.3815 175.8732 112 S 5.0910 9.3505 117.9543 56.1643 67.4279 173.5308 113 P 3.0969 0.0000 0.0000 65.2293 31.0583 177.9147 114 Y 4.4917 7.7503 111.6910 57.3153 38.4848 175.0366 115 S 4.7563 7.7890 114.2237 57.4267 65.7200 172.4881 116 Y 5.4632 7.7726 122.2787 55.8310 41.0610 174.0432 117 S 4.9501 9.2300 116.2026 57.1691 66.9279 173.0436 118 T 5.2254 8.4482 115.7020 60.9527 70.4448 172.9934 119 T 4.8639 8.9067 123.0071 61.7692 73.1995 172.4345 120 A 5.0587 8.5994 125.3944 50.1794 21.6923 176.2472 121 V 4.1700 8.7857 122.1548 61.2882 33.9769 174.4061 122 I 4.7070 8.2811 129.7868 59.9273 38.4204 175.3036 123 T 4.6500 8.3941 116.8003 59.5408 72.6877 174.2405 124 N 4.6516 8.5187 117.9498 53.6301 38.7783 175.4277 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 8 S 8.33 4.36 0.00 3.87 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 K 8.44 3.87 0.00 1.81 1.88 0.00 2.01 0.00 0.00 1.74 0.00 0.00 3.17 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.42 1.48 7.81 10 C 9.25 4.49 0.00 2.98 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 11 P 0.00 4.53 0.00 1.87 2.27 0.00 3.47 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 2.07 2.20 0.00 12 L 7.48 5.04 0.00 0.74 1.04 0.87 0.57 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 13 M 9.35 5.00 0.00 2.04 1.82 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.59 0.00 14 V 8.27 4.91 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 0.83 0.00 0.00 0.90 0.00 0.00 15 K 9.00 4.96 0.00 1.81 1.55 0.00 1.47 0.00 0.00 1.62 0.00 0.00 2.88 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.29 1.35 7.81 16 V 8.88 4.79 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 0.68 0.00 0.00 0.81 0.00 0.00 17 L 8.99 5.03 0.00 1.58 1.51 0.93 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 18 D 9.07 5.32 0.00 2.66 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 A 9.25 4.31 1.42 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 0.00 0.00 20 V 8.58 3.84 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.92 0.00 0.00 21 R 8.82 4.43 0.00 1.92 2.02 0.00 3.38 0.00 0.00 3.31 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.72 0.00 22 G 8.47 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 23 S 7.60 4.75 0.00 3.88 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 24 P 0.00 4.60 0.00 1.95 2.14 0.00 3.67 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 2.17 2.08 0.00 25 A 8.80 4.29 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.28 4.19 1.91 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 1.58 0.77 0.96 0.00 0.00 27 N 8.65 4.27 0.00 2.88 2.95 0.00 0.00 6.94 7.34 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 28 V 7.78 4.01 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 0.75 0.00 0.00 0.52 0.00 0.00 29 A 8.54 4.72 1.26 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 0.00 0.00 30 V 8.72 4.81 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 0.97 0.00 0.00 0.91 0.00 0.00 31 H 9.36 4.96 0.00 3.06 2.74 0.00 5.63 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 V 8.76 4.85 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 1.30 0.00 0.00 0.95 0.00 0.00 33 F 9.45 5.48 0.00 2.91 3.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 R 9.00 4.66 0.00 1.58 1.70 0.00 2.93 0.00 0.00 2.99 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.50 0.00 35 K 8.71 3.92 0.00 0.79 1.27 0.00 1.34 0.00 0.00 1.27 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.01 0.63 7.81 36 A 9.20 4.26 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 A 8.66 3.88 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 D 7.86 4.34 0.00 2.71 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 39 D 8.07 4.19 0.00 2.66 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 40 T 7.42 4.40 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 1.18 0.00 0.00 41 W 8.42 5.15 0.00 2.89 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 42 E 9.14 4.83 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 2.30 2.46 0.00 43 P 0.00 4.32 0.00 1.98 2.00 0.00 3.77 0.00 0.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.40 0.00 44 F 8.92 4.80 0.00 3.06 3.23 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 45 A 7.65 4.61 1.16 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 0.00 0.00 0.00 0.00 0.00 0.00 46 S 7.57 4.62 0.00 3.64 3.54 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 47 G 7.37 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 0.00 0.00 0.00 48 K 8.48 5.24 0.00 1.56 1.65 0.00 1.74 0.00 0.00 1.85 0.00 0.00 2.83 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.28 1.36 7.81 49 T 8.53 4.18 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 50 S 8.76 4.90 0.00 3.98 4.11 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 0.00 0.00 0.00 51 E 8.72 3.96 0.00 1.97 2.05 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 2.31 2.29 0.00 52 S 7.88 4.51 0.00 4.00 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 53 G 8.33 3.85 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 0.00 0.00 0.00 0.00 0.00 0.00 54 E 7.77 5.14 0.00 1.81 1.55 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 2.21 2.38 0.00 55 L 8.42 4.76 0.00 1.63 1.37 0.89 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 56 H 8.65 5.13 0.00 2.99 3.16 0.00 6.10 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 G 8.61 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 0.00 0.00 0.00 58 L 8.07 4.03 0.00 1.58 1.71 0.87 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 59 T 7.54 4.60 4.33 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 0.99 0.00 0.00 60 T 8.03 4.77 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 1.20 0.00 0.00 61 E 8.83 4.13 0.00 2.04 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 0.00 2.42 2.38 0.00 62 E 8.24 4.12 0.00 1.97 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 2.34 2.28 0.00 63 E 8.05 4.33 0.00 2.19 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 2.64 2.47 0.00 64 F 8.18 5.10 0.00 3.12 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 65 V 7.65 4.15 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 0.84 0.00 0.00 1.04 0.00 0.00 66 E 8.05 4.31 0.00 1.82 1.87 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 2.45 2.29 0.00 67 G 7.85 3.77 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 0.00 0.00 0.00 68 I 7.20 4.80 1.71 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.66 1.15 0.00 0.00 69 Y 8.64 4.99 0.00 1.68 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 70 K 9.00 4.71 0.00 0.79 0.74 0.00 1.13 0.00 0.00 0.61 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.01 1.01 7.81 71 V 9.12 4.76 2.18 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 0.72 0.00 0.00 1.16 0.00 0.00 72 E 9.45 5.03 0.00 1.95 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 2.17 2.02 0.00 73 I 8.73 4.59 1.73 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.78 0.78 0.00 0.00 74 D 9.12 5.15 0.00 2.79 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 75 T 8.04 3.86 4.45 0.00 0.00 0.00 0.00 0.00 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 76 K 8.16 4.07 0.00 2.16 1.89 0.00 1.72 0.00 0.00 1.83 0.00 0.00 2.92 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.56 1.58 7.81 77 S 8.15 4.18 0.00 3.95 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 78 Y 7.54 3.85 0.00 2.98 2.78 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 79 W 8.05 4.04 0.00 3.53 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 80 K 8.42 3.98 0.00 1.93 1.89 0.00 1.70 0.00 0.00 1.85 0.00 0.00 2.96 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.50 1.54 7.81 81 A 7.65 4.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 L 7.12 4.33 0.00 1.75 1.79 0.54 0.43 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 83 G 8.09 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 I 7.89 4.45 2.15 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.82 0.77 0.00 0.00 85 S 8.74 4.34 0.00 3.88 3.85 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 0.00 0.00 0.00 86 P 0.00 4.49 0.00 2.29 2.17 0.00 3.83 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 2.12 0.00 87 F 8.15 4.06 0.00 1.78 2.56 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 0.00 88 H 7.76 4.43 0.00 3.28 3.45 0.00 5.95 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 E 8.64 4.00 0.00 1.69 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 2.15 2.13 0.00 90 H 7.55 4.80 0.00 3.20 3.23 0.00 5.10 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 A 8.32 4.36 0.32 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 92 E 8.76 5.08 0.00 1.84 1.78 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 2.04 2.27 0.00 93 V 9.14 4.47 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 0.92 0.00 0.00 0.98 0.00 0.00 94 V 8.65 5.06 2.18 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 1.06 0.00 0.00 0.86 0.00 0.00 95 F 9.09 5.14 0.00 3.11 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 96 T 8.75 5.05 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 1.31 0.00 0.00 97 A 9.27 4.68 0.74 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 0.00 0.00 98 N 8.87 5.22 0.00 2.88 2.77 0.00 0.00 7.23 7.99 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 99 D 10.01 4.82 0.00 2.76 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 S 8.56 4.58 0.00 3.89 3.85 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 0.00 0.00 0.00 101 G 8.12 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 P 0.00 4.54 0.00 2.20 2.09 0.00 3.77 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.99 0.00 103 R 8.24 4.90 0.00 1.43 1.61 0.00 3.21 0.00 0.00 3.21 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.55 0.00 104 R 9.16 4.81 0.00 1.75 1.78 0.00 3.19 0.00 0.00 3.17 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.70 0.00 105 Y 9.34 5.02 0.00 2.96 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 0.00 106 T 8.75 4.96 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 1.19 0.00 0.00 107 I 8.88 4.66 1.84 0.00 0.00 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.86 0.90 0.00 0.00 108 A 8.95 5.27 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 0.00 109 A 8.91 5.18 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 L 8.98 5.06 0.00 1.80 1.58 0.98 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 111 L 8.89 5.36 0.00 1.91 2.02 0.60 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 112 S 9.35 5.09 0.00 3.93 3.68 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 0.00 113 P 0.00 3.10 0.00 2.09 1.58 0.00 3.30 0.00 0.00 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.93 0.00 114 Y 7.75 4.49 0.00 2.86 2.90 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 0.00 115 S 7.79 4.76 0.00 3.81 3.70 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 0.00 0.00 0.00 116 Y 7.77 5.46 0.00 3.09 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 S 9.23 4.95 0.00 3.81 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 0.00 118 T 8.45 5.23 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 1.34 0.00 0.00 119 T 8.91 4.86 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 0.00 120 A 8.60 5.06 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 V 8.79 4.17 2.05 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 0.94 0.00 0.00 0.91 0.00 0.00 122 I 8.28 4.71 1.71 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 -0.01 0.57 0.00 0.00 123 T 8.39 4.65 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 1.17 0.00 0.00 124 N 8.52 4.65 0.00 2.69 2.75 0.00 0.00 6.77 7.56 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