NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 21 E 4.3114 8.4444 118.7994 56.5953 30.9451 172.8270 22 L 4.3307 7.7824 118.7871 53.9999 45.1286 171.1586 23 V 4.0674 8.1160 111.1940 60.4700 29.6293 175.7056 24 R 4.6327 7.7971 118.5588 56.9581 31.2546 179.5165 25 T 4.7462 7.7545 112.4287 61.5939 66.0544 175.7168 26 D 4.6494 9.4204 117.0758 55.8022 39.1686 176.3788 27 S 4.7073 7.6402 113.5141 55.5061 66.7585 172.7520 28 P 4.5084 0.0000 0.0000 64.4581 31.2743 177.0833 29 N 4.3572 7.7564 117.3384 55.2608 40.0274 174.2070 30 F 5.4824 7.7259 117.8124 55.8278 41.6386 174.4346 31 L 5.0891 9.3448 124.6967 53.0230 44.5377 175.8644 32 C 5.2958 8.5721 119.8278 58.1157 32.5797 173.4224 33 S 4.8796 9.4423 115.1766 57.0509 64.2725 173.0008 34 V 5.2679 8.3652 118.6609 59.6724 35.8556 174.7138 35 L 4.7167 8.6029 123.2264 52.4554 43.9789 174.3886 36 P 4.2853 0.0000 0.0000 63.5756 31.7003 175.9527 37 T 3.3679 7.4791 114.1104 61.5155 67.9650 175.4370 38 H 4.5940 8.0956 115.2083 53.5361 27.6289 174.3241 39 W 5.4139 7.0154 114.4689 56.5718 30.4500 173.8202 40 R 3.9940 8.6181 116.4220 56.8440 29.3918 175.9453 41 C 4.3658 8.7583 117.3094 58.6203 29.9242 172.7157 42 N 4.0500 8.4758 120.2357 54.6027 39.0279 175.3468 43 K 3.9649 7.4180 120.3180 55.3725 33.0762 176.3596 44 T 4.3965 8.1138 111.2728 60.8505 66.3479 173.8958 45 L 4.2417 7.9356 129.7461 54.6543 42.6486 176.4364 46 P 4.4510 0.0000 0.0000 64.0334 31.4022 177.3644 47 I 3.4839 7.3051 112.3865 61.9561 37.4310 176.6944 48 A 3.2010 7.4616 123.8608 51.7169 17.7472 175.2913 49 F 5.5710 8.7346 115.3744 56.4468 43.9920 174.2368 50 K 4.7678 9.2203 121.2528 54.4432 36.2364 175.3214 51 V 5.0376 8.1395 117.2183 59.7111 36.5570 174.5495 52 V 4.8450 9.2441 123.4362 61.2221 34.6669 173.9637 53 A 5.3528 9.1625 130.1839 50.2883 21.0026 175.1172 54 L 4.5532 9.1828 123.5294 55.0933 42.5205 177.1466 55 G 4.0788 8.9278 112.9478 45.9656 0.0000 171.7317 56 D 4.7304 8.6972 117.4283 53.8388 41.9617 177.7328 57 V 3.7956 7.7463 111.7555 61.7064 32.1328 174.4256 58 P 4.3661 0.0000 0.0000 65.5464 31.5357 176.2779 59 D 5.0620 7.2933 116.5741 51.5930 41.8842 174.6897 60 G 3.7467 9.8977 106.6621 47.3696 0.0000 174.3868 61 T 4.0454 6.3817 112.3053 60.3699 69.7026 169.4865 62 L 5.0236 7.8236 124.4743 53.1329 44.7603 175.6343 63 V 4.3685 8.8708 127.6230 60.8444 33.4222 174.8553 64 T 4.8427 8.7928 120.3133 59.1313 70.1096 172.7328 65 V 4.5690 8.2910 122.4519 60.4408 33.0356 175.3740 66 M 4.8769 8.7885 125.2840 53.4904 35.1166 174.8116 67 A 5.3455 8.5145 127.5120 50.0517 20.4716 174.6924 68 G 4.1735 8.2357 113.5536 45.3056 0.0000 173.4356 69 N 4.9303 8.2560 116.3715 52.2196 39.0108 176.9682 70 D 4.5381 8.2382 118.7739 55.2049 40.4142 174.1643 71 E 4.5915 7.1245 117.4789 53.4091 30.0667 171.7708 72 N 4.2651 8.2150 126.1512 53.5341 43.9674 175.0384 73 Y 3.7848 7.5515 111.6635 58.4998 35.8305 171.9164 74 S 3.9750 7.5992 116.4491 59.5932 61.9264 172.9236 75 A 3.5273 7.3793 123.0718 49.4903 17.8690 176.7572 76 E 3.7188 7.6694 115.5950 56.6567 27.6251 174.4552 77 L 5.2138 7.9117 125.3960 53.8758 44.0881 177.1882 78 R 4.2774 8.3560 118.8622 54.7502 29.9245 175.9408 79 N 4.1896 8.4411 116.2097 53.7340 37.6495 174.8710 80 A 3.8643 7.4578 115.3385 53.1783 19.1492 177.0713 81 T 4.6941 7.5314 114.4786 62.9369 69.7248 174.4025 82 A 4.5501 8.8185 128.7501 50.2985 22.4416 175.0123 83 A 4.8059 8.6297 124.3960 51.2705 20.7945 176.1954 84 M 4.5593 8.9093 118.9027 53.6469 35.7885 174.7012 85 K 4.4773 8.4388 116.7630 58.5748 35.0539 177.8655 86 N 4.7842 7.7947 115.2169 52.7091 38.5398 176.3421 87 Q 3.9800 8.4310 113.7982 56.5988 26.8830 173.3082 88 V 5.0813 7.2511 109.9939 59.6353 35.7952 174.4478 89 A 4.7925 8.6628 123.6857 50.0758 22.9005 175.2893 90 R 4.4993 7.5992 116.2846 54.4267 32.1344 174.3445 91 F 4.9344 8.1517 117.7055 56.8384 41.5743 174.0068 92 N 4.9508 9.3231 112.6262 52.5345 38.9727 175.2614 93 D 4.5250 8.3624 119.2047 57.0778 41.3292 176.9055 94 L 4.0331 7.8207 118.5288 54.5874 42.2005 177.2679 95 R 4.6126 8.1043 120.4339 54.5691 34.2765 174.3088 96 F 4.6777 9.1402 122.5373 56.6889 41.2559 176.2860 97 V 3.6742 8.4964 113.9495 62.6705 30.0095 175.4737 98 G 3.5124 8.2295 101.2055 49.9723 0.0000 175.4308 99 R 4.0146 6.7766 121.4770 55.8568 30.4112 175.7093 100 S 4.1718 8.8144 110.1741 58.0508 62.8992 168.4647 101 G 4.2833 8.0721 111.5157 44.7377 0.0000 172.1059 102 R 4.4924 8.5512 113.2779 56.1164 31.6604 175.1617 103 G 4.1300 8.8876 107.7003 46.6669 0.0000 173.0425 104 K 4.8484 7.4183 113.8812 54.3005 36.6100 175.5368 105 S 5.1190 8.9819 118.1197 57.0104 65.9469 173.8042 106 F 4.6605 9.1298 126.6877 57.6293 38.9232 174.3402 107 T 4.3367 8.4863 124.2020 61.7756 66.9036 172.0874 108 L 4.2834 7.0524 125.2584 55.4917 43.6446 175.4232 109 T 5.1027 8.8316 120.8038 60.3331 71.1150 172.5546 110 I 4.4174 8.7214 129.4890 60.4996 38.9245 174.6162 111 T 4.6224 8.7254 123.9738 60.1858 68.5414 174.2493 112 V 4.1343 8.2321 129.3977 61.9965 32.4935 175.2904 113 F 4.7123 8.6304 126.3244 58.1313 39.4387 174.6004 114 T 4.6263 7.4822 112.1154 59.1248 70.7457 172.9541 115 N 4.2166 8.9339 120.2745 55.6712 38.3045 174.1614 116 P 4.4437 0.0000 0.0000 60.4355 30.4142 172.8128 117 P 4.2015 0.0000 0.0000 63.4782 32.0029 176.1151 118 Q 4.3514 8.7008 127.8238 54.8171 30.0061 174.3940 119 V 4.8286 8.3066 120.5335 59.8035 32.9372 175.4767 120 A 4.9112 9.0938 127.8207 50.2121 22.2042 174.5117 121 T 4.9876 8.4898 114.7544 60.3094 70.5672 172.4577 122 Y 4.7067 8.3743 129.0005 56.8160 39.8127 174.6636 123 H 3.8394 8.8972 123.6455 59.0614 28.2960 174.9704 124 R 3.8916 8.5471 122.8110 56.7001 29.2491 176.0162 125 A 4.4313 8.2706 122.8328 49.9372 21.2458 175.9389 126 I 3.1816 7.8753 110.5358 61.6966 36.9087 173.1482 127 K 4.5416 8.5120 129.2442 56.3224 32.8350 175.9154 128 I 4.4377 8.6887 121.4135 60.2730 39.2733 175.1511 129 T 4.3407 8.5903 119.8654 61.6321 68.4216 175.7894 130 V 3.5885 8.6859 128.2718 65.9671 31.4061 176.0139 131 D 4.5369 8.9174 116.8548 53.9270 42.1893 177.7764 132 G 4.3002 7.7118 105.5321 42.3850 0.0000 171.4010 133 P 4.3742 0.0000 0.0000 65.0883 31.5516 177.1066 134 R 4.4226 7.1558 110.2602 55.4917 31.2101 173.9732 135 E 4.1840 8.6487 118.7093 56.8272 30.6036 175.3044 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 21 E 8.44 4.31 0.00 2.11 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 2.19 2.33 0.00 22 L 7.78 4.33 0.00 1.66 1.67 0.94 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 23 V 8.12 4.07 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 1.00 0.00 0.00 0.75 0.00 0.00 24 R 7.80 4.63 0.00 2.16 2.00 0.00 3.10 0.00 0.00 3.24 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.74 0.00 25 T 7.75 4.75 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 1.56 0.00 0.00 26 D 9.42 4.65 0.00 2.90 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 27 S 7.64 4.71 0.00 3.46 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 28 P 0.00 4.51 0.00 2.13 2.15 0.00 3.67 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 1.92 1.95 0.00 29 N 7.76 4.36 0.00 1.84 2.40 0.00 0.00 6.77 8.03 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 30 F 7.73 5.48 0.00 2.89 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 31 L 9.34 5.09 0.00 1.66 1.56 0.96 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 32 C 8.57 5.30 0.00 2.85 2.81 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 33 S 9.44 4.88 0.00 3.84 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 34 V 8.37 5.27 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 1.06 0.00 0.00 35 L 8.60 4.72 0.00 1.67 1.62 0.96 0.99 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 36 P 0.00 4.29 0.00 2.19 2.09 0.00 3.73 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 2.12 2.18 0.00 37 T 7.48 3.37 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 -0.46 0.00 0.00 38 H 8.10 4.59 0.00 3.49 3.59 0.00 5.74 0.00 0.00 0.00 0.00 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 W 7.02 5.41 0.00 3.48 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 40 R 8.62 3.99 0.00 2.03 2.08 0.00 3.36 0.00 0.00 3.20 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.80 0.00 41 C 8.76 4.37 0.00 3.11 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 42 N 8.48 4.05 0.00 2.63 2.96 0.00 0.00 5.88 5.48 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 43 K 7.42 3.96 0.00 2.24 1.93 0.00 1.90 0.00 0.00 1.82 0.00 0.00 3.13 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.41 1.42 7.81 44 T 8.11 4.40 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 1.31 0.00 0.00 45 L 7.94 4.24 0.00 1.81 1.69 1.32 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 46 P 0.00 4.45 0.00 2.15 2.15 0.00 3.78 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.94 0.00 47 I 7.31 3.48 1.83 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.15 0.92 0.00 0.00 48 A 7.46 3.20 1.22 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 49 F 8.73 5.57 0.00 3.51 3.14 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 0.00 0.00 0.00 50 K 9.22 4.77 0.00 1.78 1.60 0.00 1.61 0.00 0.00 1.74 0.00 0.00 2.81 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.27 1.28 7.81 51 V 8.14 5.04 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 0.94 0.00 0.00 1.05 0.00 0.00 52 V 9.24 4.84 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 0.78 0.00 0.00 0.93 0.00 0.00 53 A 9.16 5.35 1.22 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 54 L 9.18 4.55 0.00 1.68 1.66 0.98 0.73 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 55 G 8.93 4.08 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 0.00 0.00 0.00 56 D 8.70 4.73 0.00 2.65 2.70 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 57 V 7.75 3.80 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 0.89 0.00 0.00 1.04 0.00 0.00 58 P 0.00 4.37 0.00 2.21 2.20 0.00 3.79 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.98 0.00 59 D 7.29 5.06 0.00 2.93 2.81 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 60 G 9.90 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 0.00 0.00 0.00 61 T 6.38 4.05 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 1.06 0.00 0.00 62 L 7.82 5.02 0.00 1.74 1.74 0.91 1.02 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 63 V 8.87 4.37 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 0.76 0.00 0.00 0.93 0.00 0.00 64 T 8.79 4.84 4.19 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 1.22 0.00 0.00 65 V 8.29 4.57 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 0.38 0.00 0.00 0.53 0.00 0.00 66 M 8.79 4.88 0.00 2.02 2.12 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.47 0.00 67 A 8.51 5.35 1.30 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 0.00 0.00 0.00 68 G 8.24 4.17 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 0.00 69 N 8.26 4.93 0.00 2.54 2.62 0.00 0.00 6.80 8.44 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 70 D 8.24 4.54 0.00 2.81 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 71 E 7.12 4.59 0.00 1.87 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 2.26 2.25 0.00 72 N 8.22 4.27 0.00 2.61 2.59 0.00 0.00 7.28 7.55 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 73 Y 7.55 3.78 0.00 3.15 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 74 S 7.60 3.98 0.00 3.79 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 75 A 7.38 3.53 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 76 E 7.67 3.72 0.00 2.26 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 2.31 2.41 0.00 77 L 7.91 5.21 0.00 1.92 1.48 0.92 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 78 R 8.36 4.28 0.00 1.76 1.84 0.00 3.23 0.00 0.00 3.10 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.50 0.00 79 N 8.44 4.19 0.00 2.86 3.01 0.00 0.00 6.78 7.58 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 80 A 7.46 3.86 0.69 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 81 T 7.53 4.69 4.14 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 0.00 0.00 1.16 0.00 0.00 82 A 8.82 4.55 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 A 8.63 4.81 0.90 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 84 M 8.91 4.56 0.00 1.86 1.94 0.00 0.00 0.00 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.45 0.00 85 K 8.44 4.48 0.00 1.98 1.81 0.00 1.28 0.00 0.00 1.61 0.00 0.00 2.89 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.25 1.33 7.81 86 N 7.79 4.78 0.00 2.83 2.85 0.00 0.00 6.88 7.73 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 87 Q 8.43 3.98 0.00 2.29 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.54 7.12 0.00 0.00 0.00 0.00 0.00 2.42 2.46 0.00 88 V 7.25 5.08 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 0.91 0.00 0.00 0.94 0.00 0.00 89 A 8.66 4.79 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 R 7.60 4.50 0.00 1.64 1.72 0.00 3.02 0.00 0.00 3.20 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.51 0.00 91 F 8.15 4.93 0.00 3.24 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 92 N 9.32 4.95 0.00 2.70 2.84 0.00 0.00 7.04 8.25 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 93 D 8.36 4.52 0.00 2.62 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 94 L 7.82 4.03 0.00 0.37 0.56 -0.33 0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 95 R 8.10 4.61 0.00 1.88 1.74 0.00 3.13 0.00 0.00 3.23 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.66 0.00 96 F 9.14 4.68 0.00 2.53 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 97 V 8.50 3.67 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 0.82 0.00 0.00 0.77 0.00 0.00 98 G 8.23 3.51 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 0.00 0.00 0.00 99 R 6.78 4.01 0.00 1.82 1.93 0.00 3.35 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 1.64 1.57 0.00 100 S 8.81 4.17 0.00 4.07 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 0.00 101 G 8.07 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 0.00 0.00 0.00 0.00 102 R 8.55 4.49 0.00 1.97 2.00 0.00 3.13 0.00 0.00 3.35 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.61 0.00 103 G 8.89 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 0.00 0.00 0.00 104 K 7.42 4.85 0.00 1.75 1.72 0.00 1.62 0.00 0.00 1.79 0.00 0.00 3.14 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.37 1.50 7.81 105 S 8.98 5.12 0.00 3.67 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 0.00 106 F 9.13 4.66 0.00 3.12 3.02 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 0.00 107 T 8.49 4.34 4.37 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 1.21 0.00 0.00 108 L 7.05 4.28 0.00 1.36 1.38 1.22 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 109 T 8.83 5.10 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 1.25 0.00 0.00 110 I 8.72 4.42 1.87 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.47 0.72 0.00 0.00 111 T 8.73 4.62 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 1.27 0.00 0.00 112 V 8.23 4.13 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 1.21 0.00 0.00 0.77 0.00 0.00 113 F 8.63 4.71 0.00 2.91 3.16 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 0.00 114 T 7.48 4.63 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 0.00 115 N 8.93 4.22 0.00 2.72 2.88 0.00 0.00 6.83 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 0.00 116 P 0.00 4.44 0.00 2.17 2.09 0.00 3.68 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 1.95 1.94 0.00 117 P 0.00 4.20 0.00 2.07 2.11 0.00 3.73 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.94 0.00 118 Q 8.70 4.35 0.00 2.12 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.78 7.59 0.00 0.00 0.00 0.00 0.00 2.40 2.37 0.00 119 V 8.31 4.83 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 0.81 0.00 0.00 0.93 0.00 0.00 120 A 9.09 4.91 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 0.00 121 T 8.49 4.99 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 1.19 0.00 0.00 122 Y 8.37 4.71 0.00 2.90 2.75 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 0.00 123 H 8.90 3.84 0.00 3.20 3.22 0.00 5.73 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 R 8.55 3.89 0.00 1.46 2.14 0.00 3.09 0.00 0.00 3.21 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.42 0.00 125 A 8.27 4.43 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 0.00 126 I 7.88 3.18 1.95 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 1.33 1.09 1.08 0.00 0.00 127 K 8.51 4.54 0.00 1.82 1.71 0.00 1.82 0.00 0.00 1.76 0.00 0.00 3.05 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.54 1.41 7.81 128 I 8.69 4.44 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 1.11 0.77 0.96 0.00 0.00 129 T 8.59 4.34 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 1.46 0.00 0.00 130 V 8.69 3.59 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 0.84 0.00 0.00 1.02 0.00 0.00 131 D 8.92 4.54 0.00 2.69 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 G 7.71 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 0.00 0.00 0.00 0.00 133 P 0.00 4.37 0.00 2.18 2.18 0.00 3.79 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.93 0.00 134 R 7.16 4.42 0.00 1.86 1.87 0.00 3.13 0.00 0.00 3.21 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.43 0.00 135 E 8.65 4.18 0.00 1.88 1.76 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 2.14 2.23 0.00