NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 S 4.4530 8.3193 115.4126 58.3110 64.2502 172.6744 2 K 4.0625 8.3870 117.7319 57.6537 33.4357 175.8875 3 Q 4.1483 8.7851 122.4507 54.8916 30.5640 175.8363 4 P 4.2551 0.0000 0.0000 66.0368 31.4648 178.3893 5 D 4.3487 8.0307 116.8194 57.4433 40.8237 178.9238 6 K 4.0700 7.9854 118.4195 59.1914 31.9333 179.4593 7 Q 3.9346 8.1245 118.5162 59.2034 28.7057 178.9643 8 R 3.9514 8.1494 119.1012 58.9354 29.9494 178.8975 9 K 3.9011 8.1229 119.8531 59.6262 32.1952 178.8541 10 S 4.1028 8.1347 114.4351 61.7134 62.4008 176.6479 11 Q 3.9365 7.6556 120.7436 58.8249 28.6397 178.1733 12 R 4.0868 8.1167 118.4443 58.2545 30.1669 177.0907 13 R 4.4416 7.7324 115.1241 55.3752 30.7030 176.0716 14 A 4.0669 7.2728 121.5857 51.5114 18.9853 176.4793 15 P 4.4626 0.0000 0.0000 62.1573 32.4629 177.3435 16 L 3.9122 8.8124 121.2014 58.7073 41.3146 179.8924 17 H 4.3184 8.2997 112.2862 58.1366 28.4736 176.1257 18 E 4.2306 7.7428 119.2436 56.7206 29.8416 177.3834 19 R 4.2946 8.0237 118.9780 57.0248 30.6021 177.8987 20 H 4.1288 8.0305 116.8158 58.7143 28.8396 177.0466 21 K 4.2280 7.9809 115.4666 58.3213 32.5675 177.1866 22 Q 4.4195 8.0885 118.4186 56.6314 29.3528 175.9932 23 V 4.6165 7.5925 112.4004 60.0145 32.8360 175.3382 24 R 4.9752 8.2575 118.1686 55.1579 31.7144 176.0319 25 A 4.8382 8.6741 123.1564 50.0350 23.2021 175.5297 26 T 4.3869 8.4258 113.6708 62.2810 68.8037 173.5927 27 L 4.9625 8.8133 126.9845 53.2589 43.7710 176.6045 28 S 4.4247 8.2484 114.1847 57.9265 64.3170 175.1024 29 A 3.9873 8.8683 122.5071 56.1898 17.8589 179.2037 30 D 4.2928 8.1972 116.5475 57.4052 40.8823 178.4875 31 L 4.1020 8.0324 118.5457 58.3572 41.7717 180.2720 32 R 4.4233 8.2705 119.1857 58.9109 29.8606 178.7048 33 E 3.9031 7.9685 117.7027 59.1382 29.6339 178.2191 34 E 3.8684 8.2265 118.8861 58.7617 29.8657 177.4874 35 Y 4.6372 7.8762 113.1469 56.5658 39.1673 175.6430 36 G 3.9118 8.6458 108.0285 46.6737 0.0000 173.7362 37 Q 4.6175 7.7386 115.9440 53.8231 33.2189 176.4222 38 R 4.0710 8.5954 120.7388 58.2246 30.6837 175.1516 39 N 5.4528 7.5476 112.6953 51.9435 40.9925 173.6923 40 V 5.0989 8.2732 115.1814 61.5120 35.0845 172.9893 41 R 4.3803 8.4540 123.2606 56.1910 30.2925 176.2015 42 V 3.7662 8.1170 127.4011 63.8087 32.0874 175.3084 43 N 4.9085 10.1818 125.7732 51.3452 40.6754 175.5985 44 A 4.2192 8.5881 121.1228 53.4982 18.2645 178.2647 45 G 4.3274 7.5729 102.9200 46.2275 0.0000 174.1420 46 D 4.9643 8.0656 120.3559 54.8047 42.4809 175.3090 47 T 5.2420 8.9584 116.5416 62.0604 71.7564 174.0740 48 V 5.1000 9.0245 123.9278 60.2722 35.9676 173.2960 49 E 5.0587 9.2156 119.2972 54.2740 32.4451 175.2749 50 V 4.1177 8.8633 125.0257 63.1274 32.1426 176.0475 51 L 4.4484 9.2007 127.3221 55.0676 42.6420 177.5277 52 R 4.4558 8.0969 114.8630 57.4462 33.6459 177.2330 53 G 4.1081 7.8465 106.2348 45.5013 0.0000 173.4512 54 D 4.3616 8.7613 118.8509 56.1851 41.4289 176.8840 55 F 4.5944 8.0895 117.0393 56.7971 39.1968 175.0869 56 A 4.3681 7.3506 124.8485 53.9201 18.5341 177.0990 57 G 4.2488 9.4104 112.2844 45.9469 0.0000 174.5936 58 E 4.3088 8.2685 118.4657 56.3269 30.6639 176.2895 59 E 5.1211 8.2575 120.6508 54.8835 33.3706 175.1214 60 G 3.9746 8.5691 108.2618 45.9455 0.0000 171.6053 61 E 4.8792 8.1207 121.0718 54.7598 31.2197 175.4103 62 V 4.0759 8.3642 127.6739 63.6852 31.3597 175.5919 63 I 4.3058 9.1130 129.6323 62.3849 38.5728 175.4549 64 N 4.7902 7.6873 118.4914 52.4368 42.3830 173.5565 65 V 4.6635 8.2012 123.6492 61.3548 34.4434 173.9424 66 D 4.6777 9.0347 129.7503 52.8527 41.5493 177.3002 67 L 4.0282 8.5948 126.9460 57.6866 42.3123 179.0408 68 D 4.2641 8.2543 117.1757 57.3146 41.1811 177.0284 69 K 4.1117 9.2020 115.2938 55.7658 32.8326 176.5190 70 A 3.8068 7.3090 121.1948 52.9927 16.4722 175.8339 71 V 4.8646 7.9673 120.8463 61.1047 36.5471 174.7195 72 I 5.1746 8.5711 116.1967 59.4658 41.4247 173.6076 73 H 5.1830 9.3097 120.9373 54.2095 31.1733 173.8423 74 V 4.7319 8.0100 122.4301 60.4426 34.4999 174.4262 75 E 4.0698 8.8390 128.7204 57.9595 29.7729 177.1200 76 D 4.6783 8.8259 124.3297 54.6005 39.4311 175.1260 77 V 3.5109 7.1484 119.7829 61.4854 29.7520 174.1791 78 T 5.0053 7.7022 114.4200 59.3840 72.7603 172.8221 79 L 4.9442 9.7969 120.7205 52.8851 45.6115 175.6848 80 E 4.8795 8.6770 123.2305 54.7375 30.4719 176.1296 81 K 4.3735 8.9041 127.7004 56.0387 33.4298 177.5054 82 T 4.0196 8.4610 115.9682 67.1011 68.3397 176.2538 83 D 4.7253 8.0343 117.6045 53.4968 39.1485 177.2726 84 G 4.0253 7.9487 109.7912 46.0200 0.0000 174.3637 85 E 4.1026 8.4920 121.0628 56.4787 31.0822 175.2982 86 E 5.1182 8.6881 124.9511 54.7057 30.9038 175.2843 87 V 4.7005 8.7850 120.7323 58.4386 35.4111 173.7643 88 P 4.1864 0.0000 0.0000 63.0614 32.2153 176.1274 89 R 4.3698 8.0681 122.6829 53.7689 30.6539 173.4496 90 P 4.3926 0.0000 0.0000 63.2756 32.1038 175.7629 91 L 4.8495 8.6434 122.8689 52.8185 45.6177 175.3055 92 D 4.9115 8.5490 121.9339 53.3439 42.4464 177.4286 93 T 3.8775 8.5807 116.3222 64.6747 68.7463 175.8468 94 S 4.2966 8.7159 116.0895 60.2862 62.6697 173.9191 95 N 5.0662 8.3919 117.1521 53.1514 39.5646 174.2267 96 V 4.9410 7.9053 117.6935 61.2146 35.4702 174.6886 97 R 4.7903 8.6528 124.3454 54.3923 33.0741 174.2560 98 V 4.3194 8.6865 127.4554 63.0850 32.3992 176.0223 99 T 4.6708 8.3832 117.4138 60.7846 69.8757 173.5242 100 D 4.4316 7.4726 118.4069 54.1222 44.4297 174.8228 101 L 4.8527 8.8202 126.0372 53.7946 43.7928 176.3115 102 D 4.5853 8.9259 123.1307 52.6488 40.0454 175.8436 103 L 4.8241 8.0118 126.6956 54.5091 42.2981 179.2003 104 E 4.1739 8.1938 121.5663 59.1354 29.9100 177.8675 105 D 4.6032 7.5398 118.0732 53.0918 42.4643 176.4172 106 E 3.9630 8.8193 126.9156 59.7414 29.6428 179.4157 107 K 3.9665 8.2349 117.7523 59.5164 32.0968 179.0425 108 R 3.7975 8.1105 118.7405 59.2911 30.0978 177.8366 109 E 3.8095 8.0386 118.3005 59.4495 29.5949 178.6885 110 A 4.0086 8.4600 120.8096 55.3721 18.1904 179.6423 111 R 3.8235 7.7884 115.8618 59.3363 30.2272 178.1285 112 L 4.0168 8.1112 119.5001 58.3084 42.1730 178.5560 113 E 4.3973 8.6201 117.6468 57.8169 29.7070 177.3896 114 S 4.3880 7.5113 113.2256 58.4269 63.4713 173.7372 115 E 4.5694 8.5894 116.5277 56.3192 30.4112 176.1074 116 D 4.8055 8.0343 117.9798 54.2304 41.6867 175.2510 117 D 4.8527 7.6812 116.7631 52.3479 44.5512 174.2961 118 S 5.5891 8.7307 116.3659 55.5125 66.1082 173.9091 119 A 4.2348 8.4519 123.1240 52.4741 19.0876 176.0645 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 S 8.32 4.45 0.00 3.99 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 2 K 8.39 4.06 0.00 1.96 1.97 0.00 1.57 0.00 0.00 1.71 0.00 0.00 2.94 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.35 1.52 7.81 3 Q 8.79 4.15 0.00 2.14 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.76 0.00 0.00 0.00 0.00 0.00 2.38 2.39 0.00 4 P 0.00 4.26 0.00 2.15 2.12 0.00 3.60 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 2.12 2.20 0.00 5 D 8.03 4.35 0.00 2.76 2.71 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 0.00 0.00 0.00 6 K 7.99 4.07 0.00 1.94 1.85 0.00 1.67 0.00 0.00 1.82 0.00 0.00 2.94 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.53 1.53 7.81 7 Q 8.12 3.93 0.00 2.26 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.80 0.00 0.00 0.00 0.00 0.00 2.49 2.54 0.00 8 R 8.15 3.95 0.00 1.85 1.98 0.00 3.13 0.00 0.00 3.09 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.95 0.00 9 K 8.12 3.90 0.00 1.97 1.98 0.00 1.65 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.43 1.45 7.81 10 S 8.13 4.10 0.00 4.10 4.12 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 11 Q 7.66 3.94 0.00 2.15 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.05 7.05 0.00 0.00 0.00 0.00 0.00 2.39 2.47 0.00 12 R 8.12 4.09 0.00 2.03 1.95 0.00 3.22 0.00 0.00 3.22 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.66 0.00 13 R 7.73 4.44 0.00 1.81 1.91 0.00 3.22 0.00 0.00 3.22 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.69 0.00 14 A 7.27 4.07 1.31 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 0.00 0.00 0.00 15 P 0.00 4.46 0.00 2.24 2.03 0.00 3.60 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.12 0.00 16 L 8.81 3.91 0.00 1.69 1.73 0.91 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 17 H 8.30 4.32 0.00 3.37 3.45 0.00 5.52 0.00 0.00 0.00 0.00 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 E 7.74 4.23 0.00 1.98 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 2.18 1.91 0.00 19 R 8.02 4.29 0.00 1.85 2.01 0.00 3.10 0.00 0.00 3.37 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.81 0.00 20 H 8.03 4.13 0.00 3.18 3.33 0.00 5.62 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 K 7.98 4.23 0.00 1.86 1.93 0.00 1.55 0.00 0.00 1.70 0.00 0.00 3.13 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.57 1.45 7.81 22 Q 8.09 4.42 0.00 2.22 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.07 7.45 0.00 0.00 0.00 0.00 0.00 2.33 2.30 0.00 23 V 7.59 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 0.99 0.00 0.00 1.04 0.00 0.00 24 R 8.26 4.98 0.00 1.69 1.84 0.00 3.15 0.00 0.00 3.23 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.75 0.00 25 A 8.67 4.84 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 26 T 8.43 4.39 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 1.22 0.00 0.00 27 L 8.81 4.96 0.00 1.54 1.61 1.01 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 28 S 8.25 4.42 0.00 3.96 4.01 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 0.00 0.00 0.00 29 A 8.87 3.99 1.35 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 0.00 0.00 0.00 30 D 8.20 4.29 0.00 2.72 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 31 L 8.03 4.10 0.00 1.77 1.88 0.96 1.07 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 32 R 8.27 4.42 0.00 2.04 2.00 0.00 3.16 0.00 0.00 3.21 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.78 0.00 33 E 7.97 3.90 0.00 2.03 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 2.31 2.33 0.00 34 E 8.23 3.87 0.00 1.83 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 1.47 1.98 0.00 35 Y 7.88 4.64 0.00 2.97 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 36 G 8.65 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 0.00 0.00 0.00 37 Q 7.74 4.62 0.00 2.10 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.80 0.00 0.00 0.00 0.00 0.00 2.36 2.37 0.00 38 R 8.60 4.07 0.00 1.85 1.91 0.00 3.12 0.00 0.00 3.39 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.62 0.00 39 N 7.55 5.45 0.00 2.70 2.75 0.00 0.00 5.83 7.68 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 40 V 8.27 5.10 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 0.71 0.00 0.00 0.85 0.00 0.00 41 R 8.45 4.38 0.00 1.83 1.89 0.00 3.26 0.00 0.00 3.12 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.78 0.00 42 V 8.12 3.77 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 0.78 0.00 0.00 0.96 0.00 0.00 43 N 10.18 4.91 0.00 2.99 2.67 0.00 0.00 6.48 8.01 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 44 A 8.59 4.22 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 45 G 7.57 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 0.00 0.00 0.00 0.00 46 D 8.07 4.96 0.00 2.64 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 47 T 8.96 5.24 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 48 V 9.02 5.10 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 0.96 0.00 0.00 49 E 9.22 5.06 0.00 1.98 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 0.00 2.31 2.22 0.00 50 V 8.86 4.12 2.32 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 1.05 0.00 0.00 0.95 0.00 0.00 51 L 9.20 4.45 0.00 1.51 1.68 0.93 0.94 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 52 R 8.10 4.46 0.00 1.76 1.92 0.00 3.39 0.00 0.00 3.24 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.54 0.00 53 G 7.85 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 0.00 0.00 0.00 54 D 8.76 4.36 0.00 2.36 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 0.00 0.00 0.00 0.00 55 F 8.09 4.59 0.00 3.14 3.05 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 56 A 7.35 4.37 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 57 G 9.41 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 0.00 0.00 0.00 0.00 58 E 8.27 4.31 0.00 2.20 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 2.40 2.40 0.00 59 E 8.26 5.12 0.00 1.81 1.82 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 2.20 2.28 0.00 60 G 8.57 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 61 E 8.12 4.88 0.00 2.06 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 2.33 2.44 0.00 62 V 8.36 4.08 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 0.82 0.00 0.00 0.92 0.00 0.00 63 I 9.11 4.31 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 1.26 0.98 0.91 0.00 0.00 64 N 7.69 4.79 0.00 2.71 2.39 0.00 0.00 6.60 7.71 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 65 V 8.20 4.66 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 0.83 0.00 0.00 0.92 0.00 0.00 66 D 9.03 4.68 0.00 2.70 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 67 L 8.59 4.03 0.00 1.71 1.63 0.79 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 68 D 8.25 4.26 0.00 2.62 2.83 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 69 K 9.20 4.11 0.00 1.83 1.83 0.00 1.91 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.44 1.37 7.81 70 A 7.31 3.81 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 71 V 7.97 4.86 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 1.11 0.00 0.00 0.97 0.00 0.00 72 I 8.57 5.17 1.94 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 1.43 0.66 0.91 0.00 0.00 73 H 9.31 5.18 0.00 3.13 3.21 0.00 5.76 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 74 V 8.01 4.73 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 0.93 0.00 0.00 0.89 0.00 0.00 75 E 8.84 4.07 0.00 2.07 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 2.32 2.28 0.00 76 D 8.83 4.68 0.00 2.89 2.88 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 77 V 7.15 3.51 1.85 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 -0.37 0.00 0.00 0.72 0.00 0.00 78 T 7.70 5.01 4.34 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 1.12 0.00 0.00 79 L 9.80 4.94 0.00 1.61 1.59 0.96 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 80 E 8.68 4.88 0.00 1.99 1.88 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 2.24 2.34 0.00 81 K 8.90 4.37 0.00 1.88 1.77 0.00 1.76 0.00 0.00 1.80 0.00 0.00 3.02 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.48 1.41 7.81 82 T 8.46 4.02 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 83 D 8.03 4.73 0.00 2.77 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 84 G 7.95 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 85 E 8.49 4.10 0.00 2.12 1.89 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 2.31 2.27 0.00 86 E 8.69 5.12 0.00 1.99 1.82 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 2.19 2.32 0.00 87 V 8.79 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 0.78 0.00 0.00 0.96 0.00 0.00 88 P 0.00 4.19 0.00 1.62 1.91 0.00 3.70 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.95 0.00 89 R 8.07 4.37 0.00 1.82 1.74 0.00 3.35 0.00 0.00 3.31 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.53 0.00 90 P 0.00 4.39 0.00 1.96 2.02 0.00 3.64 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 2.03 2.11 0.00 91 L 8.64 4.85 0.00 1.54 1.50 0.82 0.76 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 92 D 8.55 4.91 0.00 2.68 2.53 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 93 T 8.58 3.88 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 1.25 0.00 0.00 94 S 8.72 4.30 0.00 3.82 4.21 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 95 N 8.39 5.07 0.00 2.69 2.78 0.00 0.00 6.21 7.27 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 96 V 7.91 4.94 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 0.74 0.00 0.00 0.93 0.00 0.00 97 R 8.65 4.79 0.00 1.90 1.71 0.00 3.45 0.00 0.00 3.11 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.62 0.00 98 V 8.69 4.32 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 0.92 0.00 0.00 99 T 8.38 4.67 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 1.28 0.00 0.00 100 D 7.47 4.43 0.00 2.71 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 0.00 101 L 8.82 4.85 0.00 1.52 1.48 0.66 0.98 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 0.00 102 D 8.93 4.59 0.00 2.80 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 0.00 103 L 8.01 4.82 0.00 1.75 1.64 1.03 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 104 E 8.19 4.17 0.00 1.98 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 2.35 2.46 0.00 105 D 7.54 4.60 0.00 2.80 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 0.00 106 E 8.82 3.96 0.00 2.04 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 2.40 2.41 0.00 107 K 8.23 3.97 0.00 2.10 1.85 0.00 1.66 0.00 0.00 1.73 0.00 0.00 2.90 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.52 1.50 7.81 108 R 8.11 3.80 0.00 2.00 1.97 0.00 3.07 0.00 0.00 3.03 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.58 0.00 109 E 8.04 3.81 0.00 2.10 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 0.00 2.36 2.42 0.00 110 A 8.46 4.01 1.39 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 0.00 0.00 0.00 0.00 0.00 0.00 111 R 7.79 3.82 0.00 2.09 1.97 0.00 3.24 0.00 0.00 3.13 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.62 0.00 112 L 8.11 4.02 0.00 1.72 1.50 0.23 0.56 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 0.00 113 E 8.62 4.40 0.00 2.12 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 0.00 2.53 2.67 0.00 114 S 7.51 4.39 0.00 4.01 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 0.00 115 E 8.59 4.57 0.00 2.08 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 2.17 2.29 0.00 116 D 8.03 4.81 0.00 2.68 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 0.00 117 D 7.68 4.85 0.00 2.62 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 0.00 118 S 8.73 5.59 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 0.00 119 A 8.45 4.23 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