NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 P 4.6211 0.0000 0.0000 62.5643 33.6996 174.3694 2 I 4.7458 8.1299 121.8718 59.6225 38.6841 170.6672 3 V 4.6869 8.6076 118.9200 59.5484 36.8551 174.4871 4 Q 4.4366 8.6799 120.6952 56.3683 29.9696 175.5052 5 N 5.1952 8.2985 118.1064 51.6742 39.4786 175.1749 6 L 4.1034 8.5185 116.0003 57.5336 42.0202 177.5688 7 Q 4.3785 8.2906 115.5012 55.3594 28.8693 176.4962 8 G 3.9473 7.9606 106.6199 45.0403 0.0000 173.6226 9 Q 4.4030 8.2160 119.3120 54.9088 30.5152 174.9625 10 M 4.5765 8.7977 122.9596 56.2713 32.4849 175.9843 11 V 4.5982 9.5414 117.7732 59.3218 36.2041 174.7692 12 H 4.8664 8.7431 122.5712 56.3571 30.5184 174.2633 13 Q 4.5438 8.5731 125.4949 53.9818 32.1362 174.6370 14 A 4.1758 8.5276 127.9047 51.6885 19.2485 177.2916 15 I 3.8138 7.9619 120.3106 60.6049 38.9140 176.3421 16 S 4.3138 8.4322 120.8948 57.4291 63.8117 173.6037 17 P 4.2921 0.0000 0.0000 65.8713 31.0848 179.0279 18 R 3.9282 7.8213 118.0218 59.4506 29.9462 179.1094 19 T 3.9145 7.8098 115.0545 66.5409 68.5201 176.5054 20 L 4.1199 8.2564 121.3080 58.2764 41.6799 179.5342 21 N 4.3809 8.7037 116.2985 56.0516 38.3969 177.4267 22 A 4.0256 8.2015 122.5539 54.8305 18.4603 179.4943 23 W 4.2894 8.3633 127.0304 60.5616 30.7362 178.2287 24 V 3.2931 8.0733 118.4292 66.0871 30.9152 178.2486 25 K 3.8978 7.9813 118.0505 58.9804 31.7946 179.4095 26 V 3.4035 7.7437 118.7771 66.1329 31.4188 178.3208 27 V 3.0599 6.9125 117.6352 65.7790 30.9881 177.7360 28 E 3.8495 7.9582 117.7229 59.1328 29.3017 178.4908 29 E 4.1585 7.8152 118.1919 57.8591 30.3043 177.5959 30 K 4.3051 8.0133 115.4256 55.0372 33.2643 177.0289 31 A 3.1342 8.0407 123.2088 53.6857 18.2595 178.7564 32 F 4.3555 6.9749 109.5819 58.5462 39.6077 175.7157 33 S 4.7424 7.5928 114.8499 57.1333 64.2146 173.0731 34 P 4.2497 0.0000 0.0000 66.2442 31.0898 178.6293 35 E 4.1474 8.2294 116.3294 58.7618 29.2920 179.2748 36 V 3.9513 8.0614 119.3958 64.0864 31.4919 178.6508 37 I 3.8388 7.8020 121.3252 63.9801 37.1166 176.4913 38 P 4.3731 0.0000 0.0000 65.9579 30.8804 178.3994 39 M 4.0741 7.8354 117.5322 58.2176 31.7446 177.9769 40 F 3.4934 8.3265 119.7282 61.5265 39.6003 176.8337 41 S 4.0607 8.1909 112.1339 61.3022 61.9294 175.8535 42 A 4.0377 7.7153 122.3290 54.3661 18.4589 178.7054 43 L 4.2392 7.8769 115.6439 55.3592 42.0814 177.3641 44 S 4.4498 7.2278 114.4411 57.4556 63.4163 173.5932 45 E 4.0073 8.1454 120.8871 58.5311 29.6486 177.4722 46 G 3.8133 8.3819 110.4794 45.5131 0.0000 173.1700 47 A 4.4282 7.6178 123.6059 52.1919 19.0143 178.0419 48 T 4.2951 8.6967 112.6394 60.3342 71.4530 174.3439 49 P 4.4821 0.0000 0.0000 66.0675 31.2562 178.5784 50 Q 4.0049 8.3797 118.1496 59.3749 28.9312 178.2392 51 D 4.3569 8.2347 119.7297 57.3327 40.8863 178.6324 52 L 3.9513 8.2193 119.7264 58.1088 41.6691 179.4728 53 N 4.4937 8.5698 116.3455 56.5699 38.2266 177.4953 54 T 3.9623 7.9642 116.4489 67.0342 68.6757 176.1380 55 M 4.3690 8.2583 120.4487 58.5683 31.9057 178.9079 56 L 4.3277 8.2246 119.0448 57.7394 41.5881 179.1550 57 N 4.5823 8.6903 116.2620 55.8263 38.5445 176.8142 58 T 4.2565 7.5677 109.9377 62.2011 69.4053 175.0772 59 V 3.6963 7.4013 122.9255 62.7034 32.0413 175.2126 60 G 4.0370 8.6083 116.2388 45.0192 0.0000 175.2697 61 G 3.7477 8.5350 110.2569 44.2773 0.0000 172.3831 62 H 4.2359 8.6488 110.1824 56.7636 26.5395 176.7896 63 Q 4.0079 8.1189 118.7545 58.9622 28.7300 178.2103 64 A 4.0791 7.9877 121.2688 54.9421 18.5852 179.3596 65 A 3.8986 7.9891 118.8339 55.6649 18.4736 179.6184 66 M 4.0178 8.3009 117.4103 58.4633 31.8868 179.1231 67 Q 3.9583 8.1226 118.2917 59.1473 28.8933 178.3141 68 M 3.9632 8.1582 119.3045 58.4492 32.2493 177.8923 69 L 3.8407 8.2248 120.7964 58.0934 42.2288 178.7849 70 K 3.9187 8.2653 119.7741 59.4276 32.0969 177.9231 71 E 3.8910 8.3261 119.6825 59.9230 29.4731 178.9866 72 T 4.0006 8.0253 115.4238 66.7433 68.4035 176.5900 73 I 3.7963 7.8434 121.5400 64.6293 37.2126 178.3029 74 N 4.3051 8.3800 117.3735 56.2275 38.3114 177.3121 75 E 3.8946 8.2354 120.0578 59.4950 29.4526 179.3167 76 E 3.5050 8.0596 118.3393 58.9655 29.2894 179.2297 77 A 3.3803 7.5902 120.9094 54.8903 18.4098 179.6005 78 A 3.9667 7.9510 119.2786 55.0921 18.5332 179.7975 79 E 3.8421 8.1815 117.2572 59.1925 29.3338 178.9859 80 W 4.3029 8.0500 127.3901 61.0166 31.0495 177.4142 81 D 4.5912 8.3501 118.4902 57.3747 39.9992 178.7371 82 R 3.9016 8.0128 118.4907 58.6529 30.1670 177.5759 83 L 4.5474 7.2851 115.2742 54.0035 43.0913 176.6961 84 H 4.5783 7.3057 115.8550 52.1120 29.3740 170.8466 85 P 4.2903 0.0000 0.0000 62.3786 31.7888 177.1959 86 V 3.6987 8.3082 120.5303 62.7723 32.0981 175.0188 87 A 4.7986 8.2460 129.4762 50.2731 21.1650 176.0724 88 M 4.2177 8.4538 120.8866 55.5373 33.1607 177.3860 89 A 4.6907 8.1811 125.2888 49.7861 19.3623 174.3996 90 P 4.0619 0.0000 0.0000 62.3698 32.3728 176.6483 91 I 3.8307 8.3117 123.2339 60.4719 38.5351 175.3753 92 A 4.3169 8.4022 130.6254 50.7764 19.2777 174.6048 93 P 4.4791 0.0000 0.0000 64.0777 31.7397 177.5071 94 G 3.9142 9.0324 111.0082 45.3626 0.0000 172.7507 95 Q 4.6281 7.6127 117.9164 54.4400 31.1514 174.3643 96 M 4.7992 8.0065 117.5357 53.0105 35.1926 176.3161 97 R 4.1747 8.4568 117.9077 56.2169 30.1683 176.2826 98 E 4.2490 8.6799 120.0496 55.5919 30.1391 175.2918 99 P 4.3293 0.0000 0.0000 62.5377 32.2343 176.2518 100 R 4.6169 8.8047 120.3836 54.7585 32.1250 177.7735 101 G 3.8107 9.7607 106.1361 48.4568 0.0000 176.1023 102 S 4.2535 8.0592 115.7639 60.7375 63.0923 176.0879 103 D 4.3776 7.9000 123.1711 57.1925 40.3832 178.6236 104 I 3.2501 7.2129 118.7544 63.9314 37.2057 177.5368 105 A 2.5800 7.4491 118.6739 51.9871 18.4143 178.3892 106 G 3.9346 7.5766 105.9700 45.1061 0.0000 175.1936 107 T 3.9894 7.8068 116.0665 66.2108 68.5329 175.1182 108 T 4.5875 7.8822 108.1189 60.9060 69.5333 173.7117 109 S 5.0498 7.7708 116.6320 56.6850 65.9087 173.7144 110 T 4.3926 8.6221 113.5169 60.6434 71.1358 175.7345 111 L 3.8912 8.2961 122.5811 58.6235 42.0237 179.0539 112 Q 3.9201 7.9222 117.2607 58.9571 28.5769 178.5208 113 E 3.4186 8.1022 119.5822 59.1473 29.3831 179.3259 114 Q 4.2856 7.9518 118.0041 59.2325 28.8067 179.0914 115 I 3.8424 8.1561 121.2724 64.3094 35.5290 178.7722 116 G 3.4829 7.9560 106.5937 47.5317 0.0000 175.8673 117 W 4.6049 8.2722 121.6918 59.9221 28.8510 178.5998 118 M 4.2423 8.3523 117.7999 57.2881 31.3554 177.3024 119 T 4.4907 7.7135 107.7849 61.4604 69.1106 173.8070 120 H 4.5311 7.5013 120.8962 55.9202 30.8613 174.3228 121 N 4.8206 7.7068 118.8066 50.5800 39.3574 173.0249 122 P 4.6229 0.0000 0.0000 61.0041 32.6634 174.4139 123 P 4.6509 0.0000 0.0000 62.5610 32.0815 175.9855 124 I 4.3440 8.3490 121.4693 59.2613 38.2209 175.7363 125 P 4.6014 0.0000 0.0000 62.1634 28.3156 176.9208 126 V 3.4298 7.6102 117.8890 64.4194 31.9871 178.2512 127 G 3.6532 7.8316 106.8232 47.3661 0.0000 175.5485 128 E 3.9074 7.9958 120.9429 58.8994 29.6197 179.4667 129 I 3.4324 7.6546 119.9333 64.3947 37.1068 177.8563 130 Y 3.5081 7.4625 120.3458 60.1832 38.4267 177.8015 131 K 3.7673 8.0807 120.7399 59.5984 32.2881 178.6730 132 R 3.9620 7.9874 118.2490 59.3715 30.0045 179.0557 133 W 4.4440 7.9796 118.0450 59.9232 29.0181 178.6902 134 I 3.6275 7.9589 119.8415 64.4260 36.5014 178.6050 135 I 3.7886 8.1290 120.9979 64.1738 36.8647 178.5072 136 L 4.1325 8.1824 120.1771 57.6488 41.3894 179.6914 137 G 3.5949 8.1776 105.6891 47.8742 0.0000 175.5571 138 L 3.8870 8.2374 122.0820 57.5278 41.3722 179.3185 139 N 4.3101 8.0084 115.3632 56.2566 38.6770 177.0535 140 K 4.1098 7.8801 120.6222 59.5502 32.3673 178.9565 141 I 3.8707 7.9985 113.4360 63.8084 37.6388 178.4568 142 V 4.3186 8.0451 115.6072 63.6642 31.0695 178.4433 143 R 4.0850 7.7048 117.0088 59.0460 29.9179 177.6360 144 M 4.1819 8.1725 116.9898 56.7756 32.2393 174.9065 145 Y 4.8839 7.9443 115.6028 56.0402 41.6050 175.7631 146 S 4.2529 8.4979 114.0872 59.0273 63.1473 173.8064 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 P 0.00 4.62 0.00 2.03 2.06 0.00 3.75 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 2.06 0.00 2 I 8.13 4.75 1.87 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 1.25 0.46 0.91 0.00 0.00 3 V 8.61 4.69 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 0.83 0.00 0.00 0.93 0.00 0.00 4 Q 8.68 4.44 0.00 2.05 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.71 0.00 0.00 0.00 0.00 0.00 2.31 2.35 0.00 5 N 8.30 5.20 0.00 2.95 2.99 0.00 0.00 7.33 6.14 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 6 L 8.52 4.10 0.00 1.63 1.76 0.91 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 7 Q 8.29 4.38 0.00 2.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.68 0.00 0.00 0.00 0.00 0.00 2.27 2.38 0.00 8 G 7.96 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 9 Q 8.22 4.40 0.00 2.13 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.98 6.89 0.00 0.00 0.00 0.00 0.00 2.53 2.32 0.00 10 M 8.80 4.58 0.00 1.92 2.09 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 2.61 2.53 0.00 11 V 9.54 4.60 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 0.73 0.00 0.00 0.98 0.00 0.00 12 H 8.74 4.87 0.00 3.16 3.20 0.00 5.67 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 13 Q 8.57 4.54 0.00 1.92 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.69 0.00 0.00 0.00 0.00 0.00 2.19 2.25 0.00 14 A 8.53 4.18 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 15 I 7.96 3.81 2.05 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 1.27 0.81 0.92 0.00 0.00 16 S 8.43 4.31 0.00 3.91 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 17 P 0.00 4.29 0.00 2.31 2.31 0.00 3.75 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.06 0.00 18 R 7.82 3.93 0.00 1.84 2.02 0.00 3.12 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.67 0.00 19 T 7.81 3.91 4.39 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 1.21 0.00 0.00 20 L 8.26 4.12 0.00 1.90 1.83 0.96 0.72 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 21 N 8.70 4.38 0.00 3.04 2.88 0.00 0.00 6.93 7.61 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 22 A 8.20 4.03 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 23 W 8.36 4.29 0.00 3.45 3.32 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 24 V 8.07 3.29 2.23 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 1.00 0.00 0.00 1.02 0.00 0.00 25 K 7.98 3.90 0.00 1.94 1.78 0.00 1.72 0.00 0.00 1.53 0.00 0.00 2.89 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.42 1.56 7.81 26 V 7.74 3.40 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 27 V 6.91 3.06 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 0.38 0.00 0.00 -0.56 0.00 0.00 28 E 7.96 3.85 0.00 1.93 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 2.29 2.22 0.00 29 E 7.82 4.16 0.00 1.90 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 2.33 0.00 30 K 8.01 4.31 0.00 1.72 1.67 0.00 1.82 0.00 0.00 1.59 0.00 0.00 2.92 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.30 1.32 7.81 31 A 8.04 3.13 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 F 6.97 4.36 0.00 1.51 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 7.59 4.74 0.00 4.06 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 34 P 0.00 4.25 0.00 2.20 2.21 0.00 3.64 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.25 0.00 35 E 8.23 4.15 0.00 2.05 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 2.41 2.45 0.00 36 V 8.06 3.95 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 0.97 0.00 0.00 1.07 0.00 0.00 37 I 7.80 3.84 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 1.65 0.63 0.97 0.00 0.00 38 P 0.00 4.37 0.00 2.29 2.35 0.00 3.90 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.10 0.00 39 M 7.84 4.07 0.00 2.31 2.50 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 2.71 2.98 0.00 40 F 8.33 3.49 0.00 2.81 3.21 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 41 S 8.19 4.06 0.00 4.00 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 42 A 7.72 4.04 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 43 L 7.88 4.24 0.00 1.32 1.57 1.12 0.85 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 44 S 7.23 4.45 0.00 3.44 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 45 E 8.15 4.01 0.00 1.90 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 2.35 2.19 0.00 46 G 8.38 3.81 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 0.00 0.00 0.00 47 A 7.62 4.43 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 48 T 8.70 4.30 4.44 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 1.27 0.00 0.00 49 P 0.00 4.48 0.00 2.16 2.21 0.00 3.81 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 2.08 2.26 0.00 50 Q 8.38 4.00 0.00 2.23 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.81 0.00 0.00 0.00 0.00 0.00 2.39 2.44 0.00 51 D 8.23 4.36 0.00 2.85 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 52 L 8.22 3.95 0.00 1.89 1.61 0.88 0.66 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 53 N 8.57 4.49 0.00 2.98 2.97 0.00 0.00 7.08 6.91 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 54 T 7.96 3.96 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 1.26 0.00 0.00 55 M 8.26 4.37 0.00 1.71 2.22 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.76 2.45 0.00 56 L 8.22 4.33 0.00 1.80 1.81 0.85 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 57 N 8.69 4.58 0.00 2.92 2.95 0.00 0.00 7.05 7.49 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 58 T 7.57 4.26 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 1.42 0.00 0.00 59 V 7.40 3.70 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 0.93 0.00 0.00 1.27 0.00 0.00 60 G 8.61 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 0.00 0.00 0.00 0.00 61 G 8.53 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 62 H 8.65 4.24 0.00 3.53 3.57 0.00 5.63 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 Q 8.12 4.01 0.00 2.16 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.93 0.00 0.00 0.00 0.00 0.00 2.47 2.52 0.00 64 A 7.99 4.08 1.33 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 65 A 7.99 3.90 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 66 M 8.30 4.02 0.00 2.05 2.15 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.95 0.00 67 Q 8.12 3.96 0.00 2.23 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.79 0.00 0.00 0.00 0.00 0.00 2.47 2.52 0.00 68 M 8.16 3.96 0.00 2.15 2.04 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.52 0.00 69 L 8.22 3.84 0.00 1.71 1.80 0.80 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 70 K 8.27 3.92 0.00 1.87 1.94 0.00 1.73 0.00 0.00 1.61 0.00 0.00 2.92 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.59 1.50 7.81 71 E 8.33 3.89 0.00 2.10 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 2.30 2.40 0.00 72 T 8.03 4.00 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 1.22 0.00 0.00 73 I 7.84 3.80 2.14 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.92 1.30 0.00 0.00 74 N 8.38 4.31 0.00 2.88 2.84 0.00 0.00 7.08 7.63 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 75 E 8.24 3.89 0.00 2.09 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 2.28 2.57 0.00 76 E 8.06 3.50 0.00 1.16 1.12 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 2.27 2.24 0.00 77 A 7.59 3.38 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 78 A 7.95 3.97 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 79 E 8.18 3.84 0.00 2.12 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 2.26 2.40 0.00 80 W 8.05 4.30 0.00 3.58 3.39 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 81 D 8.35 4.59 0.00 3.09 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 82 R 8.01 3.90 0.00 1.92 2.05 0.00 3.21 0.00 0.00 3.19 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.64 0.00 83 L 7.29 4.55 0.00 1.23 1.33 0.83 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 84 H 7.31 4.58 0.00 2.79 2.99 0.00 5.87 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 P 0.00 4.29 0.00 2.15 2.03 0.00 3.73 0.00 0.00 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.91 0.00 86 V 8.31 3.70 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 0.82 0.00 0.00 0.97 0.00 0.00 87 A 8.25 4.80 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 88 M 8.45 4.22 0.00 2.03 2.03 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.55 0.00 89 A 8.18 4.69 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 90 P 0.00 4.06 0.00 2.06 2.07 0.00 3.69 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.13 0.00 91 I 8.31 3.83 1.88 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 1.34 0.62 0.91 0.00 0.00 92 A 8.40 4.32 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 93 P 0.00 4.48 0.00 2.05 2.00 0.00 3.70 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 2.03 2.08 0.00 94 G 9.03 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 95 Q 7.61 4.63 0.00 2.22 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.59 0.00 0.00 0.00 0.00 0.00 2.36 2.33 0.00 96 M 8.01 4.80 0.00 1.80 1.99 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.32 0.00 97 R 8.46 4.17 0.00 2.04 2.03 0.00 3.15 0.00 0.00 3.29 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 2.01 0.00 98 E 8.68 4.25 0.00 2.06 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 0.00 2.38 2.29 0.00 99 P 0.00 4.33 0.00 1.36 0.49 0.00 3.59 0.00 0.00 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.98 0.00 100 R 8.80 4.62 0.00 1.88 1.98 0.00 3.39 0.00 0.00 3.23 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.76 0.00 101 G 9.76 3.81 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 0.00 0.00 0.00 102 S 8.06 4.25 0.00 4.06 4.15 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 0.00 103 D 7.90 4.38 0.00 2.74 2.62 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 0.00 104 I 7.21 3.25 1.44 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 0.74 -0.17 -0.30 0.00 0.00 105 A 7.45 2.58 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 0.00 106 G 7.58 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 0.00 107 T 7.81 3.99 4.36 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 1.22 0.00 0.00 108 T 7.88 4.59 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 1.23 0.00 0.00 109 S 7.77 5.05 0.00 4.20 4.43 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.62 4.39 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 1.18 0.00 0.00 111 L 8.30 3.89 0.00 1.88 1.65 0.82 0.55 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 0.00 112 Q 7.92 3.92 0.00 2.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.68 0.00 0.00 0.00 0.00 0.00 2.38 2.33 0.00 113 E 8.10 3.42 0.00 1.81 1.12 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 1.85 2.06 0.00 114 Q 7.95 4.29 0.00 2.32 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.80 0.00 0.00 0.00 0.00 0.00 2.54 2.65 0.00 115 I 8.16 3.84 1.93 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 1.45 0.75 0.90 0.00 0.00 116 G 7.96 3.48 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 0.00 0.00 0.00 117 W 8.27 4.60 0.00 3.57 3.15 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 0.00 118 M 8.35 4.24 0.00 2.03 2.17 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.79 2.57 0.00 119 T 7.71 4.49 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 1.27 0.00 0.00 120 H 7.50 4.53 0.00 3.41 3.50 0.00 5.69 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 N 7.71 4.82 0.00 2.57 2.68 0.00 0.00 6.92 8.02 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 0.00 122 P 0.00 4.62 0.00 2.20 2.08 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 2.03 2.10 0.00 123 P 0.00 4.65 0.00 2.25 2.28 0.00 3.76 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.01 0.00 124 I 8.35 4.34 1.82 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 1.34 0.57 0.73 0.00 0.00 125 P 0.00 4.60 0.00 2.22 2.20 0.00 3.70 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.06 0.00 126 V 7.61 3.43 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 0.29 0.00 0.00 1.00 0.00 0.00 127 G 7.83 3.65 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 0.00 0.00 0.00 128 E 8.00 3.91 0.00 2.06 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 2.36 2.31 0.00 129 I 7.65 3.43 1.26 0.00 0.00 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.07 0.08 0.00 0.00 130 Y 7.46 3.51 0.00 2.52 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 0.00 131 K 8.08 3.77 0.00 1.83 1.90 0.00 1.63 0.00 0.00 1.48 0.00 0.00 2.81 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.44 1.54 7.81 132 R 7.99 3.96 0.00 2.05 2.10 0.00 3.23 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.85 0.00 133 W 7.98 4.44 0.00 3.60 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 0.00 134 I 7.96 3.63 1.83 0.00 0.00 0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.20 0.33 0.00 0.00 135 I 8.13 3.79 2.04 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.06 0.95 0.00 0.00 136 L 8.18 4.13 0.00 1.94 1.75 1.02 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 137 G 8.18 3.59 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 0.00 0.00 0.00 138 L 8.24 3.89 0.00 1.73 1.75 0.53 0.59 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 0.00 139 N 8.01 4.31 0.00 2.89 2.91 0.00 0.00 7.01 6.95 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 0.00 140 K 7.88 4.11 0.00 1.81 1.95 0.00 1.62 0.00 0.00 1.68 0.00 0.00 3.00 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.43 1.44 7.81 141 I 8.00 3.87 1.78 0.00 0.00 0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.38 0.94 0.00 0.00 142 V 8.05 4.32 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 1.40 0.00 0.00 1.07 0.00 0.00 143 R 7.70 4.08 0.00 1.77 2.03 0.00 3.25 0.00 0.00 3.24 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 2.01 0.00 144 M 8.17 4.18 0.00 1.75 2.37 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 2.66 2.46 0.00 145 Y 7.94 4.88 0.00 3.06 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 0.00 146 S 8.50 4.25 0.00 3.95 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