NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 V 3.8484 8.0549 120.3756 62.9371 32.2275 174.8645 2 H 4.5359 8.6747 125.7287 54.2260 28.4984 172.9729 3 L 4.8819 7.9644 125.0190 52.5351 44.6776 176.6437 4 T 4.0145 9.0267 114.0866 61.0121 69.0240 173.8746 5 P 4.3063 0.0000 0.0000 65.0999 31.3312 177.1867 6 E 3.8606 8.5701 118.0029 58.9106 28.9464 178.3405 7 E 3.7488 8.6225 117.7033 59.4939 29.4599 179.5225 8 K 3.7923 8.1191 119.1521 59.4011 32.1246 177.9126 9 S 5.0504 7.9262 112.4393 58.4794 63.5841 175.4611 10 A 4.1863 8.2849 123.5966 53.3803 18.1327 177.8733 11 V 4.0299 7.0566 116.0199 64.5899 32.9130 177.2861 12 T 3.9554 7.3702 108.1437 65.3251 68.0051 175.7605 13 A 4.0345 7.8465 122.2502 54.8187 17.2717 179.2697 14 L 3.9558 8.0148 116.5560 56.7597 41.6889 178.7343 15 W 4.6712 7.9795 127.7380 59.4115 30.9545 178.1072 16 G 3.8470 8.0666 106.3582 47.4513 0.0000 175.3286 17 K 4.5153 7.3091 115.6403 56.4947 31.6518 176.4682 18 V 4.0739 7.1290 119.7723 60.8759 32.2089 175.4212 19 N 4.3599 8.4574 126.0495 53.7278 37.2326 175.0413 20 V 3.5516 8.0379 124.7697 64.8119 31.8601 176.3710 21 D 4.7261 7.6609 116.3601 54.7412 41.2567 176.5616 22 E 4.6003 8.1509 117.0608 55.2572 31.8067 177.6232 23 V 3.8794 7.6494 117.6803 64.5154 31.9546 177.7060 24 G 4.3342 7.4663 106.7131 47.4593 0.0000 175.7751 25 G 3.4738 8.0065 107.8051 47.3630 0.0000 175.3088 26 E 3.9456 8.0067 121.4240 58.8074 29.6222 178.8097 27 A 3.9497 8.2830 121.2952 54.9784 18.4649 179.3856 28 L 3.9955 8.6569 119.6465 58.3247 42.0764 179.4576 29 G 3.6037 8.1919 105.6757 47.8437 0.0000 175.9462 30 R 3.9971 8.1687 120.3947 58.5809 30.0059 178.4698 31 L 4.0447 7.8813 120.3583 58.6159 42.2251 179.3074 32 L 4.3366 7.7157 119.2664 56.6949 41.2160 179.5773 33 V 3.6800 6.9365 116.0452 65.3435 31.8776 177.8342 34 V 3.5668 7.9440 116.8536 64.0766 32.8078 175.5993 35 Y 4.0776 7.6346 116.2055 54.3929 38.0291 174.1116 36 P 4.7917 0.0000 0.0000 64.1313 31.4594 177.6078 37 W 4.4854 8.1786 115.2017 58.8511 27.8641 177.8198 38 T 4.3301 7.6730 111.1443 64.4635 68.3223 176.4227 39 Q 4.2272 8.1868 121.2117 58.7302 28.3923 178.5717 40 R 4.0486 7.5010 117.5715 59.0519 30.1144 178.0990 41 F 4.2749 7.6488 114.9212 57.9265 39.2325 175.5013 42 F 4.6474 7.7090 117.7463 57.0305 40.0696 176.2808 43 E 4.1383 8.2919 122.2111 59.2887 29.6252 178.9607 44 S 4.4541 8.2018 110.7689 59.7970 62.2947 174.0089 45 F 4.7839 8.2740 116.7344 57.8221 40.3185 177.0839 46 G 3.9924 7.8508 109.9216 45.8233 0.0000 176.0783 47 D 4.5057 8.7828 127.3983 54.1653 40.8656 175.3228 48 L 4.8797 8.2995 126.6323 54.7358 43.3405 177.3777 49 S 4.4893 7.8953 115.3583 59.5795 63.1384 174.4337 50 T 4.7570 7.3720 109.2095 58.1688 73.0202 172.5247 51 P 4.1747 0.0000 0.0000 66.2265 31.2460 178.4798 52 D 4.3586 8.1562 116.5121 57.4616 40.5202 178.7294 53 A 3.9923 7.7963 120.0859 55.0469 18.5387 179.5690 54 V 3.6894 8.2781 117.1497 66.5250 31.4687 178.1336 55 M 4.2780 8.4748 117.1193 56.9257 31.9232 177.8533 56 G 4.0530 7.3786 103.9429 43.1461 0.0000 172.7777 57 N 4.5549 7.4906 121.5392 52.3758 39.6305 174.3761 58 P 4.2764 0.0000 0.0000 65.2518 31.4345 178.7695 59 K 3.7694 8.4393 117.8671 58.6119 31.7728 179.6444 60 V 3.6921 7.6774 118.3871 65.8928 31.3572 178.0469 61 K 3.9231 7.7759 118.0717 59.3876 32.0784 179.0209 62 A 4.0012 7.8614 121.0086 55.6964 18.3063 179.2359 63 H 4.4366 8.4180 116.7380 59.1407 29.8931 177.5253 64 G 3.8095 8.6776 108.0410 47.6178 0.0000 175.7463 65 K 3.9956 7.8216 120.4133 59.2841 32.3547 179.5315 66 K 4.0039 7.7085 117.6494 59.1978 31.9035 179.6425 67 V 3.6058 7.9686 118.6646 65.9877 31.6101 177.5719 68 L 4.4770 8.3058 119.7474 58.5565 41.7571 179.0473 69 G 3.7923 8.6186 105.4098 47.9149 0.0000 175.4897 70 A 4.0124 7.7897 121.8016 54.7540 18.5491 179.5911 71 F 4.4137 8.4774 116.3473 61.0423 39.2039 177.7400 72 S 4.3249 9.1410 115.1333 62.2290 62.6066 176.5565 73 D 4.5019 8.7056 121.7162 57.3887 40.2508 179.4621 74 G 3.7750 8.1977 105.5602 48.0007 0.0000 175.6214 75 L 4.0256 7.8615 119.8707 57.1070 41.6214 179.1299 76 A 4.2009 7.7951 119.6990 54.2491 19.5107 177.9109 77 H 4.7827 7.7540 115.5431 54.4587 27.9447 175.2430 78 L 4.2051 7.7927 120.0439 56.4196 42.2777 177.8929 79 D 4.6257 7.9144 116.3856 53.7216 40.0463 176.7306 80 N 4.8292 7.6649 117.4706 51.9527 40.1708 173.3296 81 L 4.6492 8.2017 124.0557 55.3180 42.9487 177.6449 82 K 4.2379 8.0997 118.0952 58.2967 32.3406 178.3108 83 G 3.7587 7.9032 104.8965 47.6746 0.0000 175.6309 84 T 3.8504 7.8130 116.7070 65.3894 68.7509 175.7048 85 F 4.6098 7.7808 116.6058 57.0361 39.4608 177.4090 86 A 4.0071 7.7530 122.9316 55.5212 18.3755 180.3169 87 T 3.7834 7.7538 113.6600 66.8848 68.5898 176.7710 88 L 4.0652 7.9063 120.3462 57.7028 41.5207 179.4955 89 S 4.1730 8.4196 114.8211 60.9011 62.4517 175.5399 90 E 3.9676 7.9698 121.7984 59.3231 29.2462 178.6315 91 L 3.8856 7.7631 119.5128 58.7437 42.2691 178.8327 92 H 4.2940 8.5747 116.1269 58.2401 28.0988 177.3619 93 C 4.5257 8.1278 119.7913 61.2342 28.3408 175.6652 94 D 4.2556 7.7686 118.4985 56.0252 41.1240 177.5278 95 K 4.2611 7.9204 118.0488 58.1286 32.9560 177.1849 96 L 4.3238 7.8091 115.9603 55.1391 41.9695 176.6143 97 H 4.4269 8.2479 113.0157 54.9626 26.4545 174.5948 98 V 3.5188 7.6993 118.9185 62.7751 31.6207 175.3636 99 D 4.1505 8.7860 127.4518 53.7118 41.4857 175.0862 100 P 3.1991 0.0000 0.0000 64.5840 31.4603 177.8087 101 E 3.8442 8.0714 119.6231 59.5443 29.3542 178.4154 102 N 4.3816 8.0915 116.5505 55.7525 38.5091 177.1482 103 F 4.4712 7.3887 119.6430 60.9450 38.9456 177.6709 104 R 3.9966 8.1234 117.4758 59.4784 29.8952 178.3745 105 L 3.9202 7.7505 118.4157 57.5577 41.4607 179.2139 106 L 4.1470 8.1716 120.5393 58.2125 41.9643 179.3469 107 G 3.7365 8.1842 105.2521 47.6374 0.0000 175.3491 108 N 4.5540 8.1152 118.6221 55.9161 38.6617 177.9602 109 V 3.7279 7.9400 114.1680 64.0049 31.5719 178.1126 110 L 3.8518 8.2975 120.6928 58.2105 41.8145 179.2888 111 V 3.4338 7.5824 117.9056 66.2465 31.4970 177.8812 112 C 4.1601 8.0126 116.4204 62.5011 27.8492 176.3230 113 V 3.5027 7.7931 120.1334 65.8077 30.9959 178.1324 114 L 3.8314 7.7807 118.6536 57.5295 41.3096 179.4151 115 A 3.6775 7.2282 120.8382 55.0770 18.0495 179.0677 116 H 4.0553 7.7873 115.9668 59.6402 30.0403 176.6633 117 H 4.2546 7.9032 115.7153 56.6514 29.1369 175.8103 118 F 4.9278 7.8018 117.2218 55.7415 42.1412 176.7112 119 G 3.8524 8.0377 110.7606 45.8906 0.0000 177.4585 120 K 4.1212 9.0251 123.5700 58.9225 31.8355 177.0880 121 E 4.1553 8.2794 118.2790 57.6501 29.7971 176.6084 122 F 4.5403 8.3923 122.2552 57.2920 38.0477 175.4299 123 T 4.4382 7.5365 117.1328 59.1251 71.9277 173.6147 124 P 4.1505 0.0000 0.0000 65.6442 31.2903 177.2456 125 P 4.3049 0.0000 0.0000 65.1196 31.0727 178.9949 126 V 3.5488 7.1834 116.4529 65.7351 31.5128 177.4424 127 Q 3.6275 7.7115 119.4683 59.3213 28.3750 178.3200 128 A 3.9602 8.2324 121.5885 55.6061 18.2024 179.5772 129 A 3.9739 7.5885 117.3746 55.3485 18.3256 179.5109 130 Y 3.9071 7.7798 115.1175 61.1003 37.8655 178.3964 131 Q 4.0815 8.7685 119.6547 58.8438 28.7952 179.0112 132 K 3.9803 7.7776 118.4182 59.2906 32.1230 179.5656 133 V 3.5560 7.5449 118.9252 65.9787 31.5422 178.4019 134 V 3.9319 8.2519 118.7469 64.3610 31.4554 178.0535 135 A 4.1318 8.3672 121.8567 55.1087 18.0679 179.8954 136 G 3.4500 7.9906 104.0976 47.6859 0.0000 176.1513 137 V 2.8086 7.7581 120.4415 65.4248 31.4725 177.9496 138 A 3.7503 7.6955 120.1818 55.0652 18.0320 178.9901 139 N 4.2774 8.1222 114.1941 56.8696 39.4749 176.5440 140 A 4.1128 8.0224 122.1952 55.2730 17.9607 179.6207 141 L 3.7272 8.0314 117.4785 57.3980 41.4669 178.6743 142 A 4.8090 7.9968 118.7355 52.6909 18.5550 178.3211 143 H 4.0564 7.9703 119.2650 59.4199 29.9710 177.0763 144 K 4.0786 7.6951 115.5529 57.9504 32.0098 176.8990 145 Y 4.6088 7.9054 116.6945 58.4393 39.0185 175.6371 146 H 4.6313 8.0585 122.0131 55.9497 28.8782 174.9364 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 V 8.05 3.85 2.04 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 0.99 0.00 0.00 0.95 0.00 0.00 2 H 8.67 4.54 0.00 3.26 3.20 0.00 5.72 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 L 7.96 4.88 0.00 1.57 1.51 0.81 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 4 T 9.03 4.01 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 5 P 0.00 4.31 0.00 2.16 2.12 0.00 3.59 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 2.09 2.12 0.00 6 E 8.57 3.86 0.00 2.00 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 2.35 2.40 0.00 7 E 8.62 3.75 0.00 2.29 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 2.27 2.32 0.00 8 K 8.12 3.79 0.00 1.77 1.97 0.00 1.67 0.00 0.00 1.84 0.00 0.00 3.04 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.48 7.81 9 S 7.93 5.05 0.00 4.12 4.07 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 0.00 0.00 0.00 10 A 8.28 4.19 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 11 V 7.06 4.03 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 0.50 0.00 0.00 0.25 0.00 0.00 12 T 7.37 3.96 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 1.30 0.00 0.00 13 A 7.85 4.03 1.43 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 0.00 0.00 14 L 8.01 3.96 0.00 1.94 1.84 1.03 -0.04 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 15 W 7.98 4.67 0.00 3.65 3.34 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 16 G 8.07 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 17 K 7.31 4.52 0.00 2.02 2.06 0.00 1.69 0.00 0.00 1.50 0.00 0.00 3.16 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.54 1.54 7.81 18 V 7.13 4.07 1.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.14 0.00 0.00 0.79 0.00 0.00 19 N 8.46 4.36 0.00 2.68 2.65 0.00 0.00 6.82 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 20 V 8.04 3.55 2.04 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 0.83 0.00 0.00 0.92 0.00 0.00 21 D 7.66 4.73 0.00 2.71 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 22 E 8.15 4.60 0.00 1.94 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 2.17 2.17 0.00 23 V 7.65 3.88 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 0.96 0.00 0.00 0.82 0.00 0.00 24 G 7.47 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 25 G 8.01 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.01 3.95 0.00 2.00 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 2.23 2.27 0.00 27 A 8.28 3.95 1.38 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 0.00 0.00 0.00 0.00 0.00 0.00 28 L 8.66 4.00 0.00 1.97 1.66 0.91 0.88 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 29 G 8.19 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.17 4.00 0.00 1.92 1.93 0.00 3.07 0.00 0.00 3.01 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.64 0.00 31 L 7.88 4.04 0.00 1.85 1.92 0.98 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 32 L 7.72 4.34 0.00 1.67 1.69 0.76 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 33 V 6.94 3.68 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 0.72 0.00 0.00 0.91 0.00 0.00 34 V 7.94 3.57 1.53 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 0.09 0.00 0.00 0.74 0.00 0.00 35 Y 7.63 4.08 0.00 2.55 1.43 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 36 P 0.00 4.79 0.00 2.22 2.10 0.00 3.94 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.10 0.00 37 W 8.18 4.49 0.00 3.60 3.57 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.67 4.33 4.38 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 0.00 0.00 0.00 1.03 0.00 0.00 39 Q 8.19 4.23 0.00 2.27 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.81 0.00 0.00 0.00 0.00 0.00 2.42 2.48 0.00 40 R 7.50 4.05 0.00 1.83 1.56 0.00 3.09 0.00 0.00 3.15 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.64 0.00 41 F 7.65 4.27 0.00 2.15 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 42 F 7.71 4.65 0.00 2.78 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 0.00 0.00 0.00 0.00 43 E 8.29 4.14 0.00 2.02 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 2.46 0.00 44 S 8.20 4.45 0.00 3.95 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 45 F 8.27 4.78 0.00 3.26 3.11 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 46 G 7.85 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 0.00 0.00 0.00 47 D 8.78 4.51 0.00 2.67 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 48 L 8.30 4.88 0.00 1.66 1.62 1.05 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 49 S 7.90 4.49 0.00 3.90 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 50 T 7.37 4.76 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 1.21 0.00 0.00 51 P 0.00 4.17 0.00 2.15 2.13 0.00 3.59 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 2.09 2.17 0.00 52 D 8.16 4.36 0.00 2.67 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 53 A 7.80 3.99 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 54 V 8.28 3.69 2.21 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 1.06 0.00 0.00 0.98 0.00 0.00 55 M 8.47 4.28 0.00 1.96 2.09 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 2.60 2.83 0.00 56 G 7.38 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 0.00 0.00 0.00 57 N 7.49 4.55 0.00 2.92 2.85 0.00 0.00 7.20 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 58 P 0.00 4.28 0.00 2.12 2.03 0.00 3.59 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 2.07 2.13 0.00 59 K 8.44 3.77 0.00 1.48 0.74 0.00 1.56 0.00 0.00 1.15 0.00 0.00 2.76 0.00 0.00 2.87 0.00 0.00 0.00 0.00 0.95 1.15 7.81 60 V 7.68 3.69 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 1.08 0.00 0.00 1.10 0.00 0.00 61 K 7.78 3.92 0.00 1.76 1.82 0.00 1.71 0.00 0.00 1.63 0.00 0.00 3.01 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.44 1.61 7.81 62 A 7.86 4.00 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 63 H 8.42 4.44 0.00 3.64 3.49 0.00 5.80 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 G 8.68 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 65 K 7.82 4.00 0.00 2.03 1.88 0.00 1.78 0.00 0.00 1.64 0.00 0.00 2.96 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.56 1.47 7.81 66 K 7.71 4.00 0.00 2.00 1.85 0.00 1.70 0.00 0.00 1.62 0.00 0.00 2.95 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.48 1.46 7.81 67 V 7.97 3.61 2.35 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 1.26 0.00 0.00 1.05 0.00 0.00 68 L 8.31 4.48 0.00 2.06 1.91 0.79 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 69 G 8.62 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 A 7.79 4.01 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 71 F 8.48 4.41 0.00 3.64 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 72 S 9.14 4.32 0.00 4.24 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 73 D 8.71 4.50 0.00 2.78 2.45 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 0.00 74 G 8.20 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 0.00 0.00 0.00 75 L 7.86 4.03 0.00 1.35 1.55 0.64 -0.45 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 76 A 7.80 4.20 1.45 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 0.00 0.00 0.00 77 H 7.75 4.78 0.00 3.09 3.33 0.00 5.64 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 L 7.79 4.21 0.00 1.61 1.69 0.83 1.10 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 79 D 7.91 4.63 0.00 2.77 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 80 N 7.66 4.83 0.00 2.69 2.76 0.00 0.00 7.05 7.66 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 81 L 8.20 4.65 0.00 1.80 1.75 1.17 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 82 K 8.10 4.24 0.00 1.70 1.79 0.00 1.54 0.00 0.00 1.62 0.00 0.00 2.89 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.28 1.21 7.81 83 G 7.90 3.76 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 0.00 0.00 0.00 84 T 7.81 3.85 3.66 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 0.71 0.00 0.00 85 F 7.78 4.61 0.00 3.17 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 86 A 7.75 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 87 T 7.75 3.78 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 1.19 0.00 0.00 88 L 7.91 4.07 0.00 1.89 1.78 0.97 0.88 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 89 S 8.42 4.17 0.00 3.98 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 90 E 7.97 3.97 0.00 2.22 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 2.44 2.30 0.00 91 L 7.76 3.89 0.00 1.82 1.83 0.90 0.84 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 92 H 8.57 4.29 0.00 3.37 3.72 0.00 5.85 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 93 C 8.13 4.53 0.00 2.64 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 0.00 0.00 0.00 94 D 7.77 4.26 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 95 K 7.92 4.26 0.00 1.67 1.87 0.00 1.67 0.00 0.00 1.71 0.00 0.00 3.10 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.34 1.50 7.81 96 L 7.81 4.32 0.00 1.85 1.75 0.75 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 97 H 8.25 4.43 0.00 3.39 3.46 0.00 5.76 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 7.70 3.52 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 0.24 0.00 0.00 0.42 0.00 0.00 99 D 8.79 4.15 0.00 2.74 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 0.00 100 P 0.00 3.20 0.00 2.27 2.31 0.00 3.36 0.00 0.00 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.45 0.00 101 E 8.07 3.84 0.00 2.08 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 2.28 2.39 0.00 102 N 8.09 4.38 0.00 2.71 2.81 0.00 0.00 6.87 7.72 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 0.00 103 F 7.39 4.47 0.00 3.16 2.95 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 0.00 104 R 8.12 4.00 0.00 1.93 2.12 0.00 3.20 0.00 0.00 3.36 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.77 0.00 105 L 7.75 3.92 0.00 1.67 1.13 0.42 0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 106 L 8.17 4.15 0.00 1.89 1.98 1.03 1.10 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 0.00 107 G 8.18 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 0.00 0.00 0.00 108 N 8.12 4.55 0.00 2.95 2.95 0.00 0.00 6.91 8.27 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 0.00 109 V 7.94 3.73 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 1.02 0.00 0.00 1.05 0.00 0.00 110 L 8.30 3.85 0.00 1.65 1.72 0.88 0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 111 V 7.58 3.43 2.29 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 1.27 0.00 0.00 1.19 0.00 0.00 112 C 8.01 4.16 0.00 3.15 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 0.00 113 V 7.79 3.50 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 0.76 0.00 0.00 0.86 0.00 0.00 114 L 7.78 3.83 0.00 0.80 1.13 0.34 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 115 A 7.23 3.68 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 0.00 116 H 7.79 4.06 0.00 3.27 3.53 0.00 5.75 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 0.00 117 H 7.90 4.25 0.00 2.82 2.59 0.00 5.67 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 F 7.80 4.93 0.00 3.23 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 0.00 119 G 8.04 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 0.00 120 K 9.03 4.12 0.00 1.81 1.97 0.00 1.77 0.00 0.00 1.66 0.00 0.00 3.00 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.49 1.49 7.81 121 E 8.28 4.16 0.00 2.03 2.34 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 2.31 2.26 0.00 122 F 8.39 4.54 0.00 3.04 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 0.00 123 T 7.54 4.44 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 1.26 0.00 0.00 124 P 0.00 4.15 0.00 2.15 2.15 0.00 3.58 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.20 0.00 125 P 0.00 4.30 0.00 2.10 2.06 0.00 3.49 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 2.08 2.11 0.00 126 V 7.18 3.55 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 0.98 0.00 0.00 0.88 0.00 0.00 127 Q 7.71 3.63 0.00 1.80 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.47 0.00 0.00 0.00 0.00 0.00 2.40 2.55 0.00 128 A 8.23 3.96 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 0.00 129 A 7.59 3.97 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 0.00 130 Y 7.78 3.91 0.00 3.23 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 0.00 131 Q 8.77 4.08 0.00 2.21 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.82 0.00 0.00 0.00 0.00 0.00 2.70 2.60 0.00 132 K 7.78 3.98 0.00 1.98 1.82 0.00 1.63 0.00 0.00 1.55 0.00 0.00 2.89 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.45 1.59 7.81 133 V 7.54 3.56 2.21 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 1.02 0.00 0.00 0.79 0.00 0.00 134 V 8.25 3.93 2.27 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 0.86 0.00 0.00 1.08 0.00 0.00 135 A 8.37 4.13 1.43 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 0.00 0.00 136 G 7.99 3.45 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 0.00 0.00 0.00 0.00 137 V 7.76 2.81 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 -0.21 0.00 0.00 0.90 0.00 0.00 138 A 7.70 3.75 1.48 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 0.00 139 N 8.12 4.28 0.00 2.82 2.98 0.00 0.00 7.26 8.82 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 0.00 140 A 8.02 4.11 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 0.00 141 L 8.03 3.73 0.00 0.96 0.31 0.16 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 142 A 8.00 4.81 1.65 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 0.00 143 H 7.97 4.06 0.00 3.35 3.38 0.00 5.79 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 K 7.70 4.08 0.00 1.49 1.60 0.00 1.69 0.00 0.00 1.68 0.00 0.00 3.19 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.40 1.52 7.81 145 Y 7.91 4.61 0.00 3.02 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 0.00 146 H 8.06 4.63 0.00 3.23 3.21 0.00 5.70 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00