NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 V 4.0720 8.0393 120.3965 62.5877 32.4395 175.7826 6 S 4.1882 8.2061 121.9455 57.7274 65.1285 173.9540 7 Q 3.9019 9.1748 122.7238 58.6707 28.6673 180.0061 8 E 3.9813 7.8770 118.9893 59.2913 29.7691 178.5845 9 E 3.9496 7.7733 118.5586 59.3352 29.5628 179.7708 10 V 2.0000 6.6690 111.1547 63.5708 31.3955 178.7072 11 K 3.9955 7.3620 116.8874 59.3698 31.8420 179.3906 12 K 4.0212 7.6233 118.5452 59.3338 31.2496 179.3086 13 W 4.6084 7.9806 118.8256 59.5005 28.7154 177.6369 14 A 4.0360 8.0456 118.5049 53.3631 18.2081 178.2389 15 E 4.3861 8.3598 116.7608 56.6184 30.7573 176.5238 16 S 4.5565 7.1268 110.2415 56.0459 66.2928 177.0184 17 L 3.8910 7.7838 126.1612 57.7270 41.6217 178.9769 18 E 3.9366 8.1454 117.9588 59.6727 29.5127 179.0190 19 N 4.3226 7.9177 116.1908 56.2608 38.2392 177.1790 20 L 3.1055 7.7003 121.1698 57.9432 41.8946 178.8754 21 I 3.4361 7.1812 118.5257 63.3816 37.1171 177.1015 22 N 4.6659 8.3549 115.5072 52.7619 39.2023 174.2456 23 H 4.7696 7.5199 121.6531 54.5623 31.3860 175.4071 24 E 3.9183 8.6161 126.8758 59.5772 29.3783 178.4343 25 C 4.4165 8.3750 118.0564 61.6882 31.0858 175.5192 26 G 3.1138 8.3273 108.5353 46.8468 0.0000 175.4058 27 L 4.2160 8.1339 121.5549 57.3923 41.8064 179.4540 28 A 4.0273 7.7225 120.4221 55.2803 18.3071 179.6243 29 A 3.9014 8.9614 120.4775 55.1609 18.3747 179.6785 30 F 4.3262 9.6118 119.4293 61.3757 39.3194 177.4922 31 K 3.7185 8.8233 118.7360 59.4167 31.6284 179.2281 32 A 3.8487 7.5617 119.5169 54.9138 18.6906 179.0551 33 F 3.8938 8.2915 119.5613 61.3620 39.4540 177.3053 34 L 3.6300 7.7876 118.8202 57.4549 41.3273 179.2133 35 K 3.5971 7.3660 119.5849 59.6960 31.7684 178.8799 36 S 3.7444 7.1211 113.7980 60.7454 63.0782 175.5536 37 E 4.3693 7.4140 118.7985 55.0413 29.2021 175.8372 38 Y 3.5879 6.7329 115.2237 59.0346 36.3591 171.2658 39 S 4.8508 7.2630 111.7648 58.5143 64.4086 175.2810 40 E 4.0513 8.1982 123.4827 59.9098 29.2659 177.7042 41 E 4.2243 8.2741 118.7743 59.3986 29.5260 178.6693 42 N 4.4408 8.1826 117.5666 56.4022 38.7041 177.1865 43 I 3.9797 7.8543 119.4637 64.1523 38.2951 177.4621 44 D 4.4797 8.1828 119.5507 57.3970 40.6596 178.5020 45 F 3.3036 8.6523 121.5637 60.7235 39.2501 176.8969 46 W 4.1708 8.7258 128.3981 60.5777 30.4713 178.0484 47 I 3.4302 8.1222 120.0419 64.2025 36.5318 178.6046 48 S 3.9107 7.6308 114.9206 61.5294 62.7325 176.3635 49 C 3.6799 7.6826 120.7170 62.1365 27.6245 175.8620 50 E 3.5243 7.6844 120.4769 59.3522 28.9518 179.2293 51 E 3.8229 7.6095 118.0617 59.4861 29.2404 178.7822 52 Y 3.6894 7.4091 118.5620 60.6115 38.9222 178.1810 53 K 4.1739 8.0432 118.0527 58.6952 32.1656 178.8844 54 K 4.2837 7.3618 117.8906 57.2237 32.2993 177.2047 55 I 3.7588 7.1183 120.5801 61.2608 36.8495 175.8328 56 K 4.2183 8.4744 124.0820 56.1496 32.6784 176.5545 57 S 4.5147 7.5322 117.2555 56.2904 62.7888 172.9551 58 P 4.4879 0.0000 0.0000 63.9606 31.1483 177.3357 59 S 4.3707 7.8049 113.7477 60.4528 64.0024 175.8746 60 K 4.2056 7.7823 119.4995 57.8443 31.9361 178.9652 61 L 3.8976 7.6978 119.4818 57.9222 41.5351 178.7512 62 S 4.2007 8.2156 114.3964 61.3540 62.2578 174.4902 63 P 4.2720 0.0000 0.0000 66.0687 31.2717 178.8720 64 K 4.1128 7.8355 115.9990 59.5936 32.4693 178.9550 65 A 4.1109 8.7189 122.5698 55.1975 18.2962 179.6643 66 K 3.9733 8.2883 116.8966 59.5586 32.1356 179.7733 67 K 4.1002 7.8385 117.4866 59.5989 31.7836 179.5327 68 I 3.9920 8.3420 120.3844 64.5630 37.0589 177.8388 69 Y 4.5063 9.0484 121.2484 61.1298 38.5227 178.0866 70 N 4.5558 9.0788 116.4883 55.7287 38.6377 176.8327 71 E 4.0301 8.4551 120.5612 58.7659 29.8784 177.6629 72 F 4.5347 9.4433 117.6543 58.3188 39.7988 177.5083 73 I 3.9359 7.5555 117.1515 61.3959 37.9601 176.1555 74 S 4.0450 7.6561 116.3365 58.1240 62.5452 175.2556 75 V 3.8725 8.4219 120.7215 63.8143 31.4266 176.7349 76 Q 4.3491 8.0016 116.9429 55.0711 28.7985 175.7372 77 A 3.9965 8.1688 122.9905 52.7152 18.7512 179.1108 78 T 4.0559 8.3781 111.6387 63.5583 69.5669 174.9901 79 K 4.5740 7.0193 120.9637 54.4482 32.1057 175.4801 80 E 4.1345 8.0194 122.3853 57.6099 30.5394 177.5979 81 V 4.3709 7.5948 116.9720 59.7723 33.6764 175.9912 82 N 4.5741 8.6114 121.2641 53.0374 37.3103 174.1404 83 L 4.7050 8.0735 122.3770 51.9220 46.1608 176.5026 84 D 4.6132 8.3153 119.7661 54.2863 42.3455 178.0124 85 S 4.1688 8.4955 116.9814 61.4045 62.8503 176.4158 86 C 4.1816 7.9612 121.3143 62.1557 31.5080 175.3871 87 T 3.8172 7.7897 116.9118 66.6778 68.1389 176.5147 88 R 3.9085 7.6506 119.8813 59.4332 30.1285 178.9758 89 E 4.0352 7.8481 117.4423 59.4174 29.4323 179.0217 90 E 3.9145 8.6546 119.7221 59.6515 29.4422 179.0692 91 T 3.6813 7.7786 115.0188 66.4221 68.6244 176.3987 92 S 3.9141 8.2190 116.2871 61.6345 63.0276 176.9321 93 R 3.9311 8.0129 121.6282 58.7811 29.7766 178.6436 94 N 4.4399 8.0389 116.0304 55.9640 38.1887 177.1514 95 M 4.0595 7.3561 119.8474 58.3551 32.0267 178.3414 96 L 4.2807 7.6165 117.8063 56.4305 42.9826 177.4485 97 E 4.6038 7.8827 117.3162 53.3933 30.2949 171.4745 98 P 4.4359 0.0000 0.0000 62.8156 32.1505 175.9727 99 T 4.7795 8.3013 112.2890 59.2518 71.8786 174.5893 100 I 3.9726 8.3725 121.1532 63.5583 37.9850 176.2209 101 T 4.9974 7.4895 108.6871 61.0147 68.9830 176.0885 102 C 3.7970 8.1177 123.2305 62.7550 31.7647 175.1158 103 F 4.3593 7.7658 115.6923 57.6956 39.0293 177.4415 104 D 4.3860 7.5780 120.4878 57.3711 40.6683 178.1363 105 E 3.9469 8.1596 119.1223 59.1154 29.6960 178.6354 106 A 4.0240 7.8474 120.4530 55.1833 18.6319 179.1390 107 Q 4.2135 8.4150 118.1917 59.3134 29.0630 178.3722 108 K 3.9464 8.1596 120.6477 59.5600 32.2027 178.9207 109 K 4.0731 7.9432 118.2429 59.4635 31.8621 179.4755 110 I 3.8315 7.9685 120.1472 64.3348 36.9913 178.4473 111 F 3.9122 9.1095 118.9820 60.7495 38.8138 177.5633 112 N 4.3375 8.7471 116.4913 56.0533 38.4401 177.2307 113 L 3.9370 8.5539 122.3328 58.4557 42.3211 178.9487 114 M 4.1805 8.3590 117.2482 58.4131 31.0987 178.0549 115 E 3.6817 8.3026 120.5383 58.7440 29.6208 178.4553 116 K 4.1856 8.3792 116.4647 57.6388 32.4648 176.4934 117 D 4.8521 7.8806 116.9296 55.6466 43.2632 178.2081 118 S 4.4193 8.8619 114.3689 61.9913 63.1034 175.9770 119 Y 3.9060 7.5402 118.3412 60.5730 37.5023 178.9559 120 R 3.9645 8.1057 118.3165 59.4737 30.1719 179.2722 121 R 3.9983 8.4388 118.1429 58.9625 29.8692 178.7347 122 F 3.5737 9.0813 121.0211 60.5917 39.4162 176.8198 123 L 3.1760 7.5597 117.0076 57.1039 41.4806 178.8376 124 K 4.3554 7.3345 115.4533 55.5634 32.7726 177.3087 125 S 4.4699 7.5637 115.8112 57.7955 64.0770 175.6671 126 R 3.9054 8.5902 121.1249 59.2739 29.6751 179.3492 127 F 3.9643 8.0727 117.1842 60.6901 38.9334 176.8270 128 Y 4.0653 8.0089 118.4694 60.7118 38.4738 177.8520 129 L 4.1848 7.7842 119.8235 57.3522 41.8376 178.9489 130 D 4.4555 8.3445 117.5939 57.5773 40.9176 178.8436 131 L 4.1598 8.0112 118.0452 56.0584 42.9598 177.6675 132 T 4.2670 7.9874 110.4897 59.6725 68.0075 174.0005 133 N 4.4733 7.8940 125.1045 54.2451 38.7119 175.3733 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 5 V 8.04 4.07 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 0.80 0.00 0.00 1.11 0.00 0.00 6 S 8.21 4.19 0.00 4.11 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 7 Q 9.17 3.90 0.00 2.02 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.07 6.89 0.00 0.00 0.00 0.00 0.00 2.30 2.34 0.00 8 E 7.88 3.98 0.00 1.87 1.95 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 2.26 2.34 0.00 9 E 7.77 3.95 0.00 1.80 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 2.38 2.30 0.00 10 V 6.67 2.00 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 0.01 0.00 0.00 0.56 0.00 0.00 11 K 7.36 4.00 0.00 1.92 1.83 0.00 1.63 0.00 0.00 1.63 0.00 0.00 2.88 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.42 1.61 7.81 12 K 7.62 4.02 0.00 1.99 1.98 0.00 1.71 0.00 0.00 1.71 0.00 0.00 2.95 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.48 1.62 7.81 13 W 7.98 4.61 0.00 3.55 2.85 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 14 A 8.05 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 15 E 8.36 4.39 0.00 2.13 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 0.00 2.32 2.53 0.00 16 S 7.13 4.56 0.00 4.14 3.92 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 17 L 7.78 3.89 0.00 0.90 1.18 0.19 -0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.29 0.00 0.00 0.00 0.00 0.00 0.00 18 E 8.15 3.94 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 2.71 2.63 0.00 19 N 7.92 4.32 0.00 3.11 3.07 0.00 0.00 6.75 6.62 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 20 L 7.70 3.11 0.00 1.25 1.29 -1.03 -0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 21 I 7.18 3.44 1.45 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.48 0.02 -0.25 0.00 0.00 22 N 8.35 4.67 0.00 2.76 2.90 0.00 0.00 6.92 7.39 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 23 H 7.52 4.77 0.00 3.61 3.34 0.00 5.59 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 E 8.62 3.92 0.00 2.06 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 2.42 2.40 0.00 25 C 8.38 4.42 0.00 3.28 3.30 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 26 G 8.33 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 0.00 0.00 0.00 27 L 8.13 4.22 0.00 1.86 1.75 1.02 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 28 A 7.72 4.03 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 29 A 8.96 3.90 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 30 F 9.61 4.33 0.00 2.80 2.97 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 31 K 8.82 3.72 0.00 1.98 1.80 0.00 1.75 0.00 0.00 1.67 0.00 0.00 3.01 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.48 1.64 7.81 32 A 7.56 3.85 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 33 F 8.29 3.89 0.00 3.01 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 34 L 7.79 3.63 0.00 1.52 1.34 0.49 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 35 K 7.37 3.60 0.00 1.64 1.57 0.00 1.54 0.00 0.00 1.56 0.00 0.00 2.91 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.26 1.37 7.81 36 S 7.12 3.74 0.00 3.39 3.58 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 37 E 7.41 4.37 0.00 1.76 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 2.11 1.77 0.00 38 Y 6.73 3.59 0.00 3.13 3.01 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 39 S 7.26 4.85 0.00 4.14 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 40 E 8.20 4.05 0.00 2.22 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 0.00 2.41 2.43 0.00 41 E 8.27 4.22 0.00 2.44 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 0.00 2.44 2.48 0.00 42 N 8.18 4.44 0.00 3.04 3.07 0.00 0.00 6.64 7.40 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 43 I 7.85 3.98 2.00 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 1.76 1.44 1.06 0.00 0.00 44 D 8.18 4.48 0.00 3.11 2.96 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 0.00 0.00 0.00 45 F 8.65 3.30 0.00 2.95 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 46 W 8.73 4.17 0.00 3.68 3.55 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 47 I 8.12 3.43 2.05 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.55 0.87 0.00 0.00 48 S 7.63 3.91 0.00 3.72 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 49 C 7.68 3.68 0.00 2.70 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 50 E 7.68 3.52 0.00 1.50 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 1.47 1.47 0.00 51 E 7.61 3.82 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 2.22 2.29 0.00 52 Y 7.41 3.69 0.00 2.80 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 53 K 8.04 4.17 0.00 1.80 1.81 0.00 1.61 0.00 0.00 1.63 0.00 0.00 2.99 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.63 1.59 7.81 54 K 7.36 4.28 0.00 1.72 1.78 0.00 1.60 0.00 0.00 1.63 0.00 0.00 2.96 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.37 1.54 7.81 55 I 7.12 3.76 1.53 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.45 0.78 0.00 0.00 56 K 8.47 4.22 0.00 1.68 1.79 0.00 1.70 0.00 0.00 1.67 0.00 0.00 2.94 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.32 1.56 7.81 57 S 7.53 4.51 0.00 3.80 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 58 P 0.00 4.49 0.00 2.17 2.30 0.00 3.72 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 1.97 1.94 0.00 59 S 7.80 4.37 0.00 3.98 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 60 K 7.78 4.21 0.00 1.71 1.81 0.00 1.60 0.00 0.00 1.60 0.00 0.00 2.88 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.38 1.42 7.81 61 L 7.70 3.90 0.00 1.69 1.74 0.71 -0.03 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 62 S 8.22 4.20 0.00 3.88 3.92 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 63 P 0.00 4.27 0.00 2.08 2.13 0.00 3.84 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.06 0.00 64 K 7.84 4.11 0.00 2.09 2.05 0.00 1.23 0.00 0.00 1.47 0.00 0.00 2.97 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.64 1.51 7.81 65 A 8.72 4.11 1.73 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 0.00 0.00 66 K 8.29 3.97 0.00 2.03 1.95 0.00 1.70 0.00 0.00 1.67 0.00 0.00 2.95 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.47 1.53 7.81 67 K 7.84 4.10 0.00 2.04 1.92 0.00 1.70 0.00 0.00 1.68 0.00 0.00 2.97 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.51 1.68 7.81 68 I 8.34 3.99 1.87 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 1.32 0.91 0.84 0.00 0.00 69 Y 9.05 4.51 0.00 3.30 3.27 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 70 N 9.08 4.56 0.00 2.92 2.96 0.00 0.00 7.14 6.65 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 71 E 8.46 4.03 0.00 1.99 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 1.47 2.09 0.00 72 F 9.44 4.53 0.00 3.35 3.33 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 73 I 7.56 3.94 0.91 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 1.40 0.91 0.42 0.00 0.00 74 S 7.66 4.05 0.00 3.86 3.82 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 0.00 0.00 0.00 75 V 8.42 3.87 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 0.71 0.00 0.00 0.94 0.00 0.00 76 Q 8.00 4.35 0.00 2.02 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.76 0.00 0.00 0.00 0.00 0.00 2.31 2.28 0.00 77 A 8.17 4.00 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 78 T 8.38 4.06 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 79 K 7.02 4.57 0.00 2.03 1.78 0.00 1.60 0.00 0.00 1.63 0.00 0.00 2.52 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.12 1.07 7.81 80 E 8.02 4.13 0.00 1.86 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 2.42 2.49 0.00 81 V 7.59 4.37 1.83 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 0.75 0.00 0.00 0.79 0.00 0.00 82 N 8.61 4.57 0.00 2.70 2.87 0.00 0.00 5.88 7.91 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 83 L 8.07 4.71 0.00 1.51 1.49 0.64 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 84 D 8.32 4.61 0.00 2.67 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 85 S 8.50 4.17 0.00 3.86 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 86 C 7.96 4.18 0.00 2.98 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 87 T 7.79 3.82 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 1.19 0.00 0.00 88 R 7.65 3.91 0.00 1.79 1.94 0.00 3.09 0.00 0.00 3.09 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.78 0.00 89 E 7.85 4.04 0.00 2.17 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 2.36 2.49 0.00 90 E 8.65 3.91 0.00 2.06 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 2.25 2.32 0.00 91 T 7.78 3.68 4.46 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 0.65 0.00 0.00 92 S 8.22 3.91 0.00 4.04 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 0.00 93 R 8.01 3.93 0.00 2.00 1.99 0.00 3.11 0.00 0.00 3.16 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.82 0.00 94 N 8.04 4.44 0.00 2.78 2.80 0.00 0.00 6.85 7.62 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 95 M 7.36 4.06 0.00 1.82 2.06 0.00 0.00 0.00 0.00 0.00 2.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.71 0.00 96 L 7.62 4.28 0.00 1.73 1.71 0.94 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 97 E 7.88 4.60 0.00 1.89 1.83 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 2.23 2.25 0.00 98 P 0.00 4.44 0.00 2.12 2.18 0.00 3.64 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 2.07 2.13 0.00 99 T 8.30 4.78 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 1.29 0.00 0.00 100 I 8.37 3.97 1.89 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.76 0.94 0.00 0.00 101 T 7.49 5.00 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 1.23 0.00 0.00 102 C 8.12 3.80 0.00 3.07 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 0.00 103 F 7.77 4.36 0.00 2.56 2.85 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 0.00 104 D 7.58 4.39 0.00 2.80 2.72 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 0.00 105 E 8.16 3.95 0.00 2.01 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 0.00 2.37 2.37 0.00 106 A 7.85 4.02 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.42 4.21 0.00 2.23 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.08 6.60 0.00 0.00 0.00 0.00 0.00 2.24 2.67 0.00 108 K 8.16 3.95 0.00 1.86 2.00 0.00 1.68 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.47 1.50 7.81 109 K 7.94 4.07 0.00 2.01 1.86 0.00 1.74 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.65 1.63 7.81 110 I 7.97 3.83 2.34 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 1.84 1.15 1.12 0.00 0.00 111 F 9.11 3.91 0.00 3.24 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 0.00 112 N 8.75 4.34 0.00 2.83 2.89 0.00 0.00 7.08 6.39 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 0.00 113 L 8.55 3.94 0.00 1.81 1.84 0.95 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 114 M 8.36 4.18 0.00 2.37 2.42 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.61 0.00 115 E 8.30 3.68 0.00 1.77 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 2.12 1.75 0.00 116 K 8.38 4.19 0.00 1.81 1.86 0.00 1.71 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.47 1.61 7.81 117 D 7.88 4.85 0.00 3.07 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 0.00 118 S 8.86 4.42 0.00 4.41 4.41 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 0.00 119 Y 7.54 3.91 0.00 3.22 3.07 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 0.00 120 R 8.11 3.96 0.00 2.02 2.02 0.00 3.32 0.00 0.00 3.37 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.89 0.00 121 R 8.44 4.00 0.00 2.14 2.25 0.00 3.49 0.00 0.00 3.21 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 2.06 0.00 122 F 9.08 3.57 0.00 2.86 2.72 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 0.00 123 L 7.56 3.18 0.00 1.48 1.44 0.80 0.09 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 0.00 124 K 7.33 4.36 0.00 1.68 1.85 0.00 1.71 0.00 0.00 1.77 0.00 0.00 3.08 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.43 1.41 7.81 125 S 7.56 4.47 0.00 4.02 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 0.00 126 R 8.59 3.91 0.00 1.63 1.80 0.00 3.02 0.00 0.00 3.28 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.68 0.00 127 F 8.07 3.96 0.00 2.91 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 0.00 128 Y 8.01 4.07 0.00 3.22 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 0.00 129 L 7.78 4.18 0.00 1.83 1.73 0.99 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 130 D 8.34 4.46 0.00 2.71 2.67 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.01 4.16 0.00 1.42 1.57 1.16 1.03 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 0.00 132 T 7.99 4.27 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 -0.30 0.00 0.00 133 N 7.89 4.47 0.00 2.68 2.72 0.00 0.00 7.12 7.46 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