NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.3130 8.2644 123.5822 52.1096 20.0475 177.6476 3 R 3.8906 8.1219 122.2928 58.7967 30.3476 174.3926 4 R 4.0326 7.5500 116.4493 55.9456 31.5680 177.2124 5 R 4.4081 7.6130 118.6456 55.0735 32.5271 176.6200 6 R 4.1412 8.5333 116.8072 55.4357 29.5435 176.0046 7 A 3.6017 7.6446 114.0029 52.5703 15.6622 176.4816 8 E 3.9727 8.3984 119.0669 56.7865 30.1776 177.8842 9 V 3.4708 8.3880 122.9322 62.9890 31.8749 175.3113 10 R 3.8893 8.5279 127.3729 56.4104 29.8956 175.2484 11 Q 4.2855 8.5893 127.6876 55.0213 29.8590 174.7617 12 L 4.7467 8.1362 124.9601 53.5498 43.0229 175.6388 13 Q 4.1224 8.3636 121.1967 54.9887 29.6195 174.2095 14 P 4.4474 0.0000 0.0000 62.2631 32.3369 175.5340 15 D 4.6167 8.5578 118.7571 54.7026 41.8195 176.8799 16 L 4.2346 8.5661 123.2265 56.4486 42.3887 178.0184 17 V 4.0210 8.0938 115.1407 63.3777 31.9432 175.4759 18 Y 4.5464 7.7273 113.1926 57.1589 40.9035 175.6056 19 G 4.3236 8.5012 106.5466 46.0494 0.0000 172.4869 20 D 4.8916 7.9612 118.2758 51.3243 44.0594 176.4318 21 V 3.9572 8.6259 121.4899 63.9841 31.3697 177.9491 22 L 4.0127 8.0665 118.9651 58.7219 42.0848 178.9314 23 V 3.3429 7.8734 118.3036 65.4545 31.5462 177.6881 24 T 3.7956 7.9213 108.5640 65.1382 68.2412 175.5763 25 A 4.1683 8.0191 124.7427 54.1925 18.3589 179.1936 26 F 4.4043 8.2587 118.0051 60.2794 39.3221 177.1799 27 I 3.3535 7.5242 120.0924 64.3824 37.3675 177.7108 28 N 4.3504 7.8629 116.7566 55.2626 36.9045 177.0743 29 K 4.0565 7.4683 120.7421 59.3186 32.1806 178.8662 30 I 3.7774 6.6400 118.8437 63.2454 37.1537 176.4962 31 M 3.8259 7.2682 118.8338 56.2937 32.4611 175.5946 32 R 4.5391 8.4626 124.3720 55.5632 32.4155 175.6035 33 D 4.1555 9.6567 117.7373 55.0916 38.5581 173.9621 34 G 3.8816 8.1094 103.8665 46.9937 0.0000 175.7626 35 K 4.3952 7.6421 120.0857 53.8301 31.0387 177.1354 36 K 3.9440 8.0602 123.0891 59.9063 32.2259 176.5004 37 N 4.3831 7.9631 115.8999 55.5840 38.1306 176.6953 38 L 3.9913 7.9356 119.1570 58.3369 41.9326 179.6018 39 A 3.9065 8.0464 119.4514 55.0299 18.3418 179.4100 40 A 3.8279 8.0511 119.0863 55.5480 18.5137 179.2492 41 R 3.9733 8.7920 117.8625 60.0232 30.0036 178.1948 42 I 3.6803 8.9248 120.0672 64.7839 37.2509 178.1014 43 F 4.2468 7.8863 120.6550 61.5709 39.0281 176.7352 44 Y 3.9823 7.5751 116.1133 60.7353 37.6973 177.6340 45 D 4.3653 8.4875 120.0591 57.3089 40.9769 178.7029 46 A 4.0075 8.0882 121.3181 55.3895 18.1357 179.4684 47 C 3.9857 7.8920 115.2870 62.7476 28.1996 176.4100 48 K 4.0308 8.2753 120.4891 59.5909 31.4153 179.3531 49 I 4.3410 8.1723 121.4763 63.6567 36.9883 178.0349 50 I 3.8290 7.6169 121.4800 64.1083 36.7231 177.8992 51 Q 4.5605 7.7772 120.8476 58.4739 28.9835 179.0847 52 E 4.1077 8.0661 119.0294 59.5230 29.3719 179.4463 53 K 4.0595 7.5331 115.2090 57.3771 33.1332 177.2227 54 T 4.5890 7.9152 113.4711 60.1407 69.2631 174.4833 55 G 4.0504 8.6645 115.0062 46.0399 0.0000 173.2192 56 Q 4.6459 7.5831 118.4854 53.4924 31.0931 175.0780 57 E 4.3070 8.5250 118.5785 55.0703 30.7412 175.5857 58 P 4.2055 0.0000 0.0000 66.3419 30.9359 178.0165 59 L 3.8686 8.0527 119.1412 57.6379 41.9374 178.8839 60 K 3.9956 8.7445 120.0626 59.5295 32.2819 179.0823 61 V 3.6674 7.8615 117.9385 65.9000 31.2715 177.3602 62 F 4.1538 8.8818 121.3100 60.7770 39.2898 176.9437 63 K 3.6039 8.3745 117.9323 59.6670 31.9967 178.9604 64 Q 3.8453 7.9619 118.9269 59.0955 28.9231 177.9499 65 A 3.9205 7.8347 121.9470 55.3341 18.1923 180.0656 66 V 3.4073 7.2764 116.2077 64.7593 31.4290 177.8985 67 E 3.9736 7.9171 118.9576 58.5638 29.5003 177.9525 68 N 4.5169 7.7844 115.5140 54.5351 39.8730 175.9031 69 V 4.3456 7.3494 120.4448 62.2428 30.9613 176.3544 70 K 4.5701 7.3778 120.5219 52.6666 32.5301 171.4907 71 P 4.2989 0.0000 0.0000 62.8287 31.5812 177.3651 72 R 4.0644 8.8319 123.9082 59.1921 30.3101 175.9837 73 M 5.1456 7.5943 114.2646 54.2566 36.3561 173.9559 74 E 4.8049 8.8930 117.6266 55.2760 33.7974 174.2572 75 V 4.6022 8.3641 114.4099 60.8775 32.8524 175.7681 76 R 4.8042 9.1119 124.8780 54.2088 33.2623 175.5360 77 S 4.8711 8.8142 119.4786 58.6474 63.5462 173.5022 78 R 4.6446 9.1438 125.7034 54.4545 33.0028 174.4883 79 R 4.5846 8.3036 124.3080 55.3464 31.6867 177.0251 80 V 3.7812 8.6606 117.7419 61.4512 34.0350 174.5418 81 G 3.6520 8.9566 113.7215 46.1993 0.0000 173.9442 82 G 3.8269 8.2279 108.3895 44.9440 0.0000 174.1088 83 A 4.2039 7.2422 122.9421 51.2208 19.8208 175.8099 84 N 4.9492 8.5509 121.8458 52.4754 40.3059 173.8268 85 Y 4.9065 8.5459 123.7157 56.6599 41.2879 175.2673 86 Q 4.6164 8.6118 121.4740 54.7079 27.5159 174.3863 87 V 4.1009 8.6838 122.6554 62.0437 33.1427 172.9222 88 P 4.9904 0.0000 0.0000 62.8984 32.7084 175.2221 89 M 4.4477 8.3427 119.1184 54.7043 34.7977 173.3725 90 E 4.3080 8.7194 119.5145 56.7287 30.8016 176.9589 91 V 4.2655 7.9149 121.7902 60.0326 34.0536 175.7851 92 S 4.1747 8.6113 121.6177 57.8682 63.9995 172.8194 93 P 4.2212 0.0000 0.0000 66.3828 30.5147 179.0210 94 R 3.8631 7.9457 117.1746 58.5329 29.8275 178.8044 95 R 3.9285 7.6965 118.1286 58.9817 30.2666 177.7994 96 Q 3.8121 8.2957 118.4330 59.9206 28.7047 178.6176 97 Q 3.6397 8.1408 118.5623 60.0518 28.8916 179.0235 98 S 4.0139 7.9553 113.8163 61.7794 63.2488 176.8902 99 L 3.2429 7.7229 121.0258 58.1055 41.2724 178.8228 100 A 3.9697 7.4333 121.1069 54.6700 17.8525 179.1878 101 L 3.7879 8.2758 115.5196 57.8803 41.9853 180.2610 102 R 3.9793 7.8001 118.0994 59.4438 30.1169 178.7384 103 W 4.7613 8.4474 118.9682 59.8500 28.8958 177.9403 104 L 4.0576 8.1920 119.3992 58.0424 41.0599 179.1227 105 V 3.6754 8.2079 116.1369 67.0954 31.3349 178.4780 106 Q 3.7759 9.0482 116.3654 59.3545 28.4902 180.0338 107 A 4.0369 8.5481 122.3907 54.6856 18.7064 179.4387 108 A 4.2502 8.4147 120.2399 55.6171 18.3918 179.6195 109 N 4.3774 8.5321 113.2954 55.9256 38.6140 177.1932 110 Q 4.1580 7.5823 118.7706 57.2602 29.1958 176.8872 111 R 4.1475 7.3225 119.0241 55.4516 30.7414 175.1281 112 P 4.3586 0.0000 0.0000 65.3972 31.7342 176.8202 113 E 4.0428 8.0828 115.5143 56.5180 29.3295 176.6460 114 R 4.1521 8.0499 117.5200 58.5913 31.0846 177.0672 115 R 4.1144 7.7032 115.5970 55.5823 30.9288 177.6628 116 A 4.0433 8.8620 125.0270 55.2606 18.2726 179.2210 117 A 3.9658 8.0184 118.8409 55.5270 18.4820 180.1173 118 V 3.6331 7.9049 110.8290 64.2079 31.4103 179.1233 119 R 4.0073 7.7969 117.6486 59.4746 30.3186 178.7837 120 I 3.3544 8.1995 119.5155 64.4229 37.0332 178.2613 121 A 4.0260 8.1171 121.8910 55.3329 18.3007 179.1192 122 H 4.1326 8.2944 113.9739 59.2238 28.9520 177.1935 123 E 3.9091 9.1469 121.8778 59.6978 29.5403 178.6352 124 L 3.9613 8.0407 118.1168 58.5754 41.7202 179.6191 125 M 4.0999 8.1223 118.4566 58.4165 32.0337 178.3576 126 D 4.7285 8.9039 118.9437 56.7003 40.6347 178.7971 127 A 4.0707 8.0899 121.6341 54.8472 18.7692 179.2634 128 A 3.9173 7.6274 117.4776 55.1344 18.3778 179.4015 129 E 4.0327 8.3232 117.7395 60.8378 29.9504 176.4082 130 G 3.6331 7.3546 109.0732 45.8011 0.0000 174.9055 131 K 3.8556 8.4591 121.1322 58.8437 32.4720 177.1422 132 G 3.8970 8.5927 108.0392 45.8384 0.0000 174.6408 133 G 3.6237 8.6643 107.6943 47.0079 0.0000 176.0126 134 A 4.0662 8.0995 122.9601 55.2654 17.8526 179.8765 135 V 3.6053 7.6209 116.2875 65.9411 31.7687 178.3729 136 K 4.2407 7.9727 117.6915 59.1532 31.7635 179.2759 137 K 3.7222 7.5225 118.0186 59.0968 31.9245 179.2911 138 K 3.9545 7.4830 119.6635 59.3148 31.9687 178.7154 139 E 3.9627 9.3665 119.7642 59.2591 29.3512 178.8702 140 D 4.2223 7.8692 117.6522 57.4062 41.2099 178.3045 141 V 3.5969 7.6085 118.7469 66.2589 31.3688 177.8589 142 E 4.0169 8.1049 117.9749 59.0816 29.2735 179.4105 143 R 3.8774 7.6701 118.3205 59.7287 30.2449 178.6731 144 M 4.0572 8.1173 118.0583 58.5980 31.6982 178.9246 145 A 3.9509 7.4453 119.6494 55.3516 18.7765 179.0173 146 E 4.0067 8.1056 115.4944 60.0825 29.7275 178.9171 147 A 4.0359 8.5893 120.7523 55.5911 18.1178 178.9312 148 N 4.7352 8.2440 109.8725 53.4100 38.7692 177.5063 149 R 3.9355 8.0383 122.2811 58.5649 30.2921 177.1574 150 A 3.9848 7.6646 121.5032 55.8476 18.3116 178.4264 151 Y 4.0838 7.3984 112.0535 58.4587 37.8682 177.5056 152 A 4.1477 7.8054 125.1611 54.2171 18.6930 180.3841 153 H 4.1690 7.4616 110.9079 58.3948 28.4576 175.0799 154 Y 4.9878 7.0511 117.2182 57.9476 38.3061 177.9214 155 R 3.8457 8.1307 121.6843 58.0520 30.5511 177.2138 156 W 4.2458 7.7030 118.6540 56.8702 30.2304 174.1585 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 2 A 8.26 4.31 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 3 R 8.12 3.89 0.00 1.86 1.96 0.00 3.22 0.00 0.00 3.21 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.70 0.00 4 R 7.55 4.03 0.00 1.83 1.77 0.00 3.24 0.00 0.00 3.15 7.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.60 0.00 5 R 7.61 4.41 0.00 1.88 1.80 0.00 3.22 0.00 0.00 3.26 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.66 0.00 6 R 8.53 4.14 0.00 1.82 1.91 0.00 3.45 0.00 0.00 3.24 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.64 0.00 7 A 7.64 3.60 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 8 E 8.40 3.97 0.00 1.97 1.92 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 2.32 2.31 0.00 9 V 8.39 3.47 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 0.75 0.00 0.00 0.93 0.00 0.00 10 R 8.53 3.89 0.00 1.81 1.85 0.00 3.28 0.00 0.00 3.15 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.62 0.00 11 Q 8.59 4.29 0.00 2.03 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.59 0.00 0.00 0.00 0.00 0.00 2.32 2.41 0.00 12 L 8.14 4.75 0.00 1.77 1.62 0.94 0.57 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 13 Q 8.36 4.12 0.00 2.05 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 7.04 0.00 0.00 0.00 0.00 0.00 2.35 2.39 0.00 14 P 0.00 4.45 0.00 2.11 2.02 0.00 3.76 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.10 0.00 15 D 8.56 4.62 0.00 2.94 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 16 L 8.57 4.23 0.00 1.72 1.72 0.96 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 17 V 8.09 4.02 2.16 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 0.47 0.00 0.00 0.60 0.00 0.00 18 Y 7.73 4.55 0.00 3.29 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 G 8.50 4.32 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 0.00 20 D 7.96 4.89 0.00 2.74 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 V 8.63 3.96 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 1.25 0.00 0.00 0.96 0.00 0.00 22 L 8.07 4.01 0.00 1.71 1.99 0.92 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 23 V 7.87 3.34 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 0.83 0.00 0.00 0.71 0.00 0.00 24 T 7.92 3.80 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 1.31 0.00 0.00 25 A 8.02 4.17 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 26 F 8.26 4.40 0.00 3.20 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 27 I 7.52 3.35 1.84 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.48 0.80 0.00 0.00 28 N 7.86 4.35 0.00 2.87 3.03 0.00 0.00 6.12 7.20 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 29 K 7.47 4.06 0.00 1.72 1.87 0.00 1.72 0.00 0.00 1.68 0.00 0.00 3.00 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.54 1.64 7.81 30 I 6.64 3.78 1.73 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.25 0.78 0.00 0.00 31 M 7.27 3.83 0.00 2.06 1.96 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 2.55 2.52 0.00 32 R 8.46 4.54 0.00 1.89 1.79 0.00 3.32 0.00 0.00 3.33 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.70 0.00 33 D 9.66 4.16 0.00 2.78 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 34 G 8.11 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 0.00 0.00 0.00 35 K 7.64 4.40 0.00 1.83 1.75 0.00 1.69 0.00 0.00 1.57 0.00 0.00 2.89 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.37 1.52 7.81 36 K 8.06 3.94 0.00 1.81 1.83 0.00 1.74 0.00 0.00 1.84 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.53 1.55 7.81 37 N 7.96 4.38 0.00 2.83 2.79 0.00 0.00 6.82 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 38 L 7.94 3.99 0.00 1.72 1.75 0.93 0.81 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 39 A 8.05 3.91 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 40 A 8.05 3.83 1.59 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 41 R 8.79 3.97 0.00 2.03 2.14 0.00 3.16 0.00 0.00 3.20 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.76 0.00 42 I 8.92 3.68 1.89 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 1.42 0.61 0.95 0.00 0.00 43 F 7.89 4.25 0.00 2.79 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 Y 7.58 3.98 0.00 3.31 2.91 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 45 D 8.49 4.37 0.00 2.89 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 46 A 8.09 4.01 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 47 C 7.89 3.99 0.00 3.09 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 48 K 8.28 4.03 0.00 2.00 1.85 0.00 1.70 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.81 1.64 7.81 49 I 8.17 4.34 1.83 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 2.50 0.86 0.00 0.00 50 I 7.62 3.83 2.06 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 1.75 0.81 0.99 0.00 0.00 51 Q 7.78 4.56 0.00 2.02 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.92 0.00 0.00 0.00 0.00 0.00 2.43 2.49 0.00 52 E 8.07 4.11 0.00 2.20 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 2.34 2.58 0.00 53 K 7.53 4.06 0.00 1.79 1.88 0.00 1.71 0.00 0.00 1.65 0.00 0.00 3.00 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.67 1.61 7.81 54 T 7.92 4.59 4.26 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 1.28 0.00 0.00 55 G 8.66 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 56 Q 7.58 4.65 0.00 2.10 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.78 0.00 0.00 0.00 0.00 0.00 2.33 2.43 0.00 57 E 8.52 4.31 0.00 2.21 2.15 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 2.41 2.30 0.00 58 P 0.00 4.21 0.00 2.13 2.33 0.00 3.77 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.25 0.00 59 L 8.05 3.87 0.00 1.88 1.86 0.92 0.72 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 60 K 8.74 4.00 0.00 1.92 1.93 0.00 1.62 0.00 0.00 1.61 0.00 0.00 3.02 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.46 1.51 7.81 61 V 7.86 3.67 2.28 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 1.04 0.00 0.00 0.96 0.00 0.00 62 F 8.88 4.15 0.00 3.23 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 63 K 8.37 3.60 0.00 2.05 1.85 0.00 1.85 0.00 0.00 1.90 0.00 0.00 3.19 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.50 1.52 7.81 64 Q 7.96 3.85 0.00 2.33 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.77 0.00 0.00 0.00 0.00 0.00 2.35 2.40 0.00 65 A 7.83 3.92 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 66 V 7.28 3.41 1.37 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 0.50 0.00 0.00 0.54 0.00 0.00 67 E 7.92 3.97 0.00 2.04 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 2.28 2.34 0.00 68 N 7.78 4.52 0.00 2.67 2.84 0.00 0.00 6.83 8.83 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 69 V 7.35 4.35 2.13 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 1.28 0.00 0.00 1.02 0.00 0.00 70 K 7.38 4.57 0.00 1.80 1.75 0.00 1.90 0.00 0.00 1.72 0.00 0.00 3.29 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.40 1.29 7.81 71 P 0.00 4.30 0.00 2.33 2.41 0.00 3.69 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 1.92 1.90 0.00 72 R 8.83 4.06 0.00 1.95 2.00 0.00 3.25 0.00 0.00 3.21 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.59 0.00 73 M 7.59 5.15 0.00 1.90 1.89 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.60 0.00 74 E 8.89 4.80 0.00 2.09 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 2.22 2.33 0.00 75 V 8.36 4.60 2.16 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 0.85 0.00 0.00 0.98 0.00 0.00 76 R 9.11 4.80 0.00 1.86 1.94 0.00 3.16 0.00 0.00 3.22 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.61 0.00 77 S 8.81 4.87 0.00 3.79 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 R 9.14 4.64 0.00 2.01 1.81 0.00 2.98 0.00 0.00 3.21 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.36 0.00 79 R 8.30 4.58 0.00 1.58 1.67 0.00 3.30 0.00 0.00 3.11 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.49 0.00 80 V 8.66 3.78 1.68 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 0.24 0.00 0.00 0.02 0.00 0.00 81 G 8.96 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 82 G 8.23 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 A 7.24 4.20 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 0.00 0.00 0.00 0.00 0.00 84 N 8.55 4.95 0.00 2.64 2.67 0.00 0.00 7.08 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 Y 8.55 4.91 0.00 2.86 2.56 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.61 4.62 0.00 2.08 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.70 6.93 0.00 0.00 0.00 0.00 0.00 2.40 2.37 0.00 87 V 8.68 4.10 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 1.17 0.00 0.00 1.27 0.00 0.00 88 P 0.00 4.99 0.00 2.11 2.18 0.00 3.94 0.00 0.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.16 0.00 89 M 8.34 4.45 0.00 1.91 1.95 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.30 0.00 90 E 8.72 4.31 0.00 1.87 1.78 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 2.23 2.32 0.00 91 V 7.91 4.27 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 0.82 0.00 0.00 0.91 0.00 0.00 92 S 8.61 4.17 0.00 3.90 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 93 P 0.00 4.22 0.00 2.27 2.27 0.00 3.72 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.04 0.00 94 R 7.95 3.86 0.00 1.85 2.00 0.00 3.11 0.00 0.00 3.25 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.67 0.00 95 R 7.70 3.93 0.00 1.83 2.04 0.00 3.19 0.00 0.00 3.32 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.63 0.00 96 Q 8.30 3.81 0.00 2.15 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.42 0.00 0.00 0.00 0.00 0.00 2.33 2.49 0.00 97 Q 8.14 3.64 0.00 2.19 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.73 0.00 0.00 0.00 0.00 0.00 2.33 2.43 0.00 98 S 7.96 4.01 0.00 3.88 3.83 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 99 L 7.72 3.24 0.00 0.83 0.13 0.76 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 100 A 7.43 3.97 1.21 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 0.00 0.00 101 L 8.28 3.79 0.00 1.68 1.90 0.90 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 102 R 7.80 3.98 0.00 1.93 1.93 0.00 3.18 0.00 0.00 3.24 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.71 0.00 103 W 8.45 4.76 0.00 3.51 3.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 L 8.19 4.06 0.00 2.02 1.82 0.88 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 105 V 8.21 3.68 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 0.91 0.00 0.00 1.16 0.00 0.00 106 Q 9.05 3.78 0.00 2.40 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.58 0.00 0.00 0.00 0.00 0.00 2.67 2.91 0.00 107 A 8.55 4.04 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 0.00 108 A 8.41 4.25 1.49 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 0.00 0.00 0.00 0.00 0.00 0.00 109 N 8.53 4.38 0.00 2.82 2.92 0.00 0.00 7.17 7.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 Q 7.58 4.16 0.00 2.13 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.89 0.00 0.00 0.00 0.00 0.00 2.53 2.54 0.00 111 R 7.32 4.15 0.00 2.02 2.15 0.00 3.22 0.00 0.00 3.44 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.79 0.00 112 P 0.00 4.36 0.00 2.18 2.18 0.00 3.80 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.95 0.00 113 E 8.08 4.04 0.00 2.13 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 2.33 2.38 0.00 114 R 8.05 4.15 0.00 1.84 1.97 0.00 3.21 0.00 0.00 3.23 7.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.66 0.00 115 R 7.70 4.11 0.00 1.86 1.88 0.00 3.32 0.00 0.00 3.35 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.58 0.00 116 A 8.86 4.04 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 0.00 117 A 8.02 3.97 1.40 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 0.00 0.00 0.00 0.00 0.00 0.00 118 V 7.90 3.63 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 1.03 0.00 0.00 119 R 7.80 4.01 0.00 2.05 2.15 0.00 3.29 0.00 0.00 3.58 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.93 0.00 120 I 8.20 3.35 2.00 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 1.59 1.17 1.32 0.00 0.00 121 A 8.12 4.03 1.40 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 0.00 0.00 0.00 0.00 0.00 0.00 122 H 8.29 4.13 0.00 3.38 3.39 0.00 5.66 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 0.00 123 E 9.15 3.91 0.00 2.13 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 2.58 2.47 0.00 124 L 8.04 3.96 0.00 2.14 1.81 1.35 0.93 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 0.00 125 M 8.12 4.10 0.00 2.11 2.31 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.91 2.61 0.00 126 D 8.90 4.73 0.00 2.79 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 0.00 127 A 8.09 4.07 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 0.00 128 A 7.63 3.92 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 0.00 129 E 8.32 4.03 0.00 2.03 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 2.32 2.47 0.00 130 G 7.35 3.63 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 0.00 0.00 0.00 131 K 8.46 3.86 0.00 2.11 1.90 0.00 1.80 0.00 0.00 1.71 0.00 0.00 3.04 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.43 1.46 7.81 132 G 8.59 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 G 8.66 3.62 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 0.00 0.00 0.00 134 A 8.10 4.07 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 V 7.62 3.61 2.16 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 1.03 0.00 0.00 0.99 0.00 0.00 136 K 7.97 4.24 0.00 1.96 1.80 0.00 1.69 0.00 0.00 1.79 0.00 0.00 2.91 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.50 1.51 7.81 137 K 7.52 3.72 0.00 1.40 1.14 0.00 1.54 0.00 0.00 1.27 0.00 0.00 2.60 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.24 1.57 7.81 138 K 7.48 3.95 0.00 2.15 2.01 0.00 1.74 0.00 0.00 1.80 0.00 0.00 3.06 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.56 1.87 7.81 139 E 9.37 3.96 0.00 2.21 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 2.32 2.48 0.00 140 D 7.87 4.22 0.00 2.88 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 0.00 141 V 7.61 3.60 2.13 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 1.09 0.00 0.00 0.87 0.00 0.00 142 E 8.10 4.02 0.00 2.17 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 2.35 2.39 0.00 143 R 7.67 3.88 0.00 1.97 1.96 0.00 3.13 0.00 0.00 3.15 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.88 0.00 144 M 8.12 4.06 0.00 2.05 2.32 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 2.62 2.82 0.00 145 A 7.45 3.95 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 0.00 146 E 8.11 4.01 0.00 2.16 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 2.34 2.47 0.00 147 A 8.59 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 0.00 148 N 8.24 4.74 0.00 2.88 2.91 0.00 0.00 6.81 8.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 R 8.04 3.94 0.00 1.84 1.96 0.00 3.47 0.00 0.00 3.19 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.61 0.00 150 A 7.66 3.98 0.97 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 0.00 151 Y 7.40 4.08 0.00 3.00 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 0.00 152 A 7.81 4.15 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 0.00 153 H 7.46 4.17 0.00 3.04 3.33 0.00 5.52 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 Y 7.05 4.99 0.00 3.34 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 0.00 155 R 8.13 3.85 0.00 1.86 1.96 0.00 3.22 0.00 0.00 3.25 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.89 0.00 156 W 7.70 4.25 0.00 3.63 3.19 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