NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1C H 4.8546 8.4449 117.8452 56.2561 30.0053 172.9135 1D H 4.4711 8.8141 118.9144 55.8365 29.7276 172.9431 1E H 5.0932 7.5990 115.2460 53.6287 33.5788 171.8973 1F H 4.6846 8.8842 116.9023 55.8306 29.1020 174.3379 1G F 4.9219 8.3590 119.4420 57.8517 39.8465 174.0364 2 N 4.6391 8.5019 117.2223 52.4139 39.1702 174.5518 3 L 4.7854 8.0855 123.2657 52.0929 43.9576 174.6257 4 P 4.6158 0.0000 0.0000 61.5311 32.9969 175.2889 5 P 4.4379 0.0000 0.0000 63.0789 31.8405 175.9023 6 G 3.9389 8.7264 109.2509 45.0491 0.0000 171.6094 7 N 4.3681 7.9140 114.2186 51.8009 39.8814 174.2536 8 Y 4.8111 8.0780 116.9446 58.2411 38.6127 176.8620 9 K 4.1528 8.5912 122.2417 58.6699 32.2289 177.2730 10 K 4.7278 7.5923 115.2590 53.2569 35.5152 173.7533 11 P 4.7261 0.0000 0.0000 63.1629 32.3157 175.2117 12 K 4.9109 9.4298 119.2022 55.0626 37.4395 174.9711 13 L 4.9890 9.0103 121.5733 53.3785 44.2773 176.2483 14 L 5.0122 8.6278 123.5149 53.6339 42.7302 174.1742 15 Y 4.8105 9.2340 126.5175 56.7957 40.5249 173.4885 16 C 4.3595 8.3513 128.3984 57.4685 32.6095 174.2350 17 S 4.1368 7.9532 120.9896 59.4607 63.0816 175.0895 18 N 4.2316 7.7966 120.2089 56.3748 38.7300 175.5513 19 G 3.8949 7.5363 101.7664 44.4393 0.0000 172.9841 20 G 3.3226 7.9123 107.5017 45.9369 0.0000 173.2409 21 H 4.6678 7.3409 115.7326 54.3257 31.1004 174.1277 22 F 5.3096 8.8380 120.4911 55.9695 40.6942 175.2693 23 L 4.4654 9.0127 125.7509 55.3118 43.3759 175.6044 24 R 4.9627 9.2988 126.1558 54.6571 33.4641 173.7598 25 I 4.6780 8.2624 127.4711 59.4891 38.4409 175.5304 26 N 4.4587 8.8919 125.7894 51.8953 39.1084 175.0760 27 P 4.1431 0.0000 0.0000 65.7990 31.2234 177.2729 28 A 4.0581 7.8313 119.5891 53.1074 18.6055 177.9210 29 G 4.2177 8.6442 105.8566 44.7423 0.0000 173.9779 30 T 4.5506 7.5374 109.7975 60.9119 70.0622 173.6871 31 V 4.9219 7.9080 121.3471 61.3456 34.7877 174.4975 32 D 4.5938 8.6134 124.9073 52.9833 42.5499 174.0761 33 G 4.5930 8.6397 104.7443 45.4826 0.0000 172.3209 34 T 4.9801 8.7443 114.2589 60.6856 71.0884 174.5371 35 R 4.2445 8.7987 124.5715 56.3185 30.9698 176.2067 36 D 4.6127 8.2525 119.7083 53.3142 40.3740 176.7051 37 R 3.7488 8.6556 127.8889 58.1986 30.2798 177.0699 38 S 4.4162 8.2916 110.8890 58.6792 63.6726 174.0757 39 D 4.3818 7.6806 121.7786 55.0397 41.2954 175.7451 40 Q 4.4742 8.4008 122.7446 55.8013 29.2046 175.7419 41 H 4.8982 9.2295 115.6245 55.4672 29.1639 175.2211 42 I 4.5730 7.4711 110.9220 59.9084 38.5500 175.2112 43 Q 4.2715 7.8201 121.9967 55.6042 29.7624 174.7144 44 L 5.0210 8.9401 124.4029 52.8056 45.6684 175.2654 45 Q 4.7745 9.2192 124.4875 54.5386 30.7974 174.3931 46 L 5.3173 8.6339 126.3503 53.5817 44.1637 175.9997 47 S 4.4132 8.5360 114.8419 56.6604 66.8957 172.6165 48 A 4.4213 7.8275 124.0923 51.1091 18.8475 176.8513 49 E 3.9967 8.8630 124.7197 58.2098 30.3350 176.3098 50 S 4.6345 7.3641 112.2430 56.3118 67.1815 173.1832 51 V 3.7686 8.3259 121.8491 64.7526 31.5093 176.4337 52 G 3.9256 9.1925 114.6269 45.3946 0.0000 171.7256 53 E 5.1626 8.4990 120.2922 54.5316 32.2931 175.6542 54 V 4.8929 9.1903 117.0546 59.8341 36.4689 174.1296 55 Y 5.5524 8.5598 119.5545 56.7172 41.1507 175.2350 56 I 4.6785 8.5030 121.8231 59.5918 40.7557 174.1770 57 K 4.7637 8.7704 128.7402 54.0268 35.5837 175.1030 58 S 4.6529 8.8874 122.7883 58.6511 62.7138 174.9182 59 T 3.9343 8.5168 117.9774 64.1376 68.8497 175.9085 60 E 4.0738 8.3453 122.9275 58.3725 29.8713 176.9565 61 T 4.3560 8.0207 105.8971 60.5939 70.2005 175.2442 62 G 3.8277 8.2382 110.0866 45.3770 0.0000 173.7552 63 Q 4.4281 7.5788 119.1548 56.0043 30.2516 174.6584 64 Y 4.6693 9.0164 120.7022 56.3336 40.0388 175.0755 65 L 4.4742 9.0512 126.4958 55.4220 43.5294 175.5410 66 A 5.1657 8.6522 125.7386 50.9013 23.2780 174.3908 67 M 5.4266 8.7193 119.3518 53.8500 34.7554 175.6853 68 D 5.2372 9.3780 126.4317 52.5245 41.0616 176.9653 69 T 4.0223 8.5604 112.9246 64.7044 67.2500 174.0252 70 D 4.8007 8.5865 118.8949 54.0151 41.2711 176.9117 71 G 3.3540 8.7413 108.1711 45.1183 0.0000 173.1118 72 L 4.7920 8.3364 120.4448 52.9117 43.0521 176.0093 73 L 4.9826 8.3772 123.3814 55.1439 42.6464 175.6267 74 Y 5.0107 9.2312 120.3432 55.8655 42.2992 173.5347 75 G 4.3335 8.9198 107.9869 44.8726 0.0000 173.1556 76 S 5.0617 9.0151 120.8990 56.7574 64.0402 175.3123 77 Q 4.3096 9.0165 125.5953 58.1174 28.9846 176.4349 78 T 4.6454 7.4697 106.0598 58.5111 71.7549 171.6360 79 P 3.5021 0.0000 0.0000 62.3196 32.1214 175.1584 80 N 4.9309 7.9142 117.2448 51.4618 40.2756 174.5891 81 E 3.9889 8.6997 116.6224 59.2505 29.6688 178.0565 82 E 4.2027 8.8439 117.5775 57.3521 29.7885 177.3318 83 C 5.0128 7.8547 115.2372 58.9776 29.1406 173.3356 84 L 4.7659 7.3474 121.0217 53.5818 43.1847 175.5817 85 F 5.2136 9.0131 121.3317 55.5871 43.4634 174.3327 86 L 4.8642 9.3501 123.3858 53.9032 42.5871 175.4578 87 E 4.6063 8.9014 126.8310 55.2835 30.2553 175.6926 88 R 4.8133 8.6260 125.2171 54.1041 34.9698 174.4323 89 L 4.7640 8.6746 123.6841 55.1595 43.1147 175.7768 90 E 4.7217 9.2150 124.9293 55.2296 33.6620 174.8335 91 E 3.9942 9.6926 123.4376 57.9027 27.2839 174.1934 92 N 4.3211 8.4881 110.4242 54.0685 36.6058 173.9978 93 H 4.8103 8.5293 117.0585 57.4519 37.5740 173.4359 94 Y 4.7109 7.8017 116.1047 57.3180 40.2229 173.8039 95 N 5.5653 9.4233 118.6230 51.9585 41.0946 174.5576 96 T 5.2696 8.7530 112.8123 60.1544 72.9936 172.6676 97 Y 5.0158 8.6007 118.8050 56.6642 41.6625 174.1546 98 I 4.5490 8.5409 125.9799 59.1492 39.5843 175.4362 99 S 3.9603 8.9693 122.5189 58.4825 62.4125 173.9801 100 K 3.9610 8.7211 129.4890 59.3224 32.2841 178.6936 101 K 3.7877 7.9208 118.4446 59.0140 32.2764 176.7377 102 H 4.5944 7.8550 114.8528 55.0510 29.3519 176.1962 103 A 3.9165 7.6177 125.9725 55.1120 18.2816 180.7417 104 E 3.7220 7.8391 112.4134 58.3621 29.7562 177.6306 105 K 4.1999 7.6374 117.4419 55.3467 32.8910 175.7226 106 N 3.9663 7.5909 115.6537 54.0318 36.3877 174.8913 107 W 5.0269 7.6489 117.7056 55.7449 31.0514 177.5502 108 F 5.3769 9.2511 124.1708 55.5961 40.8968 175.7476 109 V 4.0288 8.9645 121.4685 62.9314 32.4816 175.2090 110 G 4.4153 8.6369 112.7730 45.2354 0.0000 171.4246 111 L 5.2657 8.5215 121.6311 52.5100 45.1850 177.0825 112 K 4.1500 8.9482 123.1077 55.3510 33.0063 178.3977 113 K 3.9492 8.4069 119.5417 59.3023 31.9648 177.9237 114 N 4.5938 8.0740 114.1230 52.6400 37.5756 175.9768 115 G 3.5475 8.1565 109.0628 45.0893 0.0000 173.6632 116 S 4.7138 7.9749 114.9621 57.7012 64.7821 173.8646 117 C 4.8092 8.4883 119.1632 59.7572 28.8707 173.4142 118 K 4.3493 8.6298 121.5155 55.6413 33.0956 176.9022 119 R 4.1767 8.4838 123.3336 55.4507 31.2175 177.1593 120 G 3.3019 8.4061 115.4507 48.2357 0.0000 174.1183 121 P 4.1916 0.0000 0.0000 64.4859 31.3553 177.4984 122 R 4.2828 7.9249 115.7496 56.4767 30.4076 176.3323 123 T 5.1188 7.6040 108.3632 59.8764 70.7909 173.3001 124 H 4.7118 7.8337 115.2693 55.0123 30.4475 173.1017 125 Y 3.9425 8.7757 118.2572 59.9471 38.0656 177.1435 126 G 4.0708 9.0128 111.4380 45.4657 0.0000 173.9761 127 Q 4.2279 7.4348 118.9400 55.2156 29.8352 177.1730 128 K 3.8521 8.3049 119.0932 58.6307 32.8372 179.4635 129 A 4.0071 8.0229 121.2787 53.9658 18.3807 178.5097 130 I 4.4318 7.1902 106.0702 60.5684 38.3244 175.3241 131 L 4.3747 7.2655 122.8838 54.0036 42.5206 175.8332 132 F 5.2054 9.4088 122.4619 55.6193 43.4760 174.4163 133 L 5.2927 9.3888 120.4209 52.4153 45.3056 174.1646 134 P 5.1203 0.0000 0.0000 62.7669 32.0417 175.6794 135 L 4.8768 9.2162 125.0886 51.9497 44.6460 174.5637 136 P 4.6328 0.0000 0.0000 62.6119 32.3097 177.0824 137 V 3.7540 8.1742 114.4952 61.7821 31.6189 176.3169 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 1C H 8.44 4.85 0.00 3.11 3.43 0.00 5.67 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1D H 8.81 4.47 0.00 3.20 3.21 0.00 5.64 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1E H 7.60 5.09 0.00 3.16 3.33 0.00 5.70 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 1F H 8.88 4.68 0.00 3.34 3.41 0.00 5.66 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 1G F 8.36 4.92 0.00 2.87 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 2 N 8.50 4.64 0.00 2.95 2.79 0.00 0.00 6.87 6.74 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 3 L 8.09 4.79 0.00 1.47 1.41 0.57 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 4 P 0.00 4.62 0.00 2.17 2.09 0.00 3.68 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.90 0.00 5 P 0.00 4.44 0.00 2.16 1.99 0.00 3.84 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.92 0.00 6 G 8.73 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 0.00 0.00 0.00 7 N 7.91 4.37 0.00 2.61 2.64 0.00 0.00 5.88 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 8 Y 8.08 4.81 0.00 3.02 3.20 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 0.00 9 K 8.59 4.15 0.00 1.86 1.89 0.00 1.65 0.00 0.00 1.71 0.00 0.00 3.11 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.50 1.51 7.81 10 K 7.59 4.73 0.00 1.70 1.68 0.00 1.75 0.00 0.00 1.76 0.00 0.00 3.02 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.33 1.38 7.81 11 P 0.00 4.73 0.00 2.05 2.04 0.00 3.71 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.98 0.00 12 K 9.43 4.91 0.00 1.63 1.82 0.00 1.68 0.00 0.00 1.67 0.00 0.00 2.82 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.53 1.60 7.81 13 L 9.01 4.99 0.00 1.66 1.55 0.56 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 14 L 8.63 5.01 0.00 1.57 1.57 0.32 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 15 Y 9.23 4.81 0.00 3.35 3.17 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 16 C 8.35 4.36 0.00 2.39 2.44 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 0.00 17 S 7.95 4.14 0.00 4.03 4.18 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 18 N 7.80 4.23 0.00 2.54 2.63 0.00 0.00 6.77 7.98 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 19 G 7.54 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 G 7.91 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 0.00 0.00 0.00 21 H 7.34 4.67 0.00 3.01 3.23 0.00 5.80 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 F 8.84 5.31 0.00 3.06 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 23 L 9.01 4.47 0.00 1.83 1.52 0.92 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 24 R 9.30 4.96 0.00 1.92 2.04 0.00 3.20 0.00 0.00 3.35 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.80 0.00 25 I 8.26 4.68 1.84 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.71 0.88 0.00 0.00 26 N 8.89 4.46 0.00 2.85 2.68 0.00 0.00 6.43 7.60 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 27 P 0.00 4.14 0.00 2.14 2.15 0.00 3.56 0.00 0.00 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.89 0.00 28 A 7.83 4.06 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 29 G 8.64 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 0.00 0.00 0.00 30 T 7.54 4.55 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 1.23 0.00 0.00 31 V 7.91 4.92 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 0.91 0.00 0.00 0.93 0.00 0.00 32 D 8.61 4.59 0.00 2.86 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 33 G 8.64 4.59 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 34 T 8.74 4.98 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 1.37 0.00 0.00 35 R 8.80 4.24 0.00 1.85 1.96 0.00 3.17 0.00 0.00 3.06 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.34 0.00 36 D 8.25 4.61 0.00 2.84 2.65 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 37 R 8.66 3.75 0.00 1.90 1.92 0.00 3.36 0.00 0.00 3.10 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 1.51 0.00 38 S 8.29 4.42 0.00 3.99 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 39 D 7.68 4.38 0.00 2.80 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 40 Q 8.40 4.47 0.00 1.88 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 7.09 0.00 0.00 0.00 0.00 0.00 2.26 2.21 0.00 41 H 9.23 4.90 0.00 3.31 3.46 0.00 5.77 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 I 7.47 4.57 1.88 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.18 1.05 0.00 0.00 43 Q 7.82 4.27 0.00 2.02 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.06 6.89 0.00 0.00 0.00 0.00 0.00 2.38 2.37 0.00 44 L 8.94 5.02 0.00 1.48 1.42 0.82 0.81 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 45 Q 9.22 4.77 0.00 2.08 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.75 0.00 0.00 0.00 0.00 0.00 2.26 2.37 0.00 46 L 8.63 5.32 0.00 1.82 1.69 0.93 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 47 S 8.54 4.41 0.00 3.82 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 48 A 7.83 4.42 1.05 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 49 E 8.86 4.00 0.00 1.32 1.66 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 2.04 2.18 0.00 50 S 7.36 4.63 0.00 4.03 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 51 V 8.33 3.77 2.30 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 0.95 0.00 0.00 1.02 0.00 0.00 52 G 9.19 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 53 E 8.50 5.16 0.00 2.00 1.75 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 2.22 2.28 0.00 54 V 9.19 4.89 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 0.75 0.00 0.00 1.25 0.00 0.00 55 Y 8.56 5.55 0.00 3.01 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 56 I 8.50 4.68 1.71 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.59 0.67 0.00 0.00 57 K 8.77 4.76 0.00 1.30 1.35 0.00 1.37 0.00 0.00 1.22 0.00 0.00 2.13 0.00 0.00 2.42 0.00 0.00 0.00 0.00 0.99 0.63 7.81 58 S 8.89 4.65 0.00 3.85 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 59 T 8.52 3.93 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 60 E 8.35 4.07 0.00 1.97 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 2.19 2.36 0.00 61 T 8.02 4.36 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 62 G 8.24 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 63 Q 7.58 4.43 0.00 1.95 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.87 6.79 0.00 0.00 0.00 0.00 0.00 2.40 2.34 0.00 64 Y 9.02 4.67 0.00 2.78 2.78 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 65 L 9.05 4.47 0.00 1.58 1.47 0.80 0.27 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 66 A 8.65 5.17 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 M 8.72 5.43 0.00 2.26 2.27 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.70 0.00 68 D 9.38 5.24 0.00 2.92 2.81 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 69 T 8.56 4.02 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 1.27 0.00 0.00 70 D 8.59 4.80 0.00 2.69 2.61 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 0.00 0.00 0.00 0.00 71 G 8.74 3.35 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 0.00 72 L 8.34 4.79 0.00 1.96 1.62 0.91 0.84 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 73 L 8.38 4.98 0.00 1.57 1.62 0.91 0.95 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 74 Y 9.23 5.01 0.00 2.95 3.02 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 75 G 8.92 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 76 S 9.02 5.06 0.00 3.73 3.69 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 77 Q 9.02 4.31 0.00 2.13 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.54 0.00 0.00 0.00 0.00 0.00 2.42 2.33 0.00 78 T 7.47 4.65 4.14 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 1.21 0.00 0.00 79 P 0.00 3.50 0.00 1.48 0.49 0.00 3.46 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 1.66 1.54 0.00 80 N 7.91 4.93 0.00 2.89 2.89 0.00 0.00 6.26 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 E 8.70 3.99 0.00 1.95 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 2.29 2.32 0.00 82 E 8.84 4.20 0.00 2.26 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.34 0.00 83 C 7.85 5.01 0.00 3.15 3.10 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 0.00 0.00 0.00 0.00 84 L 7.35 4.77 0.00 1.44 1.43 0.81 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 85 F 9.01 5.21 0.00 3.10 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 86 L 9.35 4.86 0.00 1.53 1.62 0.89 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 87 E 8.90 4.61 0.00 2.17 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 2.19 1.98 0.00 88 R 8.63 4.81 0.00 1.77 1.80 0.00 3.14 0.00 0.00 2.88 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.64 0.00 89 L 8.67 4.76 0.00 1.58 1.61 0.93 0.74 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 90 E 9.21 4.72 0.00 2.21 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.44 0.00 91 E 9.69 3.99 0.00 2.45 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 0.00 2.30 2.40 0.00 92 N 8.49 4.32 0.00 2.84 2.89 0.00 0.00 6.88 8.16 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 93 H 8.53 4.81 0.00 2.83 2.89 0.00 5.94 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 Y 7.80 4.71 0.00 3.09 3.02 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 95 N 9.42 5.57 0.00 2.89 2.53 0.00 0.00 6.94 6.59 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 96 T 8.75 5.27 4.56 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 1.38 0.00 0.00 97 Y 8.60 5.02 0.00 2.79 2.80 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 98 I 8.54 4.55 1.65 0.00 0.00 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.52 0.58 0.00 0.00 99 S 8.97 3.96 0.00 4.06 4.06 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 0.00 0.00 0.00 100 K 8.72 3.96 0.00 1.72 1.70 0.00 1.63 0.00 0.00 1.49 0.00 0.00 2.80 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.34 1.32 7.81 101 K 7.92 3.79 0.00 1.58 1.64 0.00 1.52 0.00 0.00 1.60 0.00 0.00 2.99 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.24 1.07 7.81 102 H 7.86 4.59 0.00 3.00 2.08 0.00 5.68 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 A 7.62 3.92 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 0.00 104 E 7.84 3.72 0.00 1.81 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 0.00 2.09 2.14 0.00 105 K 7.64 4.20 0.00 0.94 1.64 0.00 1.58 0.00 0.00 1.49 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.21 1.00 7.81 106 N 7.59 3.97 0.00 3.08 3.09 0.00 0.00 6.87 7.79 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 0.00 107 W 7.65 5.03 0.00 3.25 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 F 9.25 5.38 0.00 2.88 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 0.00 109 V 8.96 4.03 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 0.66 0.00 0.00 0.52 0.00 0.00 110 G 8.64 4.42 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 0.00 111 L 8.52 5.27 0.00 1.45 1.43 1.01 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 112 K 8.95 4.15 0.00 1.94 1.67 0.00 1.62 0.00 0.00 1.60 0.00 0.00 2.89 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.39 1.35 7.81 113 K 8.41 3.95 0.00 1.70 1.84 0.00 1.69 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.56 1.44 7.81 114 N 8.07 4.59 0.00 2.78 2.88 0.00 0.00 6.21 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 G 8.16 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 0.00 0.00 0.00 116 S 7.97 4.71 0.00 3.90 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 0.00 117 C 8.49 4.81 0.00 2.88 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 0.00 118 K 8.63 4.35 0.00 1.61 1.68 0.00 1.62 0.00 0.00 1.56 0.00 0.00 3.03 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.40 1.33 7.81 119 R 8.48 4.18 0.00 1.73 1.62 0.00 3.20 0.00 0.00 3.25 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.54 0.00 120 G 8.41 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 0.00 0.00 0.00 121 P 0.00 4.19 0.00 1.91 2.16 0.00 2.97 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.75 0.00 122 R 7.92 4.28 0.00 1.80 1.92 0.00 3.29 0.00 0.00 3.25 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.64 0.00 123 T 7.60 5.12 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 1.27 0.00 0.00 124 H 7.83 4.71 0.00 3.40 3.53 0.00 5.47 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 Y 8.78 3.94 0.00 3.13 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 0.00 126 G 9.01 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 0.00 0.00 0.00 127 Q 7.43 4.23 0.00 1.83 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.92 6.77 0.00 0.00 0.00 0.00 0.00 2.19 2.10 0.00 128 K 8.30 3.85 0.00 1.75 1.66 0.00 1.54 0.00 0.00 1.66 0.00 0.00 2.83 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.42 1.28 7.81 129 A 8.02 4.01 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 0.00 130 I 7.19 4.43 1.67 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.00 0.58 0.00 0.00 131 L 7.27 4.37 0.00 0.99 0.51 0.35 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 132 F 9.41 5.21 0.00 3.41 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 0.00 133 L 9.39 5.29 0.00 1.81 1.65 1.12 0.77 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 0.00 134 P 0.00 5.12 0.00 2.15 2.21 0.00 3.82 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 2.04 2.07 0.00 135 L 9.22 4.88 0.00 1.64 1.62 0.92 0.86 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 0.00 136 P 0.00 4.63 0.00 1.92 1.97 0.00 3.67 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 2.02 2.12 0.00 137 V 8.17 3.75 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 0.65 0.00 0.00 0.91 0.00 0.00