NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 R 4.2449 8.2431 117.2840 56.0457 30.7486 174.7670 5 G 3.8230 8.1749 108.2151 43.5643 0.0000 171.6631 6 G 3.9755 9.1857 109.3065 45.1773 0.0000 172.3703 7 R 4.6710 8.0640 122.6564 54.7764 32.3182 174.4248 8 G 4.2079 8.7487 109.5300 46.9081 0.0000 173.2702 9 F 4.2909 8.9027 118.7012 61.3037 39.3492 178.2305 10 R 4.0119 8.3576 118.1216 59.3942 29.9866 178.1886 11 G 4.0206 8.3201 105.8236 48.0132 0.0000 175.3454 12 W 4.1149 7.9096 130.6636 59.7363 30.8951 178.0293 13 W 3.6073 8.5934 128.8784 59.8450 30.0107 177.8512 14 L 3.7350 8.6747 120.8752 58.0455 41.5561 178.5319 15 A 3.8446 7.7544 120.6325 55.4373 18.3767 179.8379 16 S 3.5902 7.3694 113.2315 61.8101 62.6443 177.1697 17 T 3.3811 6.9922 117.8309 66.3367 68.0390 176.9210 18 I 3.3750 7.6323 122.1327 64.0491 37.0699 178.0747 19 L 3.7892 7.8086 121.2701 58.0426 41.8059 178.7459 20 L 3.8134 7.4367 119.5826 58.2073 42.0169 178.9430 21 L 3.8815 7.8774 119.0522 57.6853 41.2860 179.6027 22 V 3.4929 7.8446 117.3146 65.9676 31.5096 177.3836 23 A 4.1131 8.0534 119.6325 55.4542 18.2224 179.2050 24 E 4.2532 8.1889 116.1804 58.0619 29.6135 177.7498 25 K 4.2849 7.6876 120.1814 54.4557 34.4975 173.3631 26 P 4.4812 0.0000 0.0000 63.6010 32.1125 175.5063 27 S 4.6188 8.4259 116.5314 58.4300 66.9212 173.7499 28 H 5.2230 7.7436 116.6118 53.9700 30.6762 177.1496 29 G 2.9811 8.2201 106.1085 47.4615 0.0000 175.6447 30 Y 4.1272 8.0182 121.5578 60.2300 39.4149 177.4217 31 E 4.0060 7.9636 119.6747 59.0999 29.6815 178.4322 32 L 3.8357 7.7105 118.9612 57.5803 41.4933 179.2434 33 A 3.8411 7.5359 120.4895 55.1442 17.9605 179.5744 34 E 3.7930 7.6179 116.4743 59.6849 29.6880 179.8748 35 R 3.9814 7.7692 117.3941 58.7471 29.7431 178.4293 36 L 4.0243 8.0984 120.0275 57.1291 41.7674 178.7700 37 A 4.0649 7.4516 120.4621 55.0541 18.7398 179.1583 38 E 4.0628 7.6850 113.8581 58.7891 29.5033 178.5793 39 F 3.9517 7.8076 121.3673 59.5687 40.0606 177.0868 40 G 3.8156 8.8305 107.4639 46.1312 0.0000 176.4671 41 I 4.2324 8.2889 120.2512 60.2750 38.8588 173.3198 42 E 4.3930 8.8846 125.9340 55.5264 29.1590 175.1287 43 I 4.2670 7.3080 118.4184 58.1408 38.8405 173.2227 44 P 4.3088 0.0000 0.0000 64.3573 31.3933 177.1667 45 G 3.9812 9.0266 111.8536 45.2869 0.0000 174.2600 46 I 4.0025 7.3943 112.0844 62.9845 39.9190 178.0394 47 G 3.7411 8.7748 110.2304 45.3982 0.0000 173.0279 48 H 4.4157 8.9895 119.8705 56.0601 30.1787 173.7722 49 M 4.4548 7.7766 118.1237 51.8717 35.8326 178.0191 50 G 3.6853 8.6944 104.5105 45.5826 0.0000 173.8107 51 N 4.0879 7.5793 115.4984 53.6096 34.6112 173.6210 52 I 3.4520 7.7527 125.9968 64.7152 37.7000 177.1017 53 Y 4.0358 7.8034 116.2409 61.5322 37.9072 179.0199 54 R 4.0280 8.0774 118.9555 58.7845 30.1894 178.6662 55 V 3.7160 7.6733 112.0105 63.6081 31.5304 178.1091 56 L 3.6041 7.8964 119.0278 57.9161 41.3756 179.2619 57 A 4.0710 8.2110 120.4576 55.5470 18.1440 179.3965 58 D 4.2597 8.2246 117.1551 57.5689 40.8067 179.0428 59 L 4.0550 8.1536 119.5890 57.3009 41.6911 178.8835 60 E 4.1558 8.3679 120.9542 58.9022 29.4344 178.3242 61 E 3.8668 8.5318 118.2113 59.4443 29.6506 178.4006 62 S 4.1614 7.3672 112.8202 58.5677 63.1140 175.0928 63 G 3.7284 7.4178 109.7545 45.3733 0.0000 174.1864 64 F 4.9338 7.9886 118.5044 58.0912 40.0237 175.5765 65 L 5.3167 7.7144 118.4699 53.0335 46.3460 175.5543 66 S 4.7227 9.4477 117.1938 56.8975 66.4268 172.4641 67 T 4.7932 8.0046 113.2385 60.4045 70.4286 172.4526 68 E 4.6574 8.5074 127.3394 54.3939 33.6511 174.0807 69 W 4.5157 8.8972 127.2277 56.7593 30.1586 175.2782 70 D 4.7440 9.4890 126.3872 53.9547 40.9763 176.5163 71 T 4.4946 8.6538 116.2355 61.8720 69.5710 176.3297 72 T 3.9966 8.1221 112.5048 63.2522 69.2350 174.5290 73 V 4.3849 6.9681 115.2142 59.5076 34.3247 174.9006 74 S 4.4530 8.1706 114.5653 56.0804 64.3525 171.8074 75 P 4.6099 0.0000 0.0000 61.2986 32.2647 174.0268 76 P 4.8080 0.0000 0.0000 62.9527 32.2264 176.1950 77 R 4.7198 8.8129 121.4632 54.1863 33.2349 174.8350 78 K 3.4602 8.0356 125.2822 55.5224 33.2108 175.4643 79 I 4.4685 8.2870 130.3539 60.8339 38.3720 174.9198 80 Y 4.7696 8.9583 125.7003 57.0538 39.8715 174.7925 81 R 4.7582 8.8177 122.6586 54.4444 34.0532 173.9950 82 I 4.4026 8.5107 126.6149 61.4484 38.9476 175.2748 83 T 4.5058 8.4397 119.0200 59.8817 71.1066 174.0347 84 P 4.2981 0.0000 0.0000 65.8067 31.2279 178.9663 85 Q 4.2744 7.8384 117.6431 58.9110 28.5036 179.1033 86 G 3.6893 8.3623 106.8980 47.5992 0.0000 176.0803 87 K 3.9831 8.0420 120.3443 59.2280 32.2189 179.2792 88 L 4.0392 7.8327 118.9617 57.8561 41.5415 178.9026 89 Y 4.0850 8.1005 119.6632 60.3580 38.4942 177.6550 90 L 3.7655 8.1100 121.5881 58.1679 42.1650 179.1422 91 R 3.8672 7.9946 117.9624 59.3462 29.8658 178.8445 92 E 3.9368 7.9807 117.8686 59.4530 29.2907 179.5520 93 I 3.9243 7.4281 119.8647 64.0140 37.1004 178.1997 94 L 3.9102 8.0343 121.5620 58.2270 41.9983 179.0449 95 R 4.2054 8.0386 120.0045 59.1202 29.9221 178.6864 96 S 4.3646 8.0642 114.7602 61.3698 62.7089 176.5972 97 L 4.2313 8.4638 122.2186 57.9899 40.9454 179.3562 98 E 4.0459 8.2865 118.4939 59.3424 29.3358 179.0537 99 D 4.4015 8.1251 118.9251 57.7982 40.9674 178.9100 100 M 4.0657 8.2257 119.1686 58.3276 32.0324 178.8171 101 K 4.0198 8.5535 120.2650 59.4206 32.3746 178.9004 102 R 4.0658 8.0039 119.0448 59.3430 30.1087 178.4646 103 R 3.8917 8.1874 118.6527 59.4454 30.0403 178.5768 104 I 3.7138 7.8446 119.6835 64.4661 36.9650 178.2917 105 E 4.3601 8.2467 119.4787 59.1918 29.3382 179.4543 106 T 3.9199 7.8020 110.2945 64.5292 68.8251 176.8287 107 L 3.9269 7.8422 121.5790 57.6735 41.8255 178.9504 108 E 3.9158 8.4952 118.9030 59.9462 29.3764 179.5957 109 E 4.0521 7.9731 118.1646 59.2625 29.4671 179.5053 110 R 3.9220 7.8010 117.7619 59.2051 30.0628 179.2102 111 I 3.7644 8.0102 119.9043 64.2078 37.0258 178.6156 112 K 3.9961 7.9919 119.1488 59.4451 31.9500 179.5424 113 R 3.9042 8.2093 118.5163 59.4073 29.8050 179.2865 114 V 3.8365 7.3935 110.4548 63.4166 31.7148 178.1134 115 L 4.1861 7.6167 118.4618 57.0626 41.5841 178.5625 116 Q 4.0744 8.1493 119.3465 59.2546 29.1441 176.0526 117 E 4.1059 7.8026 122.0320 56.9326 29.6121 177.1510 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 4 R 8.24 4.24 0.00 1.93 2.02 0.00 3.06 0.00 0.00 3.24 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.72 0.00 5 G 8.17 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 0.00 0.00 0.00 6 G 9.19 3.98 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 0.00 0.00 0.00 0.00 0.00 0.00 7 R 8.06 4.67 0.00 1.93 1.78 0.00 3.37 0.00 0.00 3.38 7.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.70 0.00 8 G 8.75 4.21 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 0.00 9 F 8.90 4.29 0.00 3.18 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 10 R 8.36 4.01 0.00 2.05 2.00 0.00 3.49 0.00 0.00 3.40 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.80 0.00 11 G 8.32 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 0.00 0.00 0.00 12 W 7.91 4.11 0.00 3.42 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 13 W 8.59 3.61 0.00 2.98 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 14 L 8.67 3.73 0.00 1.87 1.73 0.84 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 15 A 7.75 3.84 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 S 7.37 3.59 0.00 2.83 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 17 T 6.99 3.38 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 -0.54 0.00 0.00 18 I 7.63 3.37 1.64 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.43 0.66 0.00 0.00 19 L 7.81 3.79 0.00 1.77 1.66 0.90 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 20 L 7.44 3.81 0.00 1.77 1.66 0.91 0.44 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 21 L 7.88 3.88 0.00 1.67 1.56 0.61 1.16 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 22 V 7.84 3.49 2.14 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 0.86 0.00 0.00 0.84 0.00 0.00 23 A 8.05 4.11 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 24 E 8.19 4.25 0.00 2.15 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 2.32 2.43 0.00 25 K 7.69 4.28 0.00 1.67 1.63 0.00 1.81 0.00 0.00 1.69 0.00 0.00 2.94 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.34 1.40 7.81 26 P 0.00 4.48 0.00 1.97 2.06 0.00 3.76 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.09 0.00 27 S 8.43 4.62 0.00 3.85 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 H 7.74 5.22 0.00 3.30 3.50 0.00 5.71 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 G 8.22 2.98 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 0.00 0.00 0.00 0.00 0.00 0.00 30 Y 8.02 4.13 0.00 3.13 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 31 E 7.96 4.01 0.00 1.87 1.67 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 2.48 2.31 0.00 32 L 7.71 3.84 0.00 1.69 1.47 0.75 0.68 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 33 A 7.54 3.84 1.20 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 0.00 0.00 34 E 7.62 3.79 0.00 2.05 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 2.07 2.06 0.00 35 R 7.77 3.98 0.00 1.90 1.95 0.00 3.24 0.00 0.00 3.34 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.65 0.00 36 L 8.10 4.02 0.00 1.86 1.64 0.80 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 37 A 7.45 4.06 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 38 E 7.68 4.06 0.00 2.14 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 0.00 2.53 2.56 0.00 39 F 7.81 3.95 0.00 3.32 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 40 G 8.83 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 0.00 0.00 0.00 41 I 8.29 4.23 1.88 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.45 0.99 0.00 0.00 42 E 8.88 4.39 0.00 1.93 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.36 0.00 43 I 7.31 4.27 1.66 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.50 0.72 0.00 0.00 44 P 0.00 4.31 0.00 1.96 1.97 0.00 3.57 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 2.05 0.00 45 G 9.03 3.98 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 0.00 0.00 0.00 0.00 0.00 0.00 46 I 7.39 4.00 1.93 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.69 1.00 0.00 0.00 47 G 8.77 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 48 H 8.99 4.42 0.00 3.16 3.13 0.00 5.67 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 49 M 7.78 4.45 0.00 1.99 1.88 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.71 0.00 50 G 8.69 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 0.00 0.00 0.00 51 N 7.58 4.09 0.00 2.82 2.79 0.00 0.00 6.87 7.65 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 52 I 7.75 3.45 1.67 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.70 0.58 0.00 0.00 53 Y 7.80 4.04 0.00 3.23 3.06 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 54 R 8.08 4.03 0.00 1.88 1.93 0.00 3.10 0.00 0.00 3.19 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.69 0.00 55 V 7.67 3.72 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 0.72 0.00 0.00 0.79 0.00 0.00 56 L 7.90 3.60 0.00 1.30 0.52 0.10 0.41 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 57 A 8.21 4.07 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 58 D 8.22 4.26 0.00 2.82 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 59 L 8.15 4.05 0.00 1.79 1.74 0.81 0.79 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 60 E 8.37 4.16 0.00 2.28 2.17 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 2.30 2.32 0.00 61 E 8.53 3.87 0.00 2.01 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 2.27 2.33 0.00 62 S 7.37 4.16 0.00 3.42 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 63 G 7.42 3.73 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 0.00 64 F 7.99 4.93 0.00 2.97 2.86 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 0.00 0.00 0.00 65 L 7.71 5.32 0.00 1.62 1.63 0.93 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 66 S 9.45 4.72 0.00 3.78 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 67 T 8.00 4.79 4.16 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 0.00 0.00 1.13 0.00 0.00 68 E 8.51 4.66 0.00 2.00 1.64 0.00 0.00 0.00 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 69 W 8.90 4.52 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 70 D 9.49 4.74 0.00 2.80 2.76 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 71 T 8.65 4.49 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 72 T 8.12 4.00 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 73 V 6.97 4.38 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 0.71 0.00 0.00 1.09 0.00 0.00 74 S 8.17 4.45 0.00 3.75 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 75 P 0.00 4.61 0.00 2.26 2.05 0.00 3.81 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.98 0.00 76 P 0.00 4.81 0.00 2.07 2.21 0.00 3.62 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 2.10 0.00 77 R 8.81 4.72 0.00 1.71 1.71 0.00 3.06 0.00 0.00 3.12 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.50 0.00 78 K 8.04 3.46 0.00 0.79 1.04 0.00 0.97 0.00 0.00 1.41 0.00 0.00 2.45 0.00 0.00 2.51 0.00 0.00 0.00 0.00 0.47 0.21 7.81 79 I 8.29 4.47 1.86 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.99 0.88 0.00 0.00 80 Y 8.96 4.77 0.00 2.95 2.89 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 81 R 8.82 4.76 0.00 1.81 1.66 0.00 3.07 0.00 0.00 3.08 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.56 0.00 82 I 8.51 4.40 1.87 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 1.42 1.18 0.91 0.00 0.00 83 T 8.44 4.51 4.27 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 1.27 0.00 0.00 84 P 0.00 4.30 0.00 2.21 2.16 0.00 3.62 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.19 0.00 85 Q 7.84 4.27 0.00 2.55 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.83 0.00 0.00 0.00 0.00 0.00 2.43 2.57 0.00 86 G 8.36 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 0.00 0.00 0.00 87 K 8.04 3.98 0.00 1.96 1.87 0.00 1.68 0.00 0.00 1.82 0.00 0.00 2.92 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.52 1.54 7.81 88 L 7.83 4.04 0.00 1.97 1.76 0.97 0.61 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 89 Y 8.10 4.08 0.00 2.28 2.47 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 90 L 8.11 3.77 0.00 1.96 1.73 0.75 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 91 R 7.99 3.87 0.00 2.04 1.94 0.00 3.18 0.00 0.00 3.16 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.81 0.00 92 E 7.98 3.94 0.00 2.05 1.87 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 2.30 2.49 0.00 93 I 7.43 3.92 1.81 0.00 0.00 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.25 0.58 0.00 0.00 94 L 8.03 3.91 0.00 1.75 1.80 0.92 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 95 R 8.04 4.21 0.00 1.92 2.06 0.00 3.19 0.00 0.00 3.26 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.54 0.00 96 S 8.06 4.36 0.00 4.24 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 97 L 8.46 4.23 0.00 1.94 1.86 0.86 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 98 E 8.29 4.05 0.00 2.26 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 2.35 2.38 0.00 99 D 8.13 4.40 0.00 2.85 2.70 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 0.00 100 M 8.23 4.07 0.00 2.16 2.41 0.00 0.00 0.00 0.00 0.00 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.94 2.56 0.00 101 K 8.55 4.02 0.00 1.86 1.97 0.00 1.66 0.00 0.00 1.61 0.00 0.00 2.92 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.46 1.48 7.81 102 R 8.00 4.07 0.00 2.12 2.06 0.00 3.15 0.00 0.00 3.09 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.63 0.00 103 R 8.19 3.89 0.00 1.94 2.14 0.00 3.17 0.00 0.00 3.14 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.68 0.00 104 I 7.84 3.71 2.02 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.48 0.90 0.00 0.00 105 E 8.25 4.36 0.00 2.04 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 2.33 2.58 0.00 106 T 7.80 3.92 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 1.24 0.00 0.00 107 L 7.84 3.93 0.00 1.94 1.73 0.88 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 108 E 8.50 3.92 0.00 2.11 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 2.33 2.57 0.00 109 E 7.97 4.05 0.00 1.93 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 2.56 2.48 0.00 110 R 7.80 3.92 0.00 2.09 1.96 0.00 3.11 0.00 0.00 3.25 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.72 0.00 111 I 8.01 3.76 2.01 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 1.50 0.74 0.90 0.00 0.00 112 K 7.99 4.00 0.00 1.98 1.85 0.00 1.83 0.00 0.00 1.64 0.00 0.00 2.92 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.45 1.47 7.81 113 R 8.21 3.90 0.00 1.99 1.97 0.00 3.11 0.00 0.00 3.16 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.79 0.00 114 V 7.39 3.84 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 0.78 0.00 0.00 0.95 0.00 0.00 115 L 7.62 4.19 0.00 1.77 1.71 0.91 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 116 Q 8.15 4.07 0.00 2.02 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.81 0.00 0.00 0.00 0.00 0.00 2.37 2.40 0.00 117 E 7.80 4.11 0.00 2.23 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 2.36 2.55 0.00