NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 P 4.5933 0.0000 0.0000 62.5365 33.7174 174.3803 2 I 4.6720 8.1606 121.9981 59.7615 38.7256 170.4890 3 V 4.5502 8.9406 119.0487 59.9311 37.2067 173.2257 4 Q 4.9755 8.5791 122.5943 54.9256 30.4521 174.9319 5 N 4.8669 8.8230 124.2990 50.9520 39.6927 175.6395 6 L 4.1572 8.3391 117.1095 57.8188 41.6065 178.3724 7 Q 4.1650 8.1976 115.0297 55.7830 28.9702 176.3596 8 G 3.8892 8.5212 106.9506 45.7120 0.0000 173.1364 9 Q 4.5915 8.3668 118.2111 54.4975 30.8881 174.8102 10 M 4.7285 8.5429 122.2380 55.5953 32.6807 175.9589 11 V 4.6055 9.3409 116.9917 59.7486 36.9412 174.0022 12 H 4.9226 8.7312 121.7369 55.9858 30.7100 174.1195 13 Q 4.5820 8.4654 125.2705 53.7888 31.7668 174.9476 14 A 4.1755 8.6843 128.4467 51.8078 19.1924 177.0031 15 I 3.7364 8.0417 120.4400 60.6830 38.7969 176.4208 16 S 4.2694 8.5370 122.1061 57.5790 63.6164 173.4025 17 P 4.2706 0.0000 0.0000 65.8479 31.1242 178.9469 18 R 3.9370 7.9374 117.6531 59.5677 30.0682 178.9306 19 T 3.9170 7.8498 115.0459 66.4516 68.2941 176.7942 20 L 4.1467 8.2632 121.2999 58.0369 41.7807 179.3698 21 N 4.3659 8.7687 116.6184 56.0812 38.4257 177.3946 22 A 4.0256 8.3435 122.6153 54.7090 18.4639 179.3792 23 W 4.2905 8.4352 126.9623 60.7903 30.7491 178.1393 24 V 3.2750 8.0975 118.3655 66.1436 30.7651 178.1814 25 K 3.8856 7.9110 117.6736 58.9762 31.7814 179.5468 26 V 3.4033 7.5129 118.7147 66.0720 31.4285 178.3820 27 V 3.1036 6.9086 117.7633 65.5002 30.9406 177.8293 28 E 3.8186 7.8677 118.0517 59.3668 29.3950 178.5711 29 E 4.0984 8.1275 118.1298 57.8553 29.9650 177.6368 30 K 4.2851 8.1829 115.9866 55.1791 33.6023 176.8705 31 A 3.0287 8.0513 122.4164 53.6036 17.8106 179.0571 32 F 4.3830 6.6183 108.0242 58.0751 39.6384 175.4290 33 S 4.4871 7.4037 115.2514 57.4673 63.9783 173.5525 34 P 4.2644 0.0000 0.0000 66.0414 30.4232 178.6272 35 E 4.0764 7.8634 117.1674 59.3072 29.2160 179.7371 36 V 3.8580 8.0970 119.2372 64.5329 31.3543 178.4849 37 I 3.8503 7.7425 120.9359 63.8654 37.0368 176.4873 38 P 4.3630 0.0000 0.0000 66.0916 30.9406 178.3182 39 M 4.0976 7.8961 117.8943 58.2006 31.7021 178.3194 40 F 3.5568 8.3922 119.9574 61.0464 39.7023 176.6381 41 S 4.1007 8.2397 112.5163 61.5446 61.9638 176.1653 42 A 3.9586 7.8960 121.9939 54.8176 18.2255 178.8978 43 L 4.1881 7.6617 115.3900 55.6555 42.0871 177.7035 44 S 4.4153 7.0689 113.6843 57.4657 63.1987 173.4877 45 E 3.9261 8.0587 120.3304 58.7338 29.5503 177.4267 46 G 3.8144 8.9835 110.5619 45.5147 0.0000 172.9954 47 A 4.4963 7.7864 123.3524 51.9772 19.0667 178.1038 48 T 4.2881 8.7371 112.0807 60.4317 71.2972 174.2022 49 P 4.4941 0.0000 0.0000 66.1223 31.2329 178.5666 50 Q 3.9902 8.5222 117.9709 59.4463 28.9922 178.1394 51 D 4.3693 8.3501 119.9710 57.3156 40.8336 178.6288 52 L 3.9558 8.1504 119.5692 58.1928 41.6065 179.5190 53 N 4.5014 8.5923 116.2685 56.5078 38.2182 177.5563 54 T 3.9346 7.9567 116.5174 66.9356 68.9387 176.1181 55 M 4.3478 8.2419 120.4710 58.6474 31.8953 178.9634 56 L 4.3350 8.0882 118.9774 57.7560 41.5844 178.8986 57 N 4.6681 8.5647 115.5030 55.1708 38.6532 176.5818 58 T 4.4150 7.7591 110.1462 61.7789 69.3686 174.8501 59 V 3.6198 7.4168 122.7061 63.0117 31.6496 175.2923 60 G 3.9374 8.6249 116.9261 45.4365 0.0000 174.9601 61 G 3.7370 8.5649 110.6454 46.1729 0.0000 172.8964 62 H 4.2356 8.6576 111.2133 56.4265 26.9342 176.8798 63 Q 4.0044 8.2664 118.9475 58.9819 28.5994 178.2385 64 A 3.9396 7.9835 121.0677 55.0378 18.5227 179.2044 65 A 3.9223 8.0491 118.7546 55.7648 18.4659 179.4585 66 M 3.9062 8.2111 117.2164 58.6809 31.9233 179.0660 67 Q 3.9807 8.1251 118.0271 59.2058 28.9403 178.5480 68 M 3.9771 8.1230 119.1584 58.3890 32.2589 177.9365 69 L 3.8496 8.0837 120.6795 58.0929 42.2455 178.7780 70 K 3.9223 8.3358 119.9137 59.4869 32.0995 178.0396 71 E 3.8915 8.4520 119.7903 59.7931 29.5104 178.9792 72 T 3.8390 7.9729 115.4849 66.6404 68.4021 176.6023 73 I 3.7891 7.8417 121.5969 64.6674 37.1809 178.3192 74 N 4.2913 8.4014 117.3402 56.0888 38.2465 177.3106 75 E 3.8607 8.1888 120.0902 59.5292 29.5087 179.2376 76 E 3.4406 7.9410 118.1797 59.0301 29.2757 179.3161 77 A 3.4540 7.5010 120.6597 54.9577 18.4311 179.6193 78 A 3.9535 7.9860 119.3690 55.1319 18.4421 179.5097 79 E 3.8378 8.2660 118.0931 58.8480 29.4393 178.5905 80 W 4.2373 8.1762 128.0975 60.9313 31.0119 177.4178 81 D 4.5844 8.3578 118.6020 57.3272 39.9951 178.7416 82 R 3.9025 7.9887 118.5385 58.9630 30.1700 177.6368 83 L 4.4465 7.5491 115.5876 54.2049 42.9642 177.0246 84 H 4.5735 7.4027 116.6346 52.4703 29.0577 171.1548 85 P 4.3787 0.0000 0.0000 62.0417 32.1917 177.5147 86 V 3.7350 8.2274 119.9657 62.7633 32.1860 174.9968 87 A 4.7952 8.2016 128.6339 50.2054 21.1522 176.4062 88 M 4.2609 8.5243 122.0856 55.2618 32.9455 177.6200 89 G 4.0111 8.2002 110.9167 44.1709 0.0000 171.5069 90 P 4.5101 0.0000 0.0000 62.2073 32.2870 175.7601 91 I 3.9547 8.1108 121.1125 60.8282 38.0167 176.1177 92 A 4.2891 8.3783 127.8049 50.7341 19.2368 174.8457 93 P 4.4314 0.0000 0.0000 64.3373 31.7049 177.4111 94 G 3.9317 9.0364 110.0748 45.6206 0.0000 172.1860 95 Q 4.6999 7.8381 117.2622 54.3258 32.3043 173.6941 96 M 4.8394 8.0780 117.1733 53.5565 36.1232 175.1640 97 R 4.1910 8.5017 116.3976 56.4736 29.9047 176.3312 98 E 4.2835 8.6018 119.1484 55.3201 30.2436 175.3389 99 P 4.1910 0.0000 0.0000 62.6528 32.0229 177.0164 100 R 4.6554 9.0513 121.0687 54.8885 32.7782 178.0266 101 G 3.8680 9.5433 107.2410 48.4900 0.0000 176.1699 102 S 4.2349 8.0538 115.9573 60.9154 63.1439 176.2156 103 D 4.3573 7.8291 122.3639 57.2644 40.4623 178.3748 104 I 3.1738 7.1315 118.9273 64.1800 37.0063 177.2508 105 A 2.5800 7.3993 120.4308 52.3470 18.2298 178.3746 106 G 3.9616 7.6701 104.1038 45.1696 0.0000 175.0421 107 T 3.9908 7.8161 116.5249 66.1987 68.5373 175.2482 108 T 4.5815 7.7974 107.6636 60.9179 69.0754 173.6528 109 S 5.0675 7.7833 116.6629 56.8150 65.7179 173.7450 110 T 4.2105 8.6114 113.6086 60.4999 71.2435 175.7997 111 L 3.8694 8.2537 122.2184 58.6068 42.0546 178.9220 112 Q 3.9351 7.9277 117.2503 58.8415 28.5682 178.4226 113 E 3.3257 8.0753 119.5739 59.3105 29.4645 179.2753 114 Q 4.2592 7.9878 117.8659 59.4034 28.8457 179.3582 115 I 3.8599 8.2261 121.0835 64.2149 37.1782 178.7323 116 G 3.4863 7.9131 106.6139 47.4985 0.0000 175.8298 117 W 4.4709 8.2272 121.7443 59.9893 28.9422 178.6715 118 M 4.3653 8.2400 117.3836 57.5134 31.4030 177.2958 119 T 4.4515 7.5397 106.5136 61.3216 69.1924 173.8543 120 H 4.3567 7.8285 122.2068 56.1065 30.5263 173.6582 121 N 4.7997 7.8939 120.1623 50.9000 39.8886 171.9951 122 P 4.6513 0.0000 0.0000 60.9170 32.7221 174.5022 123 P 4.6595 0.0000 0.0000 62.3888 31.8148 176.3033 124 I 4.3385 8.4753 122.1451 59.0876 38.1987 175.4113 125 P 4.6137 0.0000 0.0000 61.9981 27.9976 176.9380 126 V 3.4032 7.6213 117.7988 64.7278 32.0009 178.2414 127 G 3.6985 7.8297 106.5028 47.4014 0.0000 175.4494 128 E 3.9425 8.0297 121.0187 58.8904 29.4752 179.4878 129 I 3.4138 7.5082 119.7594 64.4711 37.0944 177.8622 130 Y 3.5027 7.4594 120.2994 60.2331 38.4057 177.9886 131 K 3.7817 7.9666 120.5774 59.4530 32.3217 178.8076 132 R 3.9569 8.0106 118.4184 59.2514 30.0339 178.9428 133 W 4.4780 8.0367 118.4429 60.0420 29.0141 178.6314 134 I 3.6154 7.9822 119.7487 64.4323 36.4434 178.5838 135 I 3.6287 8.0911 120.9658 64.1987 36.7575 178.4398 136 L 4.1049 8.1373 120.0484 57.6989 41.4769 179.7910 137 G 3.5956 8.0867 105.4781 47.8609 0.0000 175.4009 138 L 3.8965 8.4121 122.4736 57.7053 41.4359 179.2788 139 N 4.2917 8.0752 114.9894 56.4335 38.6422 177.0503 140 K 4.1275 7.7806 121.1020 59.4515 32.4012 179.0397 141 I 3.8575 7.8029 113.3215 63.8484 37.5766 178.4992 142 V 4.2926 8.1835 115.6968 63.4347 31.3672 178.2867 143 R 4.0095 7.8939 118.4229 59.7447 29.6848 178.5124 144 M 4.2555 8.2848 116.8210 57.1753 31.9341 177.0985 145 Y 4.5208 7.8988 114.7691 57.2122 39.0714 175.7355 146 S 4.4052 7.8512 120.7396 58.9102 63.3922 169.0039 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 1 P 0.00 4.59 0.00 2.03 1.97 0.00 3.60 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 2.06 0.00 2 I 8.16 4.67 1.86 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.18 0.94 0.00 0.00 3 V 8.94 4.55 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.00 0.00 0.96 0.00 0.00 4 Q 8.58 4.98 0.00 2.04 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.80 0.00 0.00 0.00 0.00 0.00 2.26 2.33 0.00 5 N 8.82 4.87 0.00 2.95 2.95 0.00 0.00 6.70 6.46 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 6 L 8.34 4.16 0.00 1.65 1.77 0.92 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 7 Q 8.20 4.17 0.00 2.14 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.30 0.00 0.00 0.00 0.00 0.00 2.33 2.40 0.00 8 G 8.52 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 9 Q 8.37 4.59 0.00 2.12 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.24 6.95 0.00 0.00 0.00 0.00 0.00 2.56 2.28 0.00 10 M 8.54 4.73 0.00 1.93 2.05 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 2.60 2.51 0.00 11 V 9.34 4.61 2.09 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 0.72 0.00 0.00 0.92 0.00 0.00 12 H 8.73 4.92 0.00 3.18 3.19 0.00 5.67 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 13 Q 8.47 4.58 0.00 1.93 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.68 0.00 0.00 0.00 0.00 0.00 2.21 2.24 0.00 14 A 8.68 4.18 1.27 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 0.00 0.00 15 I 8.04 3.74 2.07 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.81 0.92 0.00 0.00 16 S 8.54 4.27 0.00 3.91 3.71 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 17 P 0.00 4.27 0.00 2.31 2.31 0.00 3.75 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.06 0.00 18 R 7.94 3.94 0.00 1.88 2.02 0.00 3.13 0.00 0.00 3.34 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.73 0.00 19 T 7.85 3.92 4.36 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 1.18 0.00 0.00 20 L 8.26 4.15 0.00 1.89 1.81 0.96 1.00 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 21 N 8.77 4.37 0.00 2.95 2.88 0.00 0.00 6.92 7.74 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 22 A 8.34 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 23 W 8.44 4.29 0.00 3.45 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 24 V 8.10 3.28 2.22 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 1.00 0.00 0.00 0.95 0.00 0.00 25 K 7.91 3.89 0.00 1.96 1.77 0.00 1.86 0.00 0.00 1.54 0.00 0.00 2.89 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.59 1.56 7.81 26 V 7.51 3.40 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 0.93 0.00 0.00 1.01 0.00 0.00 27 V 6.91 3.10 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 0.38 0.00 0.00 -0.46 0.00 0.00 28 E 7.87 3.82 0.00 2.05 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 2.27 2.28 0.00 29 E 8.13 4.10 0.00 1.87 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 2.27 2.33 0.00 30 K 8.18 4.29 0.00 1.76 1.65 0.00 1.82 0.00 0.00 1.61 0.00 0.00 2.91 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.27 1.32 7.81 31 A 8.05 3.03 1.11 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 32 F 6.62 4.38 0.00 1.74 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 33 S 7.40 4.49 0.00 3.97 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 34 P 0.00 4.26 0.00 2.21 2.20 0.00 3.65 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.25 0.00 35 E 7.86 4.08 0.00 1.88 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 2.39 0.00 36 V 8.10 3.86 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 1.00 0.00 0.00 1.01 0.00 0.00 37 I 7.74 3.85 1.94 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.08 0.97 0.00 0.00 38 P 0.00 4.36 0.00 2.29 2.35 0.00 3.92 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 2.24 2.10 0.00 39 M 7.90 4.10 0.00 2.26 2.47 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.96 0.00 40 F 8.39 3.56 0.00 2.87 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 41 S 8.24 4.10 0.00 3.99 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 A 7.90 3.96 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.66 4.19 0.00 1.43 1.56 1.10 0.87 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 44 S 7.07 4.42 0.00 3.49 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 45 E 8.06 3.93 0.00 1.90 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 2.24 2.22 0.00 46 G 8.98 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 A 7.79 4.50 1.19 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 0.00 0.00 48 T 8.74 4.29 4.44 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 1.31 0.00 0.00 49 P 0.00 4.49 0.00 2.30 2.22 0.00 3.83 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 2.08 2.16 0.00 50 Q 8.52 3.99 0.00 2.24 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.80 0.00 0.00 0.00 0.00 0.00 2.39 2.43 0.00 51 D 8.35 4.37 0.00 2.88 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 L 8.15 3.96 0.00 1.81 1.62 0.90 0.62 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 53 N 8.59 4.50 0.00 2.98 2.97 0.00 0.00 7.08 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 54 T 7.96 3.93 4.44 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 1.26 0.00 0.00 55 M 8.24 4.35 0.00 1.70 2.24 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.80 2.47 0.00 56 L 8.09 4.34 0.00 1.80 1.80 0.85 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 57 N 8.56 4.67 0.00 2.94 2.94 0.00 0.00 7.05 7.15 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 58 T 7.76 4.42 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 1.39 0.00 0.00 59 V 7.42 3.62 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 1.28 0.00 0.00 60 G 8.62 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 61 G 8.56 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 62 H 8.66 4.24 0.00 3.51 3.58 0.00 5.64 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 63 Q 8.27 4.00 0.00 2.16 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.92 0.00 0.00 0.00 0.00 0.00 2.47 2.53 0.00 64 A 7.98 3.94 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 65 A 8.05 3.92 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 66 M 8.21 3.91 0.00 2.05 2.16 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.95 0.00 67 Q 8.13 3.98 0.00 2.24 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.80 0.00 0.00 0.00 0.00 0.00 2.55 2.52 0.00 68 M 8.12 3.98 0.00 2.17 2.04 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.52 0.00 69 L 8.08 3.85 0.00 1.72 1.75 0.80 0.58 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 70 K 8.34 3.92 0.00 2.03 1.93 0.00 1.73 0.00 0.00 1.60 0.00 0.00 2.94 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.47 1.50 7.81 71 E 8.45 3.89 0.00 2.09 2.09 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 2.29 2.39 0.00 72 T 7.97 3.84 4.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 73 I 7.84 3.79 2.12 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.82 1.27 0.00 0.00 74 N 8.40 4.29 0.00 2.88 2.84 0.00 0.00 7.08 7.80 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 75 E 8.19 3.86 0.00 2.10 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 2.28 2.53 0.00 76 E 7.94 3.44 0.00 1.16 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 2.27 2.22 0.00 77 A 7.50 3.45 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.99 3.95 1.32 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 79 E 8.27 3.84 0.00 2.14 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 2.27 2.34 0.00 80 W 8.18 4.24 0.00 3.67 3.38 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 81 D 8.36 4.58 0.00 3.00 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 82 R 7.99 3.90 0.00 1.92 2.05 0.00 3.22 0.00 0.00 3.19 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.64 0.00 83 L 7.55 4.45 0.00 1.32 1.38 0.85 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 84 H 7.40 4.57 0.00 2.76 3.00 0.00 5.86 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 85 P 0.00 4.38 0.00 2.15 2.02 0.00 3.66 0.00 0.00 3.47 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 86 V 8.23 3.73 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 0.83 0.00 0.00 0.97 0.00 0.00 87 A 8.20 4.80 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 88 M 8.52 4.26 0.00 2.03 2.02 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 2.61 2.55 0.00 89 G 8.20 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 0.00 0.00 0.00 90 P 0.00 4.51 0.00 2.20 2.07 0.00 3.77 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 1.99 1.99 0.00 91 I 8.11 3.95 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 1.38 0.56 0.94 0.00 0.00 92 A 8.38 4.29 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 93 P 0.00 4.43 0.00 2.05 2.01 0.00 3.73 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 2.03 2.10 0.00 94 G 9.04 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 95 Q 7.84 4.70 0.00 2.25 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.82 6.63 0.00 0.00 0.00 0.00 0.00 2.31 2.33 0.00 96 M 8.08 4.84 0.00 1.76 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 2.32 2.32 0.00 97 R 8.50 4.19 0.00 2.05 2.06 0.00 3.15 0.00 0.00 3.31 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.97 0.00 98 E 8.60 4.28 0.00 2.05 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 2.39 2.29 0.00 99 P 0.00 4.19 0.00 1.34 0.49 0.00 3.52 0.00 0.00 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.85 0.00 100 R 9.05 4.66 0.00 1.85 2.11 0.00 3.37 0.00 0.00 3.24 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.84 0.00 101 G 9.54 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 S 8.05 4.23 0.00 4.06 4.15 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 0.00 103 D 7.83 4.36 0.00 2.78 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 0.00 104 I 7.13 3.17 1.38 0.00 0.00 -0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.40 -0.17 -0.27 0.00 0.00 105 A 7.40 2.58 1.16 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 0.00 0.00 0.00 106 G 7.67 3.96 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 0.00 0.00 0.00 107 T 7.82 3.99 4.36 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 1.22 0.00 0.00 108 T 7.80 4.58 4.28 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 1.23 0.00 0.00 109 S 7.78 5.07 0.00 4.12 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 0.00 110 T 8.61 4.21 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 1.17 0.00 0.00 111 L 8.25 3.87 0.00 1.90 1.64 0.83 0.51 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 0.00 112 Q 7.93 3.94 0.00 2.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.66 0.00 0.00 0.00 0.00 0.00 2.38 2.33 0.00 113 E 8.08 3.33 0.00 1.87 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 1.87 2.09 0.00 114 Q 7.99 4.26 0.00 2.28 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.80 0.00 0.00 0.00 0.00 0.00 2.52 2.65 0.00 115 I 8.23 3.86 1.94 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.69 0.90 0.00 0.00 116 G 7.91 3.49 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 0.00 117 W 8.23 4.47 0.00 3.61 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 0.00 118 M 8.24 4.37 0.00 2.04 2.25 0.00 0.00 0.00 0.00 0.00 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.82 2.57 0.00 119 T 7.54 4.45 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 0.00 120 H 7.83 4.36 0.00 3.64 3.49 0.00 5.72 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 N 7.89 4.80 0.00 2.58 2.62 0.00 0.00 7.01 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 0.00 122 P 0.00 4.65 0.00 2.26 2.06 0.00 3.91 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.99 0.00 123 P 0.00 4.66 0.00 2.23 2.13 0.00 3.35 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 2.02 1.97 0.00 124 I 8.48 4.34 1.86 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.59 0.76 0.00 0.00 125 P 0.00 4.61 0.00 2.22 2.20 0.00 3.70 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.06 0.00 126 V 7.62 3.40 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.34 0.00 0.00 1.03 0.00 0.00 127 G 7.83 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 0.00 0.00 0.00 128 E 8.03 3.94 0.00 2.10 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 2.36 2.36 0.00 129 I 7.51 3.41 1.27 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.72 0.08 0.00 0.00 130 Y 7.46 3.50 0.00 2.64 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 0.00 131 K 7.97 3.78 0.00 1.89 1.91 0.00 1.58 0.00 0.00 1.58 0.00 0.00 2.90 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.44 1.54 7.81 132 R 8.01 3.96 0.00 2.06 2.10 0.00 3.23 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.80 0.00 133 W 8.04 4.48 0.00 3.64 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 0.00 134 I 7.98 3.62 1.79 0.00 0.00 0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.43 0.27 0.00 0.00 135 I 8.09 3.63 2.02 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.70 0.95 0.00 0.00 136 L 8.14 4.10 0.00 1.94 1.74 1.07 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 137 G 8.09 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 L 8.41 3.90 0.00 1.76 1.77 0.57 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 139 N 8.08 4.29 0.00 2.97 2.92 0.00 0.00 7.04 7.12 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 0.00 140 K 7.78 4.13 0.00 1.78 1.93 0.00 1.62 0.00 0.00 1.68 0.00 0.00 3.00 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.43 1.44 7.81 141 I 7.80 3.86 1.82 0.00 0.00 0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.50 0.89 0.00 0.00 142 V 8.18 4.29 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 1.08 0.00 0.00 143 R 7.89 4.01 0.00 1.91 2.02 0.00 3.14 0.00 0.00 3.18 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.95 0.00 144 M 8.28 4.26 0.00 1.63 2.20 0.00 0.00 0.00 0.00 0.00 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.52 0.00 145 Y 7.90 4.52 0.00 3.11 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 0.00 146 S 7.85 4.41 0.00 4.14 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