NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.2604 8.2644 123.5818 51.2224 20.1759 176.7528 2 R 3.8188 8.1267 119.6995 57.1820 30.6313 169.7274 3 V 4.3612 8.3968 122.3513 61.2116 34.0894 175.2120 4 K 3.7370 7.8637 123.7859 56.2234 33.2849 175.8311 5 R 3.7934 7.9072 120.5294 57.6659 28.9538 175.7832 6 G 3.9962 7.4227 103.4151 46.3701 0.0000 174.3822 7 V 3.5485 8.6147 113.9207 64.0471 32.5323 177.8925 8 I 3.6799 7.7048 117.8199 63.2874 37.7325 176.5307 9 A 4.2955 7.6597 123.7501 54.3182 18.3997 179.3510 10 R 4.1031 7.5361 107.6481 56.5314 29.6392 178.0627 11 A 4.3911 8.3675 122.2217 54.9934 19.7720 180.3519 12 R 3.9839 7.7954 113.5323 59.0814 29.5281 178.2950 13 H 4.0188 8.1912 119.1085 59.2607 29.8243 176.9372 14 K 3.9671 7.5009 118.9176 59.5367 31.9927 177.8355 15 K 3.8472 7.8525 119.2649 59.6609 32.3859 178.1133 16 I 3.7539 7.8004 119.0240 63.9019 38.4230 176.8569 17 L 4.4927 8.0325 120.7927 53.1423 38.0398 174.2604 18 K 4.1841 7.1611 130.6999 57.2245 36.1925 176.2053 19 Q 4.0436 8.0699 113.9454 57.1593 28.3960 176.5461 20 A 3.4563 7.4184 119.7908 51.3863 20.3464 177.2590 21 K 3.5449 7.7259 115.7314 58.1521 32.2671 176.4938 22 G 4.0959 8.8869 111.3975 45.8833 0.0000 173.5211 23 Y 4.6670 7.7558 117.9756 57.5284 38.6802 174.9490 24 Y 4.4214 8.6831 124.1918 57.6504 40.1401 176.7009 25 G 3.3627 6.9203 110.8288 45.0664 0.0000 173.3664 26 A 4.1600 8.2303 118.8249 54.1154 18.0575 180.0599 27 R 4.0393 7.4199 113.7126 59.1281 30.2704 178.0187 28 S 4.7558 7.6695 112.0006 57.5797 63.8885 175.0168 29 R 4.6809 8.2413 114.9918 53.9384 32.0354 176.3436 30 V 4.4941 8.3070 133.1892 62.4726 30.3973 173.4025 31 Y 5.3377 8.1683 128.9924 57.8429 39.0710 172.9751 32 R 3.2783 7.5140 119.1898 59.1424 31.0443 178.8409 33 V 3.9142 7.7236 109.5991 62.9862 32.4973 177.9551 34 A 4.3253 7.7504 121.3361 54.3005 18.1883 179.3851 35 F 3.7662 8.8543 120.5772 61.5412 39.3724 177.3371 36 Q 4.1962 7.7467 115.9449 57.9886 28.3897 178.0541 37 A 4.0404 7.9834 122.9851 54.0635 19.0006 179.2204 38 V 3.6252 8.2747 115.5224 66.5935 31.7627 178.1867 39 I 3.6122 7.7908 118.5593 64.7830 36.9271 177.8752 40 K 4.2330 7.9051 119.7340 58.9440 32.0349 178.8774 41 A 4.1437 8.0923 120.8111 55.4365 18.1400 179.8204 42 G 3.6316 8.3959 104.2093 48.1475 0.0000 175.8315 43 Q 4.0147 7.8619 120.4546 58.9920 28.9063 178.3911 44 Y 4.6159 8.6311 117.6756 61.2071 37.8489 178.3158 45 A 4.2028 8.0990 122.3140 54.4720 18.7092 178.4543 46 Y 4.0808 8.4975 118.1127 61.0182 39.0991 178.9131 47 R 4.1349 8.6793 119.7614 59.6355 30.4224 178.2374 48 D 4.3899 8.1118 117.8057 56.5058 40.6075 178.3353 49 R 3.9853 8.3736 118.9331 58.1946 30.0855 177.3374 50 R 4.3377 7.7570 116.9084 58.3213 31.5525 178.0585 51 Q 3.9037 7.9657 117.1994 58.8281 28.4359 178.8826 52 R 3.7265 7.6420 120.9627 58.7642 29.9693 178.6427 53 K 4.0139 7.4571 116.1624 59.1262 32.2805 178.2359 54 R 4.1637 7.5335 118.7713 57.4743 29.8878 178.4171 55 Q 3.7089 8.4764 117.6137 59.3303 28.8643 180.0757 56 F 4.1030 7.5157 117.8095 60.9453 38.8447 176.9730 57 R 3.6244 7.4760 117.2020 59.5992 29.6484 177.8580 58 Q 3.9072 8.2622 117.0611 59.2811 28.7009 178.8754 59 L 3.8506 8.0407 120.2702 58.1758 42.2589 178.5303 60 W 4.7159 8.6610 119.4145 60.4239 29.2066 178.3717 61 I 3.8231 8.2948 119.1238 64.8792 36.6712 178.2221 62 A 4.0181 8.4569 121.5632 54.6728 17.9184 179.7645 63 R 4.0693 8.6505 116.8254 59.1964 30.6348 178.5228 64 I 4.1463 7.9504 118.7557 65.0383 37.1073 177.3142 65 N 4.5817 8.7426 116.9693 56.9522 38.6311 176.6578 66 A 3.9847 7.4009 119.7234 55.2600 18.6643 179.2892 67 A 3.9615 9.0419 119.9579 55.3312 18.5074 179.4772 68 A 3.8706 8.9178 119.3972 55.5715 18.1151 179.8343 69 R 3.8755 8.5226 116.6216 59.5605 30.2116 178.0596 70 Q 4.0827 8.1644 119.0010 59.6373 29.4229 176.9718 71 N 4.9266 8.3080 123.5942 53.6523 37.3202 176.0439 72 G 4.1302 8.6511 116.0462 45.9480 0.0000 171.7949 73 I 4.6042 7.3849 118.0969 57.9878 41.3049 175.5834 74 S 4.6416 8.3816 121.1993 58.0467 65.5459 173.4494 75 Y 4.2066 8.7927 121.3913 61.4715 38.1941 178.4969 76 S 4.0910 8.4359 112.9874 62.3697 62.9822 176.7958 77 K 3.9381 7.9715 122.6901 58.6571 32.2268 178.4336 78 F 4.4068 8.7470 121.1992 61.8179 39.2031 177.0008 79 I 3.1199 7.8289 118.2264 63.7588 37.7467 177.6588 80 N 4.3479 8.3702 118.4691 56.1082 38.2704 177.1011 81 G 3.5012 8.2883 107.8654 47.7103 0.0000 175.7355 82 L 3.8416 7.7810 120.7921 57.7247 41.8000 178.5806 83 K 3.9857 8.2239 120.5132 58.5207 31.7866 178.5620 84 K 3.9686 8.2650 121.6048 58.7532 33.6614 178.3557 85 A 4.1213 9.0074 123.1595 54.7343 15.9575 177.9906 86 S 3.4548 8.5430 116.8911 59.6894 59.8989 170.9724 87 V 3.3258 7.9124 128.3286 62.9674 31.8668 172.3643 88 E 3.6321 7.9857 119.4478 56.5121 27.4180 174.7943 89 I 3.5579 7.8475 124.6180 59.8875 36.8454 176.5573 90 D 4.3528 9.1234 120.5837 54.3900 40.1613 175.8710 91 R 3.3404 7.3219 118.1906 57.5311 30.2866 176.9690 92 K 4.5499 8.0501 109.5926 55.6038 35.4573 176.8139 93 I 2.0000 6.9562 118.8094 62.2927 38.4091 177.3258 94 L 3.9840 7.2873 118.5124 56.7041 41.8030 178.2285 95 A 4.3570 7.3372 119.9251 52.6128 17.7889 178.4629 96 D 4.4009 7.9562 118.8473 55.3329 39.8994 178.0255 97 I 4.0284 7.8484 112.1679 62.1854 37.4571 176.0940 98 A 3.9474 7.1624 122.9113 52.3549 18.4695 177.1820 99 V 4.0232 7.9003 114.2114 63.7141 33.5951 175.4919 100 F 5.0636 7.3823 118.0313 57.0584 40.8332 175.1196 101 D 4.4665 8.7558 120.0238 54.7599 39.3364 175.5448 102 K 3.9464 8.4437 120.0951 59.3138 32.4207 177.4883 103 V 3.6570 8.0959 118.0422 65.7260 31.5346 175.9327 104 A 4.3082 7.8528 121.1888 52.5853 19.3482 176.3051 105 F 4.3082 9.0789 123.5557 60.2359 39.3296 177.4206 106 T 3.6625 7.4439 116.1000 66.3565 67.9510 176.4957 107 A 3.9227 7.8365 122.3699 54.9426 18.4717 179.2513 108 L 3.8925 7.6961 117.0645 58.0312 41.7486 179.3920 109 V 3.1624 7.4956 118.3127 66.0672 31.2743 177.5143 110 E 3.7842 7.9791 118.4046 59.3060 29.0250 178.3756 111 K 3.7891 8.7241 119.9927 59.7973 32.0374 178.3511 112 A 4.0083 8.3737 120.9498 55.0797 18.4284 179.4843 113 K 3.7931 8.5268 117.1849 59.7567 31.9077 179.2866 114 A 3.9425 8.3450 119.7362 55.0108 18.3836 179.1093 115 A 4.0864 7.3114 117.2046 55.5546 18.5978 179.7766 116 L 4.0737 7.9467 115.4496 57.2261 41.7201 177.8041 117 A 4.2884 7.8805 125.0337 52.3161 18.4995 176.8951 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 A 8.26 4.26 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 2 R 8.13 3.82 0.00 1.84 1.87 0.00 3.22 0.00 0.00 3.19 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.73 0.00 3 V 8.40 4.36 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 0.90 0.00 0.00 0.98 0.00 0.00 4 K 7.86 3.74 0.00 1.79 1.71 0.00 1.95 0.00 0.00 1.62 0.00 0.00 2.89 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.44 1.48 7.81 5 R 7.91 3.79 0.00 2.01 1.92 0.00 3.17 0.00 0.00 3.21 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.60 0.00 6 G 7.42 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 0.00 0.00 0.00 7 V 8.61 3.55 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 0.69 0.00 0.00 0.92 0.00 0.00 8 I 7.70 3.68 1.86 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 1.35 0.62 0.90 0.00 0.00 9 A 7.66 4.30 1.24 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 0.00 0.00 10 R 7.54 4.10 0.00 1.97 2.05 0.00 2.91 0.00 0.00 3.32 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.66 0.00 11 A 8.37 4.39 1.44 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 0.00 0.00 12 R 7.80 3.98 0.00 2.08 2.23 0.00 3.01 0.00 0.00 3.34 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.77 0.00 13 H 8.19 4.02 0.00 3.20 3.22 0.00 5.68 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 14 K 7.50 3.97 0.00 2.07 1.83 0.00 1.87 0.00 0.00 1.63 0.00 0.00 2.96 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.45 1.46 7.81 15 K 7.85 3.85 0.00 1.95 1.92 0.00 1.84 0.00 0.00 1.67 0.00 0.00 2.99 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.44 1.63 7.81 16 I 7.80 3.75 1.99 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.47 0.28 0.67 0.00 0.00 17 L 8.03 4.49 0.00 1.79 1.84 1.01 0.60 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 18 K 7.16 4.18 0.00 1.85 1.87 0.00 1.75 0.00 0.00 1.79 0.00 0.00 2.86 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.21 1.25 7.81 19 Q 8.07 4.04 0.00 2.04 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.53 0.00 0.00 0.00 0.00 0.00 2.34 2.44 0.00 20 A 7.42 3.46 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 21 K 7.73 3.54 0.00 1.69 1.74 0.00 1.66 0.00 0.00 1.65 0.00 0.00 3.00 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.49 1.52 7.81 22 G 8.89 4.10 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 0.00 0.00 0.00 23 Y 7.76 4.67 0.00 2.97 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 Y 8.68 4.42 0.00 3.03 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 25 G 6.92 3.36 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 0.00 26 A 8.23 4.16 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 27 R 7.42 4.04 0.00 2.42 2.30 0.00 3.06 0.00 0.00 3.06 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.66 0.00 28 S 7.67 4.76 0.00 3.90 3.78 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 29 R 8.24 4.68 0.00 1.94 2.01 0.00 2.88 0.00 0.00 3.22 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.46 0.00 30 V 8.31 4.49 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 0.73 0.00 0.00 1.00 0.00 0.00 31 Y 8.17 5.34 0.00 3.18 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 32 R 7.51 3.28 0.00 1.94 2.00 0.00 3.24 0.00 0.00 3.37 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.92 0.00 33 V 7.72 3.91 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 0.88 0.00 0.00 0.94 0.00 0.00 34 A 7.75 4.33 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 35 F 8.85 3.77 0.00 2.43 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 36 Q 7.75 4.20 0.00 2.38 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.52 0.00 0.00 0.00 0.00 0.00 2.28 2.51 0.00 37 A 7.98 4.04 1.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.27 3.63 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 1.02 0.00 0.00 0.95 0.00 0.00 39 I 7.79 3.61 1.92 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.43 0.97 0.00 0.00 40 K 7.91 4.23 0.00 1.88 1.58 0.00 0.61 0.00 0.00 0.97 0.00 0.00 2.31 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.20 1.18 7.81 41 A 8.09 4.14 1.47 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 0.00 0.00 42 G 8.40 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 43 Q 7.86 4.01 0.00 2.16 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.67 0.00 0.00 0.00 0.00 0.00 2.31 2.34 0.00 44 Y 8.63 4.62 0.00 3.03 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 A 8.10 4.20 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 8.50 4.08 0.00 2.98 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 R 8.68 4.13 0.00 2.11 2.07 0.00 3.19 0.00 0.00 3.29 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.75 0.00 48 D 8.11 4.39 0.00 2.83 2.63 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 49 R 8.37 3.99 0.00 1.89 1.81 0.00 3.25 0.00 0.00 3.20 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.65 0.00 50 R 7.76 4.34 0.00 2.01 1.86 0.00 3.33 0.00 0.00 3.05 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.54 0.00 51 Q 7.97 3.90 0.00 1.98 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.88 0.00 0.00 0.00 0.00 0.00 2.39 2.38 0.00 52 R 7.64 3.73 0.00 1.72 1.81 0.00 3.14 0.00 0.00 3.34 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.20 0.00 53 K 7.46 4.01 0.00 1.78 1.87 0.00 1.72 0.00 0.00 1.71 0.00 0.00 3.21 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.49 1.45 7.81 54 R 7.53 4.16 0.00 1.90 1.78 0.00 3.09 0.00 0.00 3.11 7.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.81 0.00 55 Q 8.48 3.71 0.00 1.56 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.77 0.00 0.00 0.00 0.00 0.00 2.21 2.53 0.00 56 F 7.52 4.10 0.00 2.50 1.70 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 57 R 7.48 3.62 0.00 1.91 1.89 0.00 3.25 0.00 0.00 3.37 7.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.94 0.00 58 Q 8.26 3.91 0.00 2.19 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.51 0.00 0.00 0.00 0.00 0.00 2.32 2.33 0.00 59 L 8.04 3.85 0.00 1.68 1.69 0.96 1.04 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 W 8.66 4.72 0.00 3.60 3.25 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 61 I 8.29 3.82 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 1.64 0.88 0.36 0.00 0.00 62 A 8.46 4.02 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 63 R 8.65 4.07 0.00 1.87 1.94 0.00 3.17 0.00 0.00 3.28 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 2.08 0.00 64 I 7.95 4.15 2.36 0.00 0.00 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 2.00 1.29 1.34 0.00 0.00 65 N 8.74 4.58 0.00 3.07 3.01 0.00 0.00 7.22 8.27 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 66 A 7.40 3.98 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 67 A 9.04 3.96 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 A 8.92 3.87 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 R 8.52 3.88 0.00 2.07 2.16 0.00 3.37 0.00 0.00 3.20 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.71 0.00 70 Q 8.16 4.08 0.00 2.04 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.56 0.00 0.00 0.00 0.00 0.00 2.40 2.48 0.00 71 N 8.31 4.93 0.00 2.84 2.42 0.00 0.00 6.77 7.82 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 72 G 8.65 4.13 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 0.00 0.00 0.00 73 I 7.38 4.60 1.82 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 1.53 0.92 0.73 0.00 0.00 74 S 8.38 4.64 0.00 4.19 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 Y 8.79 4.21 0.00 3.40 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 76 S 8.44 4.09 0.00 4.16 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 0.00 77 K 7.97 3.94 0.00 1.80 1.96 0.00 1.79 0.00 0.00 1.66 0.00 0.00 3.06 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.47 1.54 7.81 78 F 8.75 4.41 0.00 2.98 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 79 I 7.83 3.12 1.12 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 1.19 0.66 0.00 0.00 80 N 8.37 4.35 0.00 2.89 2.92 0.00 0.00 6.99 8.20 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 81 G 8.29 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.78 3.84 0.00 1.45 1.58 -0.10 0.86 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 83 K 8.22 3.99 0.00 1.93 1.81 0.00 1.49 0.00 0.00 1.62 0.00 0.00 3.03 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.40 1.48 7.81 84 K 8.27 3.97 0.00 1.76 1.86 0.00 1.75 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.46 1.70 7.81 85 A 9.01 4.12 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 86 S 8.54 3.45 0.00 3.93 4.10 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 87 V 7.91 3.33 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 0.65 0.00 0.00 0.91 0.00 0.00 88 E 7.99 3.63 0.00 2.27 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 2.18 2.20 0.00 89 I 7.85 3.56 1.83 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 1.38 0.98 0.88 0.00 0.00 90 D 9.12 4.35 0.00 2.94 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 91 R 7.32 3.34 0.00 1.71 1.56 0.00 3.22 0.00 0.00 3.17 7.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.56 0.00 92 K 8.05 4.55 0.00 1.83 1.97 0.00 1.99 0.00 0.00 1.88 0.00 0.00 3.14 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.42 1.44 7.81 93 I 6.96 2.00 0.56 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 0.91 0.61 0.44 0.00 0.00 94 L 7.29 3.98 0.00 1.78 1.60 0.82 0.60 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 95 A 7.34 4.36 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 96 D 7.96 4.40 0.00 2.69 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 97 I 7.85 4.03 1.94 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.70 0.96 0.00 0.00 98 A 7.16 3.95 0.40 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 99 V 7.90 4.02 1.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.39 0.00 0.00 0.71 0.00 0.00 100 F 7.38 5.06 0.00 3.11 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 0.00 101 D 8.76 4.47 0.00 2.94 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 0.00 102 K 8.44 3.95 0.00 1.79 1.88 0.00 1.85 0.00 0.00 1.61 0.00 0.00 2.99 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.43 1.58 7.81 103 V 8.10 3.66 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 0.94 0.00 0.00 0.96 0.00 0.00 104 A 7.85 4.31 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 F 9.08 4.31 0.00 3.28 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 0.00 106 T 7.44 3.66 4.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 107 A 7.84 3.92 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 0.00 108 L 7.70 3.89 0.00 1.73 1.82 1.11 0.90 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 0.00 109 V 7.50 3.16 1.94 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 0.44 0.00 0.00 -0.16 0.00 0.00 110 E 7.98 3.78 0.00 2.07 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 0.00 111 K 8.72 3.79 0.00 1.84 1.98 0.00 1.55 0.00 0.00 1.64 0.00 0.00 3.04 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.43 1.52 7.81 112 A 8.37 4.01 1.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 K 8.53 3.79 0.00 1.88 1.87 0.00 1.60 0.00 0.00 1.61 0.00 0.00 2.87 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.43 1.63 7.81 114 A 8.34 3.94 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 0.00 115 A 7.31 4.09 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 0.00 116 L 7.95 4.07 0.00 1.75 1.75 1.05 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 117 A 7.88 4.29 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