NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 S 4.5124 8.1927 115.5591 57.6126 65.3871 172.9673 3 L 5.1077 7.8875 120.7200 52.6799 44.6493 174.1209 4 A 4.9446 9.8820 129.4037 50.2904 22.7226 174.6635 5 I 4.9711 8.2134 119.4227 59.4805 40.8685 174.3869 6 D 4.9067 9.0744 126.4148 52.5654 43.2791 174.6272 7 L 5.2743 8.3827 125.4078 53.4098 44.7538 175.6547 8 E 4.6264 8.6063 120.1144 55.2914 33.7881 174.0231 9 V 4.7651 8.5475 126.8427 61.3451 33.3550 174.7435 10 K 4.5277 8.4519 128.4757 55.5365 34.5776 176.6188 11 Q 3.4762 8.3149 124.5415 57.5657 27.2245 174.0381 12 D 4.8746 8.7658 125.9707 53.8963 39.6320 175.0910 13 V 4.8548 7.8804 119.4373 61.6449 34.9096 174.1334 14 L 5.0230 8.6837 127.0386 53.4304 45.1077 175.0407 15 I 4.7267 8.8691 128.5267 60.0971 39.1121 174.9307 16 V 4.7338 8.8499 127.8179 61.2162 33.8977 174.2348 17 R 5.1210 8.9733 127.4829 54.3975 32.4842 175.0142 18 L 5.1928 8.7675 123.4212 52.9271 44.8209 175.1998 19 S 4.9098 8.8036 118.8385 58.0002 64.6168 172.5081 20 G 3.9343 9.1423 114.0523 43.9561 0.0000 171.4782 21 E 4.8326 8.2432 121.6180 55.7861 30.1380 176.8047 22 L 4.5848 9.4880 129.7244 54.1064 43.1230 174.5701 23 D 5.4059 8.8701 127.7929 52.7008 42.6937 174.9386 24 H 4.0408 9.4573 117.0909 60.3526 29.9269 176.6503 25 H 4.4061 8.5205 118.5197 59.5846 29.6496 177.2663 26 T 4.0515 8.6290 109.6727 64.0861 68.7534 176.1501 27 A 4.0784 8.4645 124.1699 54.4872 18.1950 178.9826 28 E 3.9608 7.8345 117.0857 59.2113 29.7671 178.5902 29 E 3.9568 7.9405 118.3393 58.9334 29.4014 179.0398 30 L 3.9203 7.8340 120.1609 58.0308 42.1751 178.6849 31 R 3.8448 7.8851 118.3417 59.6007 30.0758 177.7872 32 E 3.9321 8.3144 118.3886 59.9328 29.4106 179.6698 33 Q 3.9458 8.0292 117.1858 59.0793 28.8274 179.0905 34 V 3.9118 7.9572 119.3887 66.2364 31.6681 177.8741 35 T 3.8089 8.1764 109.7351 64.9542 68.2185 175.4618 36 D 4.2607 8.5532 120.9556 57.1805 41.2736 178.3919 37 V 3.5930 8.6034 119.7571 66.1643 31.2969 178.0186 38 L 4.0126 8.4547 117.8299 57.4716 41.4649 178.7626 39 E 4.0644 8.0528 118.7778 58.4412 29.6175 176.9947 40 N 4.7742 7.6913 114.5336 53.3679 39.9446 174.9400 41 R 4.5796 7.8915 115.3021 53.8956 33.9027 175.5976 42 A 4.1775 8.4229 123.2094 51.7279 17.0862 176.1852 43 I 4.4887 7.9642 121.4169 60.4114 38.9408 175.8537 44 R 4.2826 8.7724 126.3275 57.5314 31.7419 175.5399 45 H 5.5323 7.9638 113.8522 53.9463 33.6866 172.5868 46 I 5.1161 8.4954 119.9345 59.6441 41.4881 174.6290 47 V 4.7639 8.6151 125.9755 61.1310 34.2866 173.9575 48 L 4.8832 8.8913 131.5619 53.6363 43.6881 175.0771 49 N 5.0617 9.3778 127.9030 52.3842 39.5505 174.5419 50 L 4.5368 8.6093 126.6774 54.5963 42.0033 179.1671 51 G 3.9365 8.4636 111.0261 48.7076 0.0000 175.4552 52 Q 4.6310 7.6062 118.2402 55.3199 29.9851 175.1585 53 L 4.9372 7.9287 122.9780 54.0267 42.6249 175.7100 54 T 4.5879 8.1961 116.7790 60.3991 69.9252 174.2405 55 F 4.9927 7.3225 128.8069 58.8344 42.3877 172.0690 56 M 5.5265 7.9715 125.0692 52.9767 35.5243 173.2044 57 D 4.8897 8.0276 123.5933 51.2081 43.1973 175.9813 58 S 3.6870 8.8103 111.4754 61.5953 62.2688 175.6864 59 S 4.5059 8.5688 114.2925 59.3263 62.7500 175.1791 60 G 3.9815 8.7220 108.9072 45.8436 0.0000 175.9935 61 L 4.0505 7.8455 120.8002 57.6403 41.7607 179.3805 62 G 3.6895 7.8343 105.5008 48.0258 0.0000 176.0283 63 V 3.8917 7.7598 120.9436 64.2338 31.2792 178.4439 64 I 3.7191 7.4093 120.8896 64.2926 37.1075 177.9474 65 L 3.9538 8.7156 121.8019 57.9490 41.3899 179.2015 66 G 3.6796 8.5565 106.0788 48.1197 0.0000 175.9312 67 R 4.1363 7.8368 121.1172 58.6934 30.1384 178.2946 68 Y 3.8929 8.5790 119.9786 60.9430 38.2060 178.5976 69 K 4.2048 8.4863 118.6381 58.8443 31.9532 179.5184 70 Q 4.0088 7.4028 117.7644 59.0133 29.0369 178.2248 71 I 3.8430 7.8920 120.9424 63.8931 37.1483 178.2601 72 K 3.7804 7.7540 120.3837 59.5423 31.7032 178.5565 73 N 4.4663 7.7236 114.7586 55.1914 38.3838 176.7229 74 V 4.3395 7.4135 111.3088 60.1230 32.3894 175.4885 75 G 3.8017 7.8992 105.7508 46.8035 0.0000 173.9204 76 G 4.7771 7.5264 107.8654 43.4062 0.0000 172.9783 77 Q 4.7901 8.7099 116.6429 54.1874 33.8324 174.0861 78 M 5.2059 8.4031 119.3251 53.8674 35.3650 174.2405 79 V 5.0024 8.8203 125.1699 61.2863 35.2281 174.2054 80 V 5.0512 9.2189 127.4125 61.4561 34.5519 173.9450 81 C 5.2883 8.9522 119.2268 55.8207 33.8431 173.1265 82 A 3.5488 8.1414 118.4662 53.1589 16.2468 177.6861 83 V 3.6350 7.8230 120.0390 63.4008 32.1931 175.8401 84 S 4.3541 8.3453 121.9372 57.5578 63.6559 173.3824 85 P 4.1839 0.0000 0.0000 65.4609 31.2539 178.4304 86 A 4.0192 7.8672 119.2468 55.2278 18.2569 179.4347 87 V 3.3596 7.7252 115.9242 66.0470 31.4458 178.3861 88 K 3.3773 7.8056 118.9935 59.0729 31.9419 178.7902 89 R 3.8984 7.8428 119.2994 59.0887 29.6615 178.1634 90 L 4.2338 7.7805 118.3823 56.9311 41.7507 178.9784 91 F 4.5345 8.1011 118.3197 59.9497 39.2976 177.5417 92 D 4.5348 8.0632 118.3547 57.2701 40.6671 177.7303 93 M 4.0586 7.9827 117.8783 59.0312 32.2320 178.1023 94 S 4.3395 7.6498 112.0658 62.2539 62.9112 174.7192 95 G 3.7154 7.1918 111.1589 44.6057 0.0000 175.1549 96 L 3.7600 8.1465 123.3247 56.1280 42.1975 178.3255 97 F 4.5585 7.5795 111.3659 58.2323 37.4527 175.3857 98 K 4.6157 7.4054 120.4408 56.2770 33.0352 176.9528 99 I 4.3914 7.8455 118.2711 62.2431 41.0287 175.6218 100 I 4.7074 7.4885 110.4780 59.3252 40.8422 173.8933 101 R 4.5784 8.6676 120.9205 54.7279 31.6841 175.9147 102 V 4.6462 8.4886 124.8097 61.9271 32.7058 174.6229 103 E 4.9476 9.3188 128.0009 54.8304 32.4938 175.6717 104 A 4.4674 8.5888 119.7756 53.9965 20.9418 177.0197 105 D 4.5103 7.9298 112.9700 51.0298 42.3879 175.5805 106 E 3.9623 8.9418 119.3300 59.7336 29.2484 178.7902 107 Q 3.8978 8.1281 117.4400 59.0000 28.9472 178.4059 108 F 4.1464 8.8014 118.1626 59.6734 39.0609 177.7652 109 A 4.0217 8.0078 121.1537 55.2808 18.3575 179.6645 110 L 4.0524 8.2448 117.3801 57.7225 41.6379 179.7421 111 Q 3.9295 8.0554 119.7306 58.8808 28.8400 177.5572 112 A 4.2470 7.9815 120.0651 53.7185 18.4622 178.2932 113 L 4.4869 7.1152 114.7639 53.2305 42.4200 176.3561 114 G 3.8296 7.7823 106.7444 46.4701 0.0000 174.2169 115 V 3.7877 7.7514 119.5929 61.6146 32.2095 175.6668 116 A 4.1711 8.1971 127.9999 52.5105 18.2327 176.8236 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 S 8.19 4.51 0.00 3.94 3.97 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 3 L 7.89 5.11 0.00 1.92 1.51 1.01 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 4 A 9.88 4.94 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 5 I 8.21 4.97 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.73 0.92 0.00 0.00 6 D 9.07 4.91 0.00 2.78 2.51 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 7 L 8.38 5.27 0.00 1.55 1.55 0.93 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 8 E 8.61 4.63 0.00 2.05 1.74 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 2.21 2.24 0.00 9 V 8.55 4.77 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 0.87 0.00 0.00 0.93 0.00 0.00 10 K 8.45 4.53 0.00 1.80 1.69 0.00 1.94 0.00 0.00 1.64 0.00 0.00 2.91 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.35 1.37 7.81 11 Q 8.31 3.48 0.00 2.21 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 7.44 0.00 0.00 0.00 0.00 0.00 2.26 2.33 0.00 12 D 8.77 4.87 0.00 2.79 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 13 V 7.88 4.85 2.20 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 1.00 0.00 0.00 0.97 0.00 0.00 14 L 8.68 5.02 0.00 1.77 1.47 1.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 15 I 8.87 4.73 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.90 1.05 0.00 0.00 16 V 8.85 4.73 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 0.87 0.00 0.00 0.95 0.00 0.00 17 R 8.97 5.12 0.00 1.79 1.81 0.00 3.13 0.00 0.00 3.18 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.59 0.00 18 L 8.77 5.19 0.00 1.60 1.57 0.96 0.50 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 19 S 8.80 4.91 0.00 4.02 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 20 G 9.14 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 21 E 8.24 4.83 0.00 1.97 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 2.44 2.29 0.00 22 L 9.49 4.58 0.00 1.77 1.59 0.96 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 23 D 8.87 5.41 0.00 3.08 3.23 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 24 H 9.46 4.04 0.00 3.21 3.41 0.00 5.74 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 25 H 8.52 4.41 0.00 3.27 3.34 0.00 5.92 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 26 T 8.63 4.05 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 1.31 0.00 0.00 27 A 8.46 4.08 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 28 E 7.83 3.96 0.00 2.14 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 2.31 2.39 0.00 29 E 7.94 3.96 0.00 2.01 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 2.32 2.45 0.00 30 L 7.83 3.92 0.00 1.77 1.87 0.94 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 31 R 7.89 3.84 0.00 2.10 2.03 0.00 3.18 0.00 0.00 3.16 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.68 0.00 32 E 8.31 3.93 0.00 2.18 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 2.34 2.68 0.00 33 Q 8.03 3.95 0.00 2.13 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.81 0.00 0.00 0.00 0.00 0.00 2.38 2.76 0.00 34 V 7.96 3.91 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 1.05 0.00 0.00 0.98 0.00 0.00 35 T 8.18 3.81 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 1.31 0.00 0.00 36 D 8.55 4.26 0.00 2.85 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 37 V 8.60 3.59 2.20 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 0.98 0.00 0.00 0.96 0.00 0.00 38 L 8.45 4.01 0.00 1.61 1.70 0.90 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 39 E 8.05 4.06 0.00 2.33 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 2.32 2.34 0.00 40 N 7.69 4.77 0.00 2.69 2.84 0.00 0.00 6.77 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 41 R 7.89 4.58 0.00 1.85 1.77 0.00 3.16 0.00 0.00 3.23 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.54 0.00 42 A 8.42 4.18 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 43 I 7.96 4.49 1.85 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 1.46 0.94 0.92 0.00 0.00 44 R 8.77 4.28 0.00 1.77 1.62 0.00 2.96 0.00 0.00 3.05 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.47 0.00 45 H 7.96 5.53 0.00 3.06 3.18 0.00 5.61 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 I 8.50 5.12 1.88 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 1.12 0.75 0.93 0.00 0.00 47 V 8.62 4.76 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 1.07 0.00 0.00 0.95 0.00 0.00 48 L 8.89 4.88 0.00 1.85 1.61 1.01 0.58 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 49 N 9.38 5.06 0.00 2.79 2.73 0.00 0.00 6.80 6.67 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 50 L 8.61 4.54 0.00 1.76 1.64 1.02 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 51 G 8.46 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 52 Q 7.61 4.63 0.00 1.99 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.78 0.00 0.00 0.00 0.00 0.00 2.31 2.29 0.00 53 L 7.93 4.94 0.00 1.81 1.60 1.01 0.78 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 54 T 8.20 4.59 4.30 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 1.24 0.00 0.00 55 F 7.32 4.99 0.00 3.25 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 56 M 7.97 5.53 0.00 1.84 1.75 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 2.43 2.30 0.00 57 D 8.03 4.89 0.00 2.80 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 58 S 8.81 3.69 0.00 3.88 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 59 S 8.57 4.51 0.00 4.09 3.91 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 60 G 8.72 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 61 L 7.85 4.05 0.00 1.65 1.63 0.91 1.08 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 62 G 7.83 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 63 V 7.76 3.89 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 0.94 0.00 0.00 0.98 0.00 0.00 64 I 7.41 3.72 2.03 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 1.44 1.02 0.85 0.00 0.00 65 L 8.72 3.95 0.00 1.58 1.61 0.77 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 66 G 8.56 3.68 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 0.00 0.00 0.00 67 R 7.84 4.14 0.00 2.15 2.01 0.00 3.15 0.00 0.00 3.47 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.68 0.00 68 Y 8.58 3.89 0.00 3.14 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 69 K 8.49 4.20 0.00 2.03 1.87 0.00 1.74 0.00 0.00 1.68 0.00 0.00 2.97 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.58 1.78 7.81 70 Q 7.40 4.01 0.00 2.15 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 7.01 0.00 0.00 0.00 0.00 0.00 2.39 2.58 0.00 71 I 7.89 3.84 1.69 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.23 0.91 0.00 0.00 72 K 7.75 3.78 0.00 1.67 1.88 0.00 1.72 0.00 0.00 1.68 0.00 0.00 2.93 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.40 1.43 7.81 73 N 7.72 4.47 0.00 2.92 2.85 0.00 0.00 6.90 7.56 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 74 V 7.41 4.34 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 0.76 0.00 0.00 0.95 0.00 0.00 75 G 7.90 3.80 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 0.00 0.00 0.00 76 G 7.53 4.78 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 0.00 0.00 0.00 77 Q 8.71 4.79 0.00 1.98 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.94 6.80 0.00 0.00 0.00 0.00 0.00 2.32 2.34 0.00 78 M 8.40 5.21 0.00 2.06 1.83 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.57 0.00 79 V 8.82 5.00 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 1.06 0.00 0.00 0.95 0.00 0.00 80 V 9.22 5.05 2.29 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 1.08 0.00 0.00 1.08 0.00 0.00 81 C 8.95 5.29 0.00 3.06 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 82 A 8.14 3.55 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 83 V 7.82 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 0.40 0.00 0.00 0.90 0.00 0.00 84 S 8.35 4.35 0.00 3.99 3.97 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 85 P 0.00 4.18 0.00 2.00 2.10 0.00 3.64 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 1.99 2.10 0.00 86 A 7.87 4.02 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 87 V 7.73 3.36 1.83 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 0.48 0.00 0.00 0.82 0.00 0.00 88 K 7.81 3.38 0.00 1.74 1.83 0.00 1.63 0.00 0.00 1.58 0.00 0.00 2.91 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.34 1.50 7.81 89 R 7.84 3.90 0.00 1.99 2.07 0.00 3.12 0.00 0.00 3.15 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.64 0.00 90 L 7.78 4.23 0.00 2.02 1.82 0.91 1.02 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 91 F 8.10 4.53 0.00 3.20 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 92 D 8.06 4.53 0.00 2.77 2.48 0.00 0.00 0.00 0.00 0.00 0.00 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 M 7.98 4.06 0.00 2.07 2.28 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.60 0.00 94 S 7.65 4.34 0.00 4.06 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 95 G 7.19 3.72 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 0.00 0.00 0.00 96 L 8.15 3.76 0.00 1.53 1.58 0.51 -0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 97 F 7.58 4.56 0.00 3.39 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 98 K 7.41 4.62 0.00 1.36 1.51 0.00 1.05 0.00 0.00 1.31 0.00 0.00 2.76 0.00 0.00 2.59 0.00 0.00 0.00 0.00 0.49 0.21 7.81 99 I 7.85 4.39 1.63 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 1.19 0.39 -0.22 0.00 0.00 100 I 7.49 4.71 2.18 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.73 1.12 0.00 0.00 101 R 8.67 4.58 0.00 1.84 1.94 0.00 3.41 0.00 0.00 3.07 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.60 0.00 102 V 8.49 4.65 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 0.83 0.00 0.00 1.14 0.00 0.00 103 E 9.32 4.95 0.00 1.91 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 2.27 2.59 0.00 104 A 8.59 4.47 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 0.00 105 D 7.93 4.51 0.00 2.94 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 0.00 106 E 8.94 3.96 0.00 2.08 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 2.39 2.44 0.00 107 Q 8.13 3.90 0.00 2.16 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.69 0.00 0.00 0.00 0.00 0.00 2.42 2.32 0.00 108 F 8.80 4.15 0.00 3.19 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 0.00 109 A 8.01 4.02 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 0.00 110 L 8.24 4.05 0.00 1.80 1.71 0.90 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 111 Q 8.06 3.93 0.00 2.15 2.27 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 2.36 2.31 0.00 112 A 7.98 4.25 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.12 4.49 0.00 1.75 1.51 0.89 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 114 G 7.78 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 0.00 115 V 7.75 3.79 2.20 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 0.79 0.00 0.00 0.94 0.00 0.00 116 A 8.20 4.17 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