NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 7 L 4.4324 8.1844 120.6412 54.8788 43.1247 175.3911 8 H 4.9281 8.6516 120.9948 53.8969 32.5501 171.4251 9 K 4.6505 9.3689 125.8565 56.0506 33.7168 175.5755 10 E 4.9799 9.1294 122.9570 53.7090 33.4121 173.7825 11 P 4.9868 0.0000 0.0000 63.1022 32.4228 174.9292 12 A 5.0244 8.6244 122.3836 51.0700 23.1364 175.2484 13 T 4.6385 8.5680 114.8678 61.2807 71.9281 174.0621 14 L 4.1902 8.7297 128.1263 56.0675 42.3131 175.6579 15 I 4.3763 8.5167 126.1715 62.3380 38.9549 176.0522 16 K 4.5325 7.6151 120.3828 55.3597 35.4760 174.0933 17 A 4.5784 8.7041 130.3153 51.8006 19.5529 176.9593 18 I 4.2715 7.8421 121.8669 62.3010 39.0805 175.1308 19 D 4.4162 7.5553 117.1443 53.2345 43.6218 176.2373 20 G 3.8677 8.9470 110.9521 47.7884 0.0000 173.8788 21 D 4.9109 8.0812 116.2903 52.9639 40.8986 175.1153 22 T 5.3363 7.7751 116.3303 61.9193 72.4942 173.2874 23 V 4.8085 8.8565 124.8033 59.8469 35.3557 174.0410 24 K 4.9616 9.0152 125.5370 55.3423 33.6404 175.1909 25 L 5.2940 9.3846 126.8139 53.1341 46.6487 175.3661 26 M 4.8157 9.0459 122.3932 55.0148 33.4845 174.2834 27 Y 5.0357 9.0051 128.3247 55.8722 41.7555 175.7390 28 K 3.7480 9.4638 127.8444 57.4833 29.6638 176.1543 29 G 4.0652 8.3875 105.6035 45.1596 0.0000 173.2393 30 Q 4.7933 7.8189 117.4021 53.3184 32.0143 173.4143 31 P 4.8733 0.0000 0.0000 63.5519 32.2942 175.4084 32 M 4.7829 9.2717 122.3228 54.7633 36.3729 173.3477 33 T 4.9091 8.4307 121.8522 62.6785 70.7543 173.4847 34 F 5.0358 9.5663 124.9460 55.5891 42.3327 174.1783 35 R 4.7713 8.7576 124.4073 54.9419 31.4226 175.4048 36 L 4.4279 8.7429 127.9189 54.5305 42.1016 177.2422 37 L 3.8769 8.5020 124.4065 55.5172 42.8949 177.8328 38 L 3.9659 8.7952 120.6025 55.3058 39.0970 173.8959 39 V 4.9949 7.2573 110.7180 59.6059 34.8568 174.9511 40 D 4.8943 8.9629 123.4515 52.7417 43.6865 175.2280 41 I 4.4460 8.3022 124.1525 58.5323 39.3515 174.9255 42 P 5.2672 0.0000 0.0000 65.5631 29.8728 175.6404 43 E 3.8137 6.4980 117.8101 53.8862 32.0427 176.2942 44 T 4.2419 8.3736 114.5375 62.0985 70.3285 174.5875 45 K 4.3074 7.9759 121.1581 55.2013 31.5233 175.0763 46 H 4.8774 8.2358 123.1959 53.1655 33.0900 172.1516 47 P 3.9722 0.0000 0.0000 65.8987 30.7959 175.9106 48 K 4.4104 6.7615 113.9924 55.7083 34.8794 173.9612 49 K 4.6482 7.9552 132.3195 55.2203 32.0476 177.7955 50 G 3.9609 8.9954 102.4861 46.2280 0.0000 170.9958 51 V 3.1211 7.5126 121.1765 61.9987 28.6759 169.4729 52 E 3.7014 7.8442 123.0492 54.1741 30.9179 176.4333 53 K 3.9809 8.3108 124.7137 58.8105 32.8776 176.7062 54 Y 4.6019 8.0087 121.0157 59.1253 36.0924 171.2228 55 G 4.1418 8.1604 108.8448 46.9641 0.0000 174.0005 56 P 4.3071 0.0000 0.0000 65.2158 31.3643 178.6267 57 E 4.0154 8.1827 116.7476 59.1890 29.4299 179.0353 58 A 4.0097 8.5347 121.3416 55.3151 18.5020 179.6423 59 S 4.1290 8.5650 111.8826 61.5033 62.3704 176.2713 60 A 4.0623 8.2998 123.7752 54.7514 18.1050 179.3636 61 F 3.9451 8.6127 119.5864 61.8425 39.5459 177.4252 62 T 3.9232 8.3066 115.4135 66.4600 68.2343 176.2200 63 K 3.8368 8.0429 121.4240 59.7696 32.2119 178.9009 64 K 3.9489 8.1275 118.5564 59.5670 31.6907 179.0773 65 M 3.8578 7.6248 117.5914 58.5497 31.9339 178.2185 66 V 3.8789 7.8682 112.1981 63.6849 31.7495 178.4047 67 E 3.9879 8.4145 118.1577 59.1862 29.4013 177.8023 68 N 4.5107 7.8949 113.9694 54.1044 39.1569 175.5273 69 A 5.0094 7.1814 120.1120 51.4036 19.0692 177.6402 70 K 4.2285 8.9107 119.5614 57.6619 33.0691 177.5494 71 K 4.6356 8.2986 118.0538 54.5213 35.6091 175.4659 72 I 5.0209 8.4202 125.4022 59.6128 40.0670 174.5318 73 E 5.2053 9.2598 124.9053 54.5617 33.9864 174.7165 74 V 4.6032 8.8374 121.9664 61.0726 34.7822 174.2610 75 E 5.0496 8.9270 127.3785 54.3863 32.0184 174.8591 76 F 4.6042 8.9984 125.6411 57.6268 40.1566 175.3861 77 D 4.9829 8.6176 121.0386 53.2153 43.1861 175.7926 78 K 4.4403 9.1456 117.9131 57.0955 33.6044 177.3345 79 G 4.3906 7.7750 110.5275 44.2769 0.0000 173.3588 80 Q 4.1219 8.6413 119.8200 56.5099 29.3763 176.4748 81 R 4.6623 8.5880 119.4663 56.3571 31.1788 175.8871 82 T 5.1068 7.5349 107.0801 59.8688 72.1314 173.1796 83 D 4.8880 8.4745 123.0641 51.6616 41.7126 176.9301 84 K 4.0251 8.3566 116.8315 59.2190 32.7116 176.9510 85 Y 4.3142 7.9649 116.1727 57.8127 38.0460 176.1611 86 G 3.9260 8.1936 108.2707 45.3777 0.0000 173.8979 87 R 4.2760 8.2298 119.6215 55.2498 31.5269 176.4272 88 G 3.6416 8.4627 111.2498 46.1906 0.0000 172.4016 89 L 5.1851 8.9263 124.5713 53.1574 43.0741 175.6733 90 A 4.4125 8.3291 124.5519 50.9079 23.5196 174.1049 91 Y 4.7882 8.5111 117.2084 57.2568 39.8617 175.1375 92 I 4.8153 8.5299 123.9557 59.6646 40.4550 174.0753 93 Y 5.0842 9.2638 123.7618 56.0422 41.2033 174.5825 94 A 4.8436 9.1908 125.4807 50.1023 21.6819 176.2556 95 D 4.3245 9.9616 125.5890 56.0270 38.9746 176.0297 96 G 4.0159 8.2976 104.1458 45.5010 0.0000 173.2301 97 K 4.6090 7.8800 120.1199 54.4528 34.2631 175.2953 98 M 3.9747 8.4679 123.0303 55.0932 33.1699 177.1804 99 V 3.6218 8.6752 127.1724 66.0511 31.6767 177.5863 100 N 4.2991 8.0587 115.8114 56.5356 38.4589 176.8109 101 E 3.9099 8.0709 119.7150 59.0757 29.8442 178.3335 102 A 4.0731 8.1330 120.8664 55.2540 18.3991 179.5372 103 L 3.4537 8.0712 117.3788 57.8167 41.6292 180.0582 104 V 3.7121 7.4980 118.2202 66.0583 31.3008 178.0357 105 R 4.0212 8.2236 117.6629 59.2253 29.9721 177.3363 106 Q 4.2426 7.8655 116.6024 55.5630 29.2867 175.8968 107 G 3.9585 8.0793 107.0013 47.3360 0.0000 174.6449 108 L 4.3705 7.7335 116.8395 53.9939 42.1630 176.1577 109 A 4.5909 7.4572 118.6373 51.0288 22.0838 176.1795 110 K 4.7082 8.7052 119.7310 54.7745 35.2659 175.8207 111 V 4.3623 8.8191 122.4243 62.5602 31.9545 176.0130 112 A 4.4214 8.4654 130.3150 50.9494 19.8332 176.4922 113 Y 4.1468 8.4752 116.5317 57.8345 38.4816 176.9154 114 V 3.7066 8.4655 123.2694 63.1838 32.3845 174.6056 115 Y 4.4557 8.8114 128.2092 56.7719 39.9681 175.4240 116 K 3.4695 9.3335 129.0677 57.5776 29.5699 176.5346 117 G 4.0157 8.1617 103.1794 45.8362 0.0000 173.9037 118 N 4.8177 7.8300 118.4492 51.8765 37.2747 174.0948 119 N 5.1801 8.2035 115.8400 52.4281 39.0338 177.0855 120 T 3.8419 8.6585 117.7511 67.2827 68.6304 174.8806 121 H 4.8624 7.9985 116.2974 55.6793 29.2858 176.4340 122 E 3.9813 8.2900 123.4158 59.7148 29.3052 179.0127 123 Q 4.0036 8.0218 117.4836 58.6854 28.9395 178.0062 124 L 3.9218 7.9522 120.9139 58.4536 42.0787 179.0517 125 L 4.0439 8.2288 118.9225 57.7995 41.5534 179.7136 126 R 3.9299 8.5322 118.5009 58.8957 29.8149 179.0523 127 K 3.8344 8.4639 118.6367 59.6267 32.2607 179.0866 128 A 3.9752 7.8567 120.5808 55.2107 18.2545 179.3259 129 E 3.9047 8.3343 117.6490 59.1056 29.5832 178.8437 130 A 3.7218 7.9124 121.0302 55.1263 18.5618 179.4313 131 Q 3.7741 7.8080 117.6453 59.1918 29.1023 178.2539 132 A 4.0243 7.7304 121.4951 54.6542 18.3553 179.5358 133 K 3.2293 7.4176 118.5470 59.0691 31.8948 179.0035 134 K 3.9154 7.9551 119.3276 58.6706 32.1340 177.5722 135 E 4.3670 7.6517 115.7953 54.7219 29.9818 175.6771 136 K 4.0340 7.8816 118.3632 57.2609 30.5690 175.1409 137 L 4.5250 8.2171 118.4801 55.3949 44.2297 178.3049 138 N 3.9952 9.6138 120.7281 54.0667 37.7667 176.3382 139 I 2.9826 5.4200 119.5416 63.7908 38.1270 177.6406 140 W 4.7363 7.8630 119.5739 56.3755 29.0186 176.4007 141 S 4.7732 8.0903 119.5114 57.9866 62.6191 173.9367 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 7 L 8.18 4.43 0.00 1.82 1.82 1.19 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 8 H 8.65 4.93 0.00 3.21 3.22 0.00 5.92 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 K 9.37 4.65 0.00 1.55 1.62 0.00 1.48 0.00 0.00 1.35 0.00 0.00 2.30 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.99 1.25 7.81 10 E 9.13 4.98 0.00 2.15 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 2.36 2.41 0.00 11 P 0.00 4.99 0.00 2.09 2.06 0.00 3.77 0.00 0.00 3.68 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 12 A 8.62 5.02 1.26 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 0.00 0.00 13 T 8.57 4.64 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 14 L 8.73 4.19 0.00 1.63 1.58 0.93 1.01 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 15 I 8.52 4.38 2.03 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 1.15 0.80 0.94 0.00 0.00 16 K 7.62 4.53 0.00 1.81 1.61 0.00 1.71 0.00 0.00 1.83 0.00 0.00 2.85 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.42 1.44 7.81 17 A 8.70 4.58 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 18 I 7.84 4.27 2.02 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 1.20 0.98 0.90 0.00 0.00 19 D 7.56 4.42 0.00 2.60 2.45 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 20 G 8.95 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 21 D 8.08 4.91 0.00 2.81 2.85 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.78 5.34 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 1.26 0.00 0.00 23 V 8.86 4.81 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 0.77 0.00 0.00 0.99 0.00 0.00 24 K 9.02 4.96 0.00 1.90 1.86 0.00 1.60 0.00 0.00 1.68 0.00 0.00 2.87 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.43 1.63 7.81 25 L 9.38 5.29 0.00 1.71 1.53 0.41 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 26 M 9.05 4.82 0.00 2.19 2.01 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 2.62 2.56 0.00 27 Y 9.01 5.04 0.00 3.31 3.07 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 28 K 9.46 3.75 0.00 1.27 1.60 0.00 1.59 0.00 0.00 0.61 0.00 0.00 2.81 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.13 0.96 7.81 29 G 8.39 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 30 Q 7.82 4.79 0.00 2.10 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.92 0.00 0.00 0.00 0.00 0.00 2.32 2.50 0.00 31 P 0.00 4.87 0.00 2.00 2.08 0.00 3.74 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 2.06 2.13 0.00 32 M 9.27 4.78 0.00 1.97 2.03 0.00 0.00 0.00 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.37 0.00 33 T 8.43 4.91 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 1.21 0.00 0.00 34 F 9.57 5.04 0.00 3.00 2.82 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 35 R 8.76 4.77 0.00 1.90 1.75 0.00 3.27 0.00 0.00 3.13 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.59 0.00 36 L 8.74 4.43 0.00 1.61 1.58 0.94 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 37 L 8.50 3.88 0.00 1.06 1.28 0.37 0.32 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 38 L 8.80 3.97 0.00 2.01 1.88 1.12 0.98 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 39 V 7.26 4.99 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 0.78 0.00 0.00 0.93 0.00 0.00 40 D 8.96 4.89 0.00 2.63 2.53 0.00 0.00 0.00 0.00 0.00 0.00 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 8.30 4.45 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 1.31 0.51 0.95 0.00 0.00 42 P 0.00 5.27 0.00 2.31 2.08 0.00 3.88 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 1.97 0.00 43 E 6.50 3.81 0.00 1.94 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 2.44 2.38 0.00 44 T 8.37 4.24 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 1.28 0.00 0.00 45 K 7.98 4.31 0.00 1.91 1.79 0.00 1.56 0.00 0.00 1.62 0.00 0.00 3.05 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.37 1.44 7.81 46 H 8.24 4.88 0.00 3.06 3.05 0.00 5.71 0.00 0.00 0.00 0.00 6.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 P 0.00 3.97 0.00 2.06 2.11 0.00 3.56 0.00 0.00 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.85 0.00 48 K 6.76 4.41 0.00 1.78 1.70 0.00 1.75 0.00 0.00 1.64 0.00 0.00 3.00 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.29 1.28 7.81 49 K 7.96 4.65 0.00 1.62 0.89 0.00 1.69 0.00 0.00 1.56 0.00 0.00 2.72 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.19 1.41 7.81 50 G 9.00 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 51 V 7.51 3.12 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 0.72 0.00 0.00 0.92 0.00 0.00 52 E 7.84 3.70 0.00 2.22 1.95 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 2.35 2.30 0.00 53 K 8.31 3.98 0.00 1.85 1.66 0.00 1.62 0.00 0.00 1.69 0.00 0.00 2.97 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.35 1.44 7.81 54 Y 8.01 4.60 0.00 3.13 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 55 G 8.16 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 0.00 0.00 0.00 0.00 56 P 0.00 4.31 0.00 2.15 2.11 0.00 3.52 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.16 0.00 57 E 8.18 4.02 0.00 2.32 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 0.00 2.50 2.49 0.00 58 A 8.53 4.01 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 59 S 8.57 4.13 0.00 4.10 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 60 A 8.30 4.06 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 61 F 8.61 3.95 0.00 3.26 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 62 T 8.31 3.92 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 63 K 8.04 3.84 0.00 1.95 2.03 0.00 1.64 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.52 1.62 7.81 64 K 8.13 3.95 0.00 1.71 1.71 0.00 1.86 0.00 0.00 1.52 0.00 0.00 2.98 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.41 1.44 7.81 65 M 7.62 3.86 0.00 1.99 1.78 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 2.48 2.50 0.00 66 V 7.87 3.88 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 0.83 0.00 0.00 1.02 0.00 0.00 67 E 8.41 3.99 0.00 2.09 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 2.27 0.00 68 N 7.89 4.51 0.00 2.84 2.82 0.00 0.00 7.01 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 A 7.18 5.01 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 70 K 8.91 4.23 0.00 1.75 1.87 0.00 1.69 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.40 1.61 7.81 71 K 8.30 4.64 0.00 1.81 1.66 0.00 1.61 0.00 0.00 1.64 0.00 0.00 2.80 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.34 1.38 7.81 72 I 8.42 5.02 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 1.34 0.95 0.85 0.00 0.00 73 E 9.26 5.21 0.00 1.89 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 0.00 2.20 2.22 0.00 74 V 8.84 4.60 1.69 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 -0.07 0.00 0.00 0.88 0.00 0.00 75 E 8.93 5.05 0.00 2.32 2.31 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 2.57 2.46 0.00 76 F 9.00 4.60 0.00 3.07 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 77 D 8.62 4.98 0.00 2.74 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 78 K 9.15 4.44 0.00 1.90 1.96 0.00 1.69 0.00 0.00 1.76 0.00 0.00 3.06 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.44 1.41 7.81 79 G 7.77 4.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 Q 8.64 4.12 0.00 2.15 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.90 6.78 0.00 0.00 0.00 0.00 0.00 2.36 2.35 0.00 81 R 8.59 4.66 0.00 1.71 1.61 0.00 2.88 0.00 0.00 2.86 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.78 0.00 82 T 7.53 5.11 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 1.18 0.00 0.00 83 D 8.47 4.89 0.00 2.82 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 84 K 8.36 4.03 0.00 1.53 1.83 0.00 0.87 0.00 0.00 1.36 0.00 0.00 2.99 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.28 1.05 7.81 85 Y 7.96 4.31 0.00 3.13 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 86 G 8.19 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 87 R 8.23 4.28 0.00 2.07 1.79 0.00 3.10 0.00 0.00 3.13 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.61 0.00 88 G 8.46 3.64 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 0.00 0.00 0.00 0.00 0.00 0.00 89 L 8.93 5.19 0.00 1.58 1.61 0.96 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 90 A 8.33 4.41 0.79 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 0.00 0.00 0.00 0.00 0.00 0.00 91 Y 8.51 4.79 0.00 2.98 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 92 I 8.53 4.82 1.76 0.00 0.00 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.78 0.85 0.00 0.00 93 Y 9.26 5.08 0.00 2.85 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 94 A 9.19 4.84 1.18 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 0.00 0.00 95 D 9.96 4.32 0.00 2.80 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 96 G 8.30 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 97 K 7.88 4.61 0.00 1.95 1.73 0.00 1.71 0.00 0.00 1.60 0.00 0.00 2.91 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.40 1.51 7.81 98 M 8.47 3.97 0.00 1.89 1.64 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 2.33 0.00 99 V 8.68 3.62 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 1.03 0.00 0.00 0.93 0.00 0.00 100 N 8.06 4.30 0.00 2.90 2.93 0.00 0.00 6.76 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 0.00 101 E 8.07 3.91 0.00 1.97 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 2.37 2.35 0.00 102 A 8.13 4.07 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 0.00 0.00 0.00 0.00 0.00 103 L 8.07 3.45 0.00 1.84 1.62 1.00 0.58 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 0.00 104 V 7.50 3.71 2.19 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 1.18 0.00 0.00 0.96 0.00 0.00 105 R 8.22 4.02 0.00 1.84 2.11 0.00 3.34 0.00 0.00 3.14 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.69 0.00 106 Q 7.87 4.24 0.00 2.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.25 0.00 0.00 0.00 0.00 0.00 2.02 2.28 0.00 107 G 8.08 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 0.00 108 L 7.73 4.37 0.00 1.30 1.50 0.40 0.86 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 0.00 109 A 7.46 4.59 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 0.00 0.00 0.00 0.00 0.00 110 K 8.71 4.71 0.00 1.69 1.93 0.00 1.59 0.00 0.00 1.43 0.00 0.00 2.64 0.00 0.00 2.57 0.00 0.00 0.00 0.00 1.25 1.11 7.81 111 V 8.82 4.36 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 0.73 0.00 0.00 0.93 0.00 0.00 112 A 8.47 4.42 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 0.00 113 Y 8.48 4.15 0.00 3.02 2.97 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 0.00 114 V 8.47 3.71 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 0.86 0.00 0.00 1.01 0.00 0.00 115 Y 8.81 4.46 0.00 3.08 2.85 0.00 0.00 0.00 0.00 0.00 0.00 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 K 9.33 3.47 0.00 1.72 1.70 0.00 1.47 0.00 0.00 1.30 0.00 0.00 2.66 0.00 0.00 2.86 0.00 0.00 0.00 0.00 0.30 0.51 7.81 117 G 8.16 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 0.00 118 N 7.83 4.82 0.00 2.98 2.86 0.00 0.00 6.66 7.99 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 0.00 119 N 8.20 5.18 0.00 2.94 3.01 0.00 0.00 6.12 7.22 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 0.00 120 T 8.66 3.84 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 1.06 0.00 0.00 121 H 8.00 4.86 0.00 2.82 3.07 0.00 5.63 0.00 0.00 0.00 0.00 6.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 E 8.29 3.98 0.00 2.23 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 2.34 2.42 0.00 123 Q 8.02 4.00 0.00 2.11 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.64 0.00 0.00 0.00 0.00 0.00 2.46 2.36 0.00 124 L 7.95 3.92 0.00 1.74 1.82 0.96 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 125 L 8.23 4.04 0.00 1.88 1.72 1.01 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 126 R 8.53 3.93 0.00 1.95 1.95 0.00 3.29 0.00 0.00 3.14 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.87 0.00 127 K 8.46 3.83 0.00 2.06 1.84 0.00 1.66 0.00 0.00 1.63 0.00 0.00 2.94 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.53 7.81 128 A 7.86 3.98 1.38 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 0.00 0.00 129 E 8.33 3.90 0.00 2.17 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 0.00 2.14 2.56 0.00 130 A 7.91 3.72 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 0.00 131 Q 7.81 3.77 0.00 2.08 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.75 0.00 0.00 0.00 0.00 0.00 2.32 2.48 0.00 132 A 7.73 4.02 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 0.00 133 K 7.42 3.23 0.00 0.79 1.25 0.00 1.22 0.00 0.00 0.61 0.00 0.00 2.20 0.00 0.00 2.46 0.00 0.00 0.00 0.00 1.02 0.25 7.81 134 K 7.96 3.92 0.00 1.77 1.89 0.00 1.79 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.40 1.42 7.81 135 E 7.65 4.37 0.00 2.00 1.95 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 2.25 2.49 0.00 136 K 7.88 4.03 0.00 2.00 1.90 0.00 1.68 0.00 0.00 1.68 0.00 0.00 2.90 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.39 1.40 7.81 137 L 8.22 4.53 0.00 1.96 1.75 0.97 0.62 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 0.00 138 N 9.61 4.00 0.00 2.68 1.76 0.00 0.00 6.88 7.26 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 0.00 139 I 5.42 2.98 1.21 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.55 -0.36 0.31 0.00 0.00 140 W 7.86 4.74 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 0.00 141 S 8.09 4.77 0.00 4.02 3.99 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 0.00 0.00 0.00