NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.8371 8.5298 120.1042 55.8375 33.9083 173.7181 2 K 4.7526 8.3392 119.4151 56.0047 36.7733 171.9714 3 M 4.9702 8.9619 119.1077 53.7045 35.7685 175.1511 4 V 4.6625 8.5029 126.1803 61.4044 33.8254 174.3472 5 V 4.6428 9.1434 128.8858 61.4668 33.2531 174.4656 6 V 4.5748 9.2279 129.6893 61.7444 33.0632 174.4083 7 I 4.7492 8.5010 129.2080 59.3127 39.9150 175.2701 8 R 4.4996 8.4344 126.3769 56.4363 30.0892 176.1374 9 N 4.8540 8.9348 122.4228 53.6991 39.2750 175.0421 10 D 4.6519 8.1100 116.0451 54.8593 40.3428 177.2670 11 L 4.0764 7.8335 119.2009 55.7331 42.0302 177.5971 12 G 3.8808 8.2400 105.7400 45.9655 0.0000 173.3101 13 M 4.0699 7.9490 118.7844 54.9689 32.4977 177.4653 14 G 3.9485 8.3906 109.7873 43.4662 0.0000 174.8277 15 K 4.0264 8.5473 118.8651 59.4420 31.9662 179.7059 16 G 3.6289 8.0386 105.2414 47.7742 0.0000 175.2706 17 K 3.9137 8.0176 122.0477 59.4950 32.1449 178.5422 18 M 4.1291 8.4000 119.2655 58.2997 31.7884 178.9538 19 V 3.5451 8.0103 118.2823 65.8094 31.6950 178.0500 20 A 3.8694 8.0982 120.5241 55.3294 18.3024 179.7372 21 Q 4.0066 8.5849 117.1937 58.9661 28.7839 179.0294 22 G 3.7827 8.4985 107.3058 47.7387 0.0000 175.9262 23 G 3.6584 8.1778 108.0353 47.9309 0.0000 175.5738 24 H 4.3222 8.2205 118.4248 58.5939 28.6744 177.7534 25 A 4.0429 8.1574 122.5698 55.1304 18.1192 179.7298 26 I 3.6985 8.2420 118.6696 64.7402 37.1845 178.7512 27 I 3.8557 7.8933 120.5248 64.5520 37.0383 178.4673 28 E 4.0324 8.5330 119.2944 59.2975 29.2642 179.2828 29 A 4.0408 8.5269 121.3960 54.8096 18.4376 179.3944 30 F 4.0632 8.5120 119.4174 61.6579 39.3197 177.4192 31 L 3.8169 8.1633 117.4265 57.7294 41.5103 178.7863 32 D 4.3890 7.9940 117.6436 57.1424 41.1509 178.1760 33 A 3.9484 8.3535 122.1242 54.6014 18.1691 178.9348 34 K 4.0456 7.6230 114.7554 57.9633 32.8714 178.1312 35 R 4.4312 7.5050 116.3227 56.6762 30.9068 177.4711 36 K 4.4217 7.8621 117.9374 57.4076 33.6149 176.4216 37 N 4.8176 8.5180 118.7429 50.0676 39.7900 172.2298 38 P 4.2060 0.0000 0.0000 65.9516 31.1769 177.7916 39 R 4.6389 8.0310 116.0700 55.8592 30.1572 178.0273 40 A 3.8761 8.1158 122.1249 55.3258 18.2886 179.5783 41 V 3.6829 7.6221 116.4806 66.2122 31.5283 177.6400 42 D 4.5122 7.9745 118.6588 57.6884 40.4450 178.6559 43 E 3.9806 8.9192 120.0054 59.1038 29.5460 178.4064 44 W 4.4641 8.1834 128.1962 60.6960 30.7422 177.7170 45 L 3.6600 8.3335 118.8784 57.8010 40.9957 179.7858 46 R 4.0814 7.7566 113.4637 58.2560 29.2860 177.4056 47 E 4.5371 7.4804 118.1128 55.8916 29.7659 176.4053 48 G 3.6231 7.5863 107.0803 44.7819 0.0000 174.4072 49 Q 2.0000 7.3726 115.8882 54.6829 27.9561 174.4822 50 K 3.9620 7.4036 119.3090 58.3946 33.7002 175.8123 51 K 5.2828 8.5751 123.8975 55.0176 36.4077 175.5062 52 V 4.4368 9.0428 124.3850 61.0150 34.7231 174.2572 53 V 4.7239 8.4204 127.0548 61.6330 33.5656 174.8196 54 V 5.1814 8.6810 121.8612 59.4272 35.1377 174.5547 55 K 5.7082 8.6245 119.2990 54.7057 35.8670 175.8193 56 V 4.5713 8.2708 112.9130 59.5213 36.3822 175.5082 57 N 4.8697 9.1058 117.2905 52.4183 39.3772 175.2357 58 S 4.7411 7.4875 111.2161 56.4461 66.4526 175.6348 59 E 3.9054 8.4568 123.4226 59.3270 29.4359 178.8729 60 K 3.8792 8.0259 119.1418 59.5729 32.2784 178.0847 61 E 4.0765 8.0743 119.1420 59.1069 29.5257 178.3692 62 L 3.9595 7.9701 120.2853 58.4020 42.2029 178.9990 63 I 3.7515 8.3122 119.8500 64.4453 36.9546 177.8397 64 D 4.4085 8.7075 119.9899 57.7341 40.6795 179.1538 65 I 3.7032 7.9229 119.8421 64.6073 37.1581 177.7978 66 Y 4.0615 8.0466 120.2222 60.7575 38.6170 177.8134 67 N 4.2178 8.7827 117.6342 56.3308 38.2069 177.3430 68 K 3.9708 8.4787 120.8934 58.9650 32.2129 179.1149 69 A 3.9784 8.0552 120.8880 55.2017 18.1386 179.9865 70 R 3.6564 7.6282 116.6656 59.2375 30.2072 179.0312 71 S 4.2301 8.4648 112.3305 59.9569 62.6328 174.7732 72 E 4.5986 7.6027 119.7457 55.4375 30.5610 176.6098 73 G 3.8514 8.2128 107.3646 45.6029 0.0000 173.2476 74 L 4.4062 7.5206 119.2782 52.7805 42.6892 175.3216 75 P 4.5721 0.0000 0.0000 63.4959 32.6634 174.9736 76 C 5.8183 9.1082 116.5534 59.4025 33.0913 172.5374 77 S 4.8958 8.1436 111.0630 57.7257 65.5404 173.6071 78 I 4.8823 8.0158 120.5277 59.3456 40.9679 174.0883 79 I 4.4826 8.8009 129.8052 59.4868 39.8883 174.3361 80 R 4.9074 8.4197 126.7443 54.7040 31.3606 175.2117 81 D 4.7888 9.5572 127.1887 53.7779 43.2343 174.2811 82 A 4.8391 8.3202 123.3717 49.5967 20.7967 176.9981 83 G 3.8974 8.8098 109.4963 46.2075 0.0000 173.1280 84 H 4.4977 9.5036 122.0122 58.2800 30.2263 174.9865 85 T 4.7223 7.4273 107.7145 59.5926 71.7872 174.1308 86 Q 4.0939 8.5374 118.5592 58.5660 28.5511 177.0850 87 L 4.3396 7.5357 117.6888 55.2471 41.9988 176.3961 88 E 4.7022 7.8852 116.8998 54.3471 32.4861 173.0130 89 P 4.6943 0.0000 0.0000 61.9122 32.9756 175.5060 90 G 3.9561 8.4491 108.1626 46.9896 0.0000 172.3158 91 T 4.8083 8.2951 112.9316 60.2631 71.3619 172.7044 92 L 4.6451 8.5671 127.9071 55.0638 41.8292 176.3804 93 T 4.4558 8.8551 114.8565 63.0657 71.1259 174.3164 94 A 5.1633 7.5669 121.2597 50.8376 23.2258 175.0832 95 V 4.9892 8.9607 117.8375 61.3734 35.6681 173.7446 96 A 5.2151 8.8829 127.6817 50.1871 22.5747 175.0349 97 I 4.6673 8.8023 121.8980 61.3928 40.5326 173.6611 98 G 3.7532 8.4645 114.3819 43.0033 0.0000 171.1820 99 P 4.5489 0.0000 0.0000 62.9075 32.2320 175.3359 100 E 4.5855 7.9391 120.3572 55.4701 33.4636 173.4188 101 K 4.4123 9.7420 120.6387 56.2207 32.8095 178.2883 102 D 4.3888 9.1365 124.7017 57.7769 40.2958 178.7337 103 E 3.9926 8.2818 118.8162 59.5272 29.2797 178.8972 104 K 3.9675 7.9056 116.2345 59.6706 32.4886 178.9856 105 I 3.8368 7.5739 119.4039 64.4456 36.9199 178.0865 106 D 4.3601 8.5044 120.1659 57.5294 40.4571 179.0987 107 K 3.7144 7.5823 116.4621 58.9555 32.0018 178.5773 108 I 4.2001 7.6896 119.2644 62.7427 38.1337 177.1375 109 T 4.4262 7.6383 107.7419 61.3034 69.5309 176.0191 110 G 3.8083 8.5798 111.9226 48.8930 0.0000 174.4177 111 H 4.4915 7.9592 113.6834 57.3704 29.2899 175.7912 112 L 4.2100 7.4281 120.4506 54.5799 42.1449 177.5029 113 K 4.3422 8.5580 121.4711 55.9928 33.6452 176.4477 114 L 4.5601 8.3192 122.4071 54.3172 42.6286 177.0752 115 L 4.1096 8.4504 123.2698 55.4567 41.9851 176.6450 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 M 8.53 4.84 0.00 2.07 2.24 0.00 0.00 0.00 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.47 0.00 2 K 8.34 4.75 0.00 1.90 2.00 0.00 1.29 0.00 0.00 1.77 0.00 0.00 2.85 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.34 1.48 7.81 3 M 8.96 4.97 0.00 2.18 1.39 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.40 0.00 4 V 8.50 4.66 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 0.91 0.00 0.00 0.93 0.00 0.00 5 V 9.14 4.64 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 0.97 0.00 0.00 0.98 0.00 0.00 6 V 9.23 4.57 2.18 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 0.99 0.00 0.00 0.95 0.00 0.00 7 I 8.50 4.75 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 1.24 0.83 0.91 0.00 0.00 8 R 8.43 4.50 0.00 1.82 2.03 0.00 3.15 0.00 0.00 3.36 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.58 0.00 9 N 8.93 4.85 0.00 2.73 2.97 0.00 0.00 7.24 8.00 0.00 0.00 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 D 8.11 4.65 0.00 2.82 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 11 L 7.83 4.08 0.00 1.66 1.76 0.96 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 12 G 8.24 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 0.00 0.00 0.00 13 M 7.95 4.07 0.00 2.02 2.02 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.54 0.00 14 G 8.39 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 0.00 0.00 0.00 15 K 8.55 4.03 0.00 1.80 1.87 0.00 1.68 0.00 0.00 1.82 0.00 0.00 2.93 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.53 1.51 7.81 16 G 8.04 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 17 K 8.02 3.91 0.00 1.87 1.95 0.00 1.62 0.00 0.00 1.82 0.00 0.00 3.05 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.51 1.60 7.81 18 M 8.40 4.13 0.00 2.08 2.21 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 2.82 2.55 0.00 19 V 8.01 3.55 2.23 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 0.99 0.00 0.00 0.99 0.00 0.00 20 A 8.10 3.87 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 21 Q 8.58 4.01 0.00 2.02 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.74 0.00 0.00 0.00 0.00 0.00 2.54 2.52 0.00 22 G 8.50 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 0.00 0.00 0.00 23 G 8.18 3.66 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 0.00 0.00 0.00 24 H 8.22 4.32 0.00 3.34 3.34 0.00 5.63 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 A 8.16 4.04 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.24 3.70 2.08 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 1.60 0.86 1.01 0.00 0.00 27 I 7.89 3.86 2.07 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 1.56 1.03 1.01 0.00 0.00 28 E 8.53 4.03 0.00 2.22 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 2.51 2.49 0.00 29 A 8.53 4.04 1.37 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 0.00 0.00 0.00 0.00 0.00 0.00 30 F 8.51 4.06 0.00 3.22 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 31 L 8.16 3.82 0.00 1.66 1.71 0.98 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 32 D 7.99 4.39 0.00 2.92 2.79 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 33 A 8.35 3.95 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 34 K 7.62 4.05 0.00 1.73 1.47 0.00 0.88 0.00 0.00 1.52 0.00 0.00 2.97 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.23 1.28 7.81 35 R 7.50 4.43 0.00 1.86 2.00 0.00 3.03 0.00 0.00 3.19 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.58 0.00 36 K 7.86 4.42 0.00 1.68 1.85 0.00 1.69 0.00 0.00 1.58 0.00 0.00 2.96 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.36 1.43 7.81 37 N 8.52 4.82 0.00 2.59 2.59 0.00 0.00 6.90 7.43 0.00 0.00 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 P 0.00 4.21 0.00 2.28 2.23 0.00 3.72 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 2.07 2.03 0.00 39 R 8.03 4.64 0.00 2.08 2.41 0.00 3.15 0.00 0.00 3.31 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.55 0.00 40 A 8.12 3.88 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 41 V 7.62 3.68 2.39 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 1.39 0.00 0.00 0.93 0.00 0.00 42 D 7.97 4.51 0.00 2.92 2.79 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 43 E 8.92 3.98 0.00 2.16 2.25 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 2.70 2.38 0.00 44 W 8.18 4.46 0.00 3.55 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 45 L 8.33 3.66 0.00 1.96 1.67 1.08 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 46 R 7.76 4.08 0.00 2.00 2.07 0.00 3.06 0.00 0.00 3.24 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.72 0.00 47 E 7.48 4.54 0.00 2.09 2.00 0.00 0.00 0.00 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 2.50 0.00 48 G 7.59 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 7.37 2.00 0.00 0.93 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.68 0.00 0.00 0.00 0.00 0.00 1.77 1.79 0.00 50 K 7.40 3.96 0.00 1.90 2.07 0.00 1.73 0.00 0.00 1.86 0.00 0.00 3.25 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.63 1.57 7.81 51 K 8.58 5.28 0.00 1.71 1.76 0.00 1.82 0.00 0.00 1.77 0.00 0.00 3.02 0.00 0.00 3.23 0.00 0.00 0.00 0.00 1.81 1.90 7.81 52 V 9.04 4.44 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 0.96 0.00 0.00 0.97 0.00 0.00 53 V 8.42 4.72 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 0.99 0.00 0.00 0.96 0.00 0.00 54 V 8.68 5.18 2.18 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 0.69 0.00 0.00 0.93 0.00 0.00 55 K 8.62 5.71 0.00 1.78 1.72 0.00 1.55 0.00 0.00 1.56 0.00 0.00 3.11 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.48 1.24 7.81 56 V 8.27 4.57 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 0.86 0.00 0.00 0.95 0.00 0.00 57 N 9.11 4.87 0.00 2.62 2.77 0.00 0.00 6.83 7.60 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 58 S 7.49 4.74 0.00 3.99 3.90 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 59 E 8.46 3.91 0.00 2.05 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 2.38 2.36 0.00 60 K 8.03 3.88 0.00 1.87 1.80 0.00 1.78 0.00 0.00 1.75 0.00 0.00 2.91 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.67 1.52 7.81 61 E 8.07 4.08 0.00 2.13 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 2.34 2.35 0.00 62 L 7.97 3.96 0.00 1.93 1.91 0.94 0.86 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 63 I 8.31 3.75 2.04 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 1.51 0.53 0.97 0.00 0.00 64 D 8.71 4.41 0.00 2.82 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 65 I 7.92 3.70 2.06 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 1.72 0.89 0.93 0.00 0.00 66 Y 8.05 4.06 0.00 3.09 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 67 N 8.78 4.22 0.00 3.02 2.86 0.00 0.00 7.06 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 68 K 8.48 3.97 0.00 1.95 1.84 0.00 1.72 0.00 0.00 1.77 0.00 0.00 2.98 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.46 1.49 7.81 69 A 8.06 3.98 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 70 R 7.63 3.66 0.00 1.82 1.80 0.00 3.15 0.00 0.00 2.97 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 1.29 0.00 71 S 8.46 4.23 0.00 3.95 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 72 E 7.60 4.60 0.00 2.13 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 2.31 2.39 0.00 73 G 8.21 3.85 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 0.00 0.00 0.00 74 L 7.52 4.41 0.00 1.61 1.53 0.87 0.94 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 75 P 0.00 4.57 0.00 2.12 1.98 0.00 3.54 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.02 0.00 76 C 9.11 5.82 0.00 3.05 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 77 S 8.14 4.90 0.00 3.91 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 78 I 8.02 4.88 0.90 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.78 0.13 0.00 0.00 79 I 8.80 4.48 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 1.23 0.97 0.00 0.00 80 R 8.42 4.91 0.00 1.75 1.78 0.00 3.20 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 1.57 0.00 81 D 9.56 4.79 0.00 2.95 2.62 0.00 0.00 0.00 0.00 0.00 0.00 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 8.32 4.84 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 83 G 8.81 3.90 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 0.00 0.00 0.00 84 H 9.50 4.50 0.00 3.07 3.36 0.00 5.91 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 85 T 7.43 4.72 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 1.23 0.00 0.00 86 Q 8.54 4.09 0.00 2.16 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 7.21 0.00 0.00 0.00 0.00 0.00 2.32 2.44 0.00 87 L 7.54 4.34 0.00 1.63 1.75 0.93 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 88 E 7.89 4.70 0.00 2.06 2.00 0.00 0.00 0.00 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 2.25 0.00 89 P 0.00 4.69 0.00 2.09 2.09 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 1.97 1.97 0.00 90 G 8.45 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 91 T 8.30 4.81 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 1.21 0.00 0.00 92 L 8.57 4.65 0.00 1.55 1.57 0.98 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 93 T 8.86 4.46 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 94 A 7.57 5.16 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 95 V 8.96 4.99 2.13 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 1.15 0.00 0.00 0.99 0.00 0.00 96 A 8.88 5.22 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 97 I 8.80 4.67 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 1.16 0.94 0.91 0.00 0.00 98 G 8.46 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 0.00 0.00 0.00 0.00 99 P 0.00 4.55 0.00 1.59 0.49 0.00 3.09 0.00 0.00 3.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.30 0.00 100 E 7.94 4.59 0.00 1.91 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.22 0.00 101 K 9.74 4.41 0.00 1.58 1.71 0.00 1.75 0.00 0.00 1.66 0.00 0.00 2.84 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.47 1.42 7.81 102 D 9.14 4.39 0.00 2.77 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 0.00 103 E 8.28 3.99 0.00 2.03 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 2.38 2.43 0.00 104 K 7.91 3.97 0.00 1.87 1.84 0.00 1.90 0.00 0.00 1.68 0.00 0.00 3.03 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.43 1.52 7.81 105 I 7.57 3.84 1.86 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.70 0.89 0.00 0.00 106 D 8.50 4.36 0.00 2.81 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 0.00 107 K 7.58 3.71 0.00 1.93 1.89 0.00 1.58 0.00 0.00 1.96 0.00 0.00 3.13 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.48 1.54 7.81 108 I 7.69 4.20 1.98 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.51 0.91 0.00 0.00 109 T 7.64 4.43 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 1.19 0.00 0.00 110 G 8.58 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 0.00 111 H 7.96 4.49 0.00 3.28 3.45 0.00 5.54 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 L 7.43 4.21 0.00 1.59 1.61 0.87 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 113 K 8.56 4.34 0.00 1.72 1.72 0.00 1.67 0.00 0.00 1.82 0.00 0.00 2.83 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.54 1.48 7.81 114 L 8.32 4.56 0.00 1.53 1.60 0.93 1.02 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 0.00 115 L 8.45 4.11 0.00 1.75 1.64 0.92 0.74 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