NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 S 4.4636 8.1776 115.2889 57.8686 63.6279 174.4837 3 V 3.3517 8.3018 128.4576 64.6455 30.9427 176.7915 4 Y 3.9526 8.6131 118.3441 60.9292 37.9954 178.9280 5 D 4.3872 7.7892 117.9636 57.0064 41.2281 178.3614 6 A 4.0692 8.1566 121.3560 55.0800 18.5310 179.5792 7 A 3.8756 8.1620 119.0590 54.9669 18.1758 179.4342 8 A 4.1008 7.4601 118.2318 54.4849 18.5506 179.0647 9 Q 4.2650 7.7673 115.3102 56.6484 29.9155 177.0078 10 L 4.2121 7.2901 120.9134 53.7917 40.1816 177.0690 11 T 4.2428 7.6923 114.9061 60.1639 71.7110 175.0336 12 A 3.9644 8.4957 122.1560 55.6041 18.1728 179.4606 13 D 4.2946 7.9968 116.9336 56.5407 39.5270 178.8049 14 V 3.4738 7.3172 119.3382 65.6311 31.5458 178.1335 15 K 3.8494 8.2439 118.5927 59.2564 31.7744 179.2112 16 K 3.9505 8.0818 119.8204 59.7342 32.1471 178.6631 17 D 4.5644 8.1018 119.1502 57.2273 40.5838 178.8388 18 L 3.6928 7.9209 119.5735 57.7115 41.5947 179.7437 19 R 4.0295 8.0845 117.9434 59.4563 29.3095 178.8427 20 D 4.4867 8.5068 119.1755 57.5150 40.8817 179.1136 21 S 3.2385 8.2400 114.7665 60.7123 63.0196 176.3098 22 W 4.3907 8.7371 132.2015 60.0406 30.1959 177.6390 23 K 3.7394 7.9824 119.1775 59.3217 31.8420 178.5560 24 V 3.7442 7.0972 115.1585 65.7430 31.9140 178.2201 25 I 3.6692 7.5276 112.8389 63.4639 37.1954 177.6008 26 G 2.2664 6.9912 105.7877 45.1657 0.0000 175.2264 27 S 4.2645 7.2499 115.4728 59.5332 64.4694 173.9426 28 D 4.6643 7.1839 120.8684 51.1690 41.1504 175.5311 29 K 3.8497 8.0021 123.1675 58.5617 32.4303 178.3715 30 K 4.0161 7.9696 119.5396 59.4214 32.3061 178.9649 31 G 3.7049 8.0434 106.6827 47.5904 0.0000 175.2906 32 N 4.4903 8.3525 119.6500 55.2983 38.6195 178.0157 33 G 3.5079 8.0872 107.5733 47.7905 0.0000 176.0877 34 V 3.6153 7.8166 120.7847 65.4253 31.5135 177.9489 35 A 4.0326 7.8564 122.0309 54.4084 18.1996 179.5677 36 L 3.7882 7.9241 117.4320 58.2197 41.6851 179.7531 37 M 3.4963 7.6811 118.2832 58.3951 31.3905 178.9964 38 T 3.9598 8.1193 110.3178 65.0987 68.7693 176.7312 39 T 3.8719 7.8245 118.6257 66.0878 68.4566 176.4087 40 L 3.7975 7.5950 122.2433 58.3142 42.2191 179.1965 41 F 4.5185 7.7256 117.4258 60.4228 38.5312 177.6348 42 A 4.1629 7.9856 119.9137 54.8934 18.4044 178.7296 43 D 4.6819 8.1574 114.9395 54.8091 42.9347 176.8464 44 N 5.1784 8.1934 116.9564 51.0828 39.6411 174.9456 45 Q 4.3073 8.4023 118.5662 58.2790 29.1355 179.2558 46 E 4.2384 8.2467 114.5995 57.7494 30.0020 177.6861 47 T 4.5991 8.1504 110.5929 62.9291 69.5710 176.5051 48 I 3.8694 7.8580 123.2476 64.6057 36.8378 178.1048 49 G 3.6430 8.0868 105.1779 48.0981 0.0000 174.8394 50 Y 4.3660 7.8021 117.6769 59.8708 38.1135 176.3469 51 F 4.8780 8.2520 118.6768 56.9116 39.9659 178.1011 52 K 3.8931 8.3605 123.0476 59.7115 32.0653 179.3806 53 R 3.9541 8.0068 117.5898 59.1618 30.0662 177.1097 54 L 4.2343 8.0021 115.9594 55.0879 42.7374 179.0392 55 G 3.8049 7.7214 106.5439 46.5672 0.0000 176.6079 56 D 4.4926 8.3631 121.0874 53.3892 40.6578 176.8815 57 V 3.7131 7.9203 120.5825 63.2506 31.4927 177.6987 58 S 4.3109 7.7813 112.7472 60.5006 63.1058 175.6772 59 Q 4.1644 8.1809 121.3658 55.8030 28.9293 177.2484 60 G 3.7957 8.6665 109.8006 46.3110 0.0000 176.7164 61 M 3.9374 8.9758 122.3820 58.1995 31.9463 176.9803 62 A 4.0045 7.6726 120.0515 53.8325 18.8490 177.2404 63 N 4.6299 8.1381 115.3272 52.5448 39.3532 174.9577 64 D 4.3836 8.6749 129.2535 57.5925 41.0135 179.0395 65 K 4.0375 8.1101 118.4079 59.2821 32.0864 179.0687 66 L 4.0518 8.6420 121.0977 58.0430 41.9736 179.0140 67 R 4.0258 8.3939 119.0959 59.3440 30.1538 178.7520 68 G 3.6270 8.3385 105.6914 47.9925 0.0000 175.1856 69 H 4.2182 8.4771 120.7129 59.1774 29.8170 177.5836 70 S 4.1106 8.5524 117.3708 61.6624 62.4381 176.7967 71 I 3.7862 7.7744 121.4294 64.7882 37.1908 178.3288 72 T 4.1643 7.9475 116.3597 66.5218 68.3268 176.4187 73 L 3.9694 8.0709 122.3466 58.4967 42.0991 179.0356 74 M 4.2302 7.9619 118.3839 58.3287 31.8442 178.0382 75 Y 4.0388 7.9182 115.8533 60.0331 38.0659 177.7549 76 A 3.8186 7.7716 122.2485 54.8653 18.4120 179.6476 77 L 3.5243 7.4986 117.0808 57.5631 41.6819 179.1856 78 Q 3.5218 7.8904 119.5939 58.9163 28.7473 177.8187 79 N 4.2633 7.7087 116.8940 56.8240 39.4212 176.3600 80 F 4.5793 7.7351 118.9575 60.8915 38.9029 177.7095 81 I 3.5464 7.6724 119.2924 64.5333 36.6323 178.2297 82 D 4.4610 8.1478 118.2251 56.4046 40.9767 177.6699 83 Q 4.4614 7.6563 117.1308 55.7863 28.8087 177.2647 84 L 3.9977 7.4709 121.7897 57.7713 41.6077 178.2500 85 D 4.3318 8.0618 117.8797 56.0501 41.2796 175.8744 86 N 4.8144 7.9277 117.0901 50.8331 40.6211 172.6838 87 P 4.2309 0.0000 0.0000 65.8865 31.3490 178.2997 88 D 4.4371 8.2536 117.5108 57.4921 40.8042 178.5168 89 D 4.3907 8.2373 118.8967 56.7902 40.9949 178.4115 90 L 3.8687 7.9454 121.0534 58.0540 42.0138 179.1156 91 V 3.3286 7.8040 118.5261 66.1213 31.2691 177.8127 92 C 4.1136 7.8331 114.1715 61.1672 29.6133 176.1011 93 V 3.8000 7.7201 114.4173 63.7192 31.1304 178.7168 94 V 3.5010 7.8028 118.4024 65.9639 31.3334 177.9806 95 E 3.8738 8.3498 118.6035 59.0067 28.9688 179.3296 96 K 3.9181 7.6176 119.2131 59.4767 32.4415 178.3801 97 L 4.1734 8.0151 120.1799 57.9890 41.9415 178.6581 98 A 3.9109 8.3248 121.2184 55.1693 18.2864 179.6384 99 V 3.5371 7.7779 116.6647 66.3929 31.1139 178.0368 100 N 4.3816 8.0583 115.9089 56.1927 38.2986 176.6524 101 H 4.4705 8.0076 116.6790 57.7831 29.3881 177.4611 102 I 3.7468 8.1557 122.5824 64.4757 36.6810 178.5167 103 T 3.8780 7.8003 109.1354 64.2323 68.7035 175.1365 104 R 4.3074 7.1616 116.0805 55.2882 30.0772 176.1202 105 K 3.8136 7.7449 116.1160 57.5477 29.8337 175.6847 106 I 4.0193 7.6465 120.1352 60.0235 37.9508 177.1541 107 S 4.5404 8.3758 120.6641 57.2204 65.6715 174.8867 108 A 3.9612 8.4497 123.2181 55.2509 17.8300 179.7187 109 A 3.9938 7.9121 117.7934 55.5277 18.8690 179.3197 110 E 4.1501 8.2535 116.8146 59.3275 29.6260 179.2986 111 F 4.1625 8.7320 121.3474 61.0141 39.4713 177.1054 112 G 3.8964 8.4037 104.6945 46.6242 0.0000 175.1673 113 K 4.2185 7.9783 120.6475 58.3314 32.0751 178.3473 114 I 3.4475 7.5803 118.9077 62.9764 37.8877 177.1945 115 N 4.4802 8.2223 117.9665 56.3532 38.2985 177.2861 116 G 3.5971 7.6269 106.7416 47.4660 0.0000 173.8876 117 P 4.2006 0.0000 0.0000 65.0926 31.2906 178.7208 118 I 3.5063 7.7400 118.5060 64.1982 36.9164 178.3483 119 K 3.9360 8.1034 120.3632 59.4659 32.0064 179.0311 120 K 3.9510 8.0163 118.7710 59.4585 31.4976 179.5853 121 V 3.5484 7.9650 118.7427 65.8433 31.3954 178.0945 122 L 3.8405 8.1200 118.7178 57.8112 41.4904 179.3329 123 A 4.1848 8.3638 121.2018 55.1068 18.0879 179.6013 124 S 4.2789 8.0259 111.4271 60.2494 63.1067 175.7478 125 K 4.4186 7.0681 120.4496 55.4694 32.3620 175.2820 126 N 4.1097 7.9604 116.0805 54.6504 37.5113 173.7967 127 F 4.5699 8.2062 115.7146 55.0962 40.6167 176.7704 128 G 4.1089 8.6388 114.9722 44.1901 0.0000 172.1868 129 D 4.5117 8.9305 118.6337 57.5318 40.5903 178.6371 130 K 3.8210 8.1622 119.4961 59.9452 32.1300 178.2596 131 Y 4.1481 8.0924 116.0708 60.8274 38.0205 177.6772 132 A 4.2272 8.3181 121.8663 55.3642 18.4605 179.4807 133 N 4.3754 8.7755 115.2557 56.2407 38.4036 177.5478 134 A 3.9389 7.7878 122.3975 55.0961 18.4931 179.8292 135 W 3.8994 8.5693 117.2106 59.6484 29.0590 178.6766 136 A 4.1367 8.2811 120.9969 55.0369 17.5442 179.8419 137 K 3.9643 7.6583 116.1215 59.2797 32.3403 179.0849 138 L 3.9725 7.5473 120.8812 58.0505 42.0190 179.0929 139 V 3.8028 8.1788 118.1086 66.0330 31.4523 177.8251 140 A 4.3503 8.1140 121.8226 54.3872 17.8784 179.8203 141 V 3.4055 7.3286 116.5076 66.0222 31.8705 178.1507 142 V 3.4562 7.4798 117.5789 65.9207 31.2868 177.8078 143 Q 3.8321 8.1142 117.6374 58.8632 28.3066 178.7093 144 A 3.9669 7.7915 120.3888 54.0778 18.4587 178.4111 145 A 4.3127 7.4852 117.1465 52.1783 19.4672 177.1216 146 L 4.1184 7.3855 122.5288 54.6824 41.8569 176.4869 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 8.18 4.46 0.00 3.90 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 3 V 8.30 3.35 1.89 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 0.28 0.00 0.00 0.68 0.00 0.00 4 Y 8.61 3.95 0.00 3.02 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 5 D 7.79 4.39 0.00 2.82 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 6 A 8.16 4.07 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 7 A 8.16 3.88 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 8 A 7.46 4.10 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 9 Q 7.77 4.27 0.00 2.20 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 7.22 0.00 0.00 0.00 0.00 0.00 2.56 2.51 0.00 10 L 7.29 4.21 0.00 1.68 1.53 0.78 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 11 T 7.69 4.24 4.21 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 1.18 0.00 0.00 12 A 8.50 3.96 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 13 D 8.00 4.29 0.00 2.84 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 14 V 7.32 3.47 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 0.90 0.00 0.00 0.87 0.00 0.00 15 K 8.24 3.85 0.00 1.94 1.79 0.00 1.68 0.00 0.00 1.53 0.00 0.00 2.97 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.37 1.56 7.81 16 K 8.08 3.95 0.00 2.02 1.95 0.00 1.55 0.00 0.00 1.67 0.00 0.00 3.07 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.77 7.81 17 D 8.10 4.56 0.00 2.81 2.64 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 18 L 7.92 3.69 0.00 1.63 1.21 0.55 -0.63 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 19 R 8.08 4.03 0.00 2.05 2.05 0.00 3.15 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.87 0.00 20 D 8.51 4.49 0.00 2.96 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 21 S 8.24 3.24 0.00 3.44 3.39 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 22 W 8.74 4.39 0.00 3.78 3.39 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 23 K 7.98 3.74 0.00 1.85 2.03 0.00 1.88 0.00 0.00 1.65 0.00 0.00 3.01 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.44 1.46 7.81 24 V 7.10 3.74 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 1.09 0.00 0.00 1.13 0.00 0.00 25 I 7.53 3.67 1.60 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.25 0.70 0.00 0.00 26 G 6.99 2.27 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 0.00 27 S 7.25 4.26 0.00 3.94 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 28 D 7.18 4.66 0.00 2.71 2.40 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 29 K 8.00 3.85 0.00 1.76 1.72 0.00 1.24 0.00 0.00 0.79 0.00 0.00 2.20 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.26 1.38 7.81 30 K 7.97 4.02 0.00 1.83 1.78 0.00 1.73 0.00 0.00 1.83 0.00 0.00 2.95 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.50 1.51 7.81 31 G 8.04 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 32 N 8.35 4.49 0.00 2.72 2.74 0.00 0.00 6.99 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 33 G 8.09 3.51 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 0.00 0.00 0.00 34 V 7.82 3.62 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 1.07 0.00 0.00 0.97 0.00 0.00 35 A 7.86 4.03 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 36 L 7.92 3.79 0.00 1.79 1.58 0.80 0.65 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 37 M 7.68 3.50 0.00 1.67 1.97 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.72 0.00 38 T 8.12 3.96 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 1.31 0.00 0.00 39 T 7.82 3.87 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 1.18 0.00 0.00 40 L 7.59 3.80 0.00 1.55 1.22 0.85 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 41 F 7.73 4.52 0.00 3.06 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 42 A 7.99 4.16 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 43 D 8.16 4.68 0.00 2.65 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 44 N 8.19 5.18 0.00 2.97 2.90 0.00 0.00 6.57 7.24 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 45 Q 8.40 4.31 0.00 2.22 2.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.91 6.97 0.00 0.00 0.00 0.00 0.00 2.43 2.28 0.00 46 E 8.25 4.24 0.00 2.11 2.14 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 2.36 2.30 0.00 47 T 8.15 4.60 4.72 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 1.45 0.00 0.00 48 I 7.86 3.87 1.92 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 1.19 1.07 0.71 0.00 0.00 49 G 8.09 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 50 Y 7.80 4.37 0.00 2.92 2.56 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 0.00 0.00 0.00 0.00 51 F 8.25 4.88 0.00 3.09 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 52 K 8.36 3.89 0.00 1.79 1.88 0.00 1.68 0.00 0.00 1.72 0.00 0.00 2.82 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.83 1.38 7.81 53 R 8.01 3.95 0.00 1.79 2.01 0.00 3.26 0.00 0.00 3.25 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.68 0.00 54 L 8.00 4.23 0.00 1.82 1.74 1.03 0.84 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 55 G 7.72 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 56 D 8.36 4.49 0.00 2.77 2.57 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 57 V 7.92 3.71 1.60 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 0.39 0.00 0.00 0.31 0.00 0.00 58 S 7.78 4.31 0.00 4.02 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 59 Q 8.18 4.16 0.00 2.26 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 5.82 0.00 0.00 0.00 0.00 0.00 2.37 2.57 0.00 60 G 8.67 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 61 M 8.98 3.94 0.00 1.97 2.12 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.61 0.00 62 A 7.67 4.00 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 63 N 8.14 4.63 0.00 2.78 2.90 0.00 0.00 7.02 8.05 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 64 D 8.67 4.38 0.00 2.74 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 65 K 8.11 4.04 0.00 1.98 1.90 0.00 1.81 0.00 0.00 1.76 0.00 0.00 2.92 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.56 1.51 7.81 66 L 8.64 4.05 0.00 1.78 1.87 1.08 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 67 R 8.39 4.03 0.00 2.05 2.05 0.00 3.16 0.00 0.00 3.18 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.66 0.00 68 G 8.34 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 69 H 8.48 4.22 0.00 3.41 3.65 0.00 5.79 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 S 8.55 4.11 0.00 4.05 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 71 I 7.77 3.79 1.96 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 1.58 0.67 1.15 0.00 0.00 72 T 7.95 4.16 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 1.25 0.00 0.00 73 L 8.07 3.97 0.00 1.71 1.82 0.91 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 74 M 7.96 4.23 0.00 2.04 2.18 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.78 2.90 0.00 75 Y 7.92 4.04 0.00 3.20 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 76 A 7.77 3.82 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 77 L 7.50 3.52 0.00 1.54 1.20 0.94 1.08 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 78 Q 7.89 3.52 0.00 2.43 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.79 0.00 0.00 0.00 0.00 0.00 2.53 2.52 0.00 79 N 7.71 4.26 0.00 2.87 2.86 0.00 0.00 7.29 7.13 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 80 F 7.74 4.58 0.00 3.05 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 81 I 7.67 3.55 1.61 0.00 0.00 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.84 0.00 0.00 82 D 8.15 4.46 0.00 2.81 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 83 Q 7.66 4.46 0.00 2.09 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.78 0.00 0.00 0.00 0.00 0.00 2.73 2.57 0.00 84 L 7.47 4.00 0.00 1.51 1.67 0.78 0.85 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 85 D 8.06 4.33 0.00 2.66 2.72 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 86 N 7.93 4.81 0.00 2.72 2.66 0.00 0.00 7.13 7.83 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 87 P 0.00 4.23 0.00 2.22 2.10 0.00 3.65 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.16 0.00 88 D 8.25 4.44 0.00 2.93 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 89 D 8.24 4.39 0.00 2.80 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 90 L 7.95 3.87 0.00 1.87 1.70 0.70 0.45 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 91 V 7.80 3.33 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 0.53 0.00 0.00 0.48 0.00 0.00 92 C 7.83 4.11 0.00 3.14 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 93 V 7.72 3.80 2.27 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 1.07 0.00 0.00 1.14 0.00 0.00 94 V 7.80 3.50 1.97 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 0.84 0.00 0.00 0.14 0.00 0.00 95 E 8.35 3.87 0.00 1.99 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 0.00 2.20 2.42 0.00 96 K 7.62 3.92 0.00 1.85 2.07 0.00 1.87 0.00 0.00 1.81 0.00 0.00 3.00 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.47 1.62 7.81 97 L 8.02 4.17 0.00 2.05 2.00 1.07 1.34 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 98 A 8.32 3.91 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 99 V 7.78 3.54 2.24 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 1.02 0.00 0.00 0.97 0.00 0.00 100 N 8.06 4.38 0.00 3.03 2.81 0.00 0.00 6.99 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 0.00 101 H 8.01 4.47 0.00 3.35 3.40 0.00 5.82 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 I 8.16 3.75 1.86 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 1.55 0.88 0.90 0.00 0.00 103 T 7.80 3.88 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 1.23 0.00 0.00 104 R 7.16 4.31 0.00 1.86 1.81 0.00 3.29 0.00 0.00 3.33 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.57 0.00 105 K 7.74 3.81 0.00 1.99 1.98 0.00 1.72 0.00 0.00 1.72 0.00 0.00 3.06 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.39 1.59 7.81 106 I 7.65 4.02 1.98 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.67 0.97 0.00 0.00 107 S 8.38 4.54 0.00 4.07 4.03 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 0.00 0.00 0.00 108 A 8.45 3.96 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 0.00 109 A 7.91 3.99 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 0.00 110 E 8.25 4.15 0.00 2.12 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 2.43 2.41 0.00 111 F 8.73 4.16 0.00 3.16 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 0.00 112 G 8.40 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 0.00 113 K 7.98 4.22 0.00 1.98 1.88 0.00 1.75 0.00 0.00 1.64 0.00 0.00 2.95 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.50 1.71 7.81 114 I 7.58 3.45 1.54 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.09 0.74 0.00 0.00 115 N 8.22 4.48 0.00 2.98 2.89 0.00 0.00 6.71 7.73 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 0.00 116 G 7.63 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 0.00 117 P 0.00 4.20 0.00 2.16 2.13 0.00 3.66 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.10 0.00 118 I 7.74 3.51 1.96 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 1.20 0.65 0.68 0.00 0.00 119 K 8.10 3.94 0.00 1.93 1.99 0.00 1.66 0.00 0.00 1.68 0.00 0.00 3.00 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.46 1.54 7.81 120 K 8.02 3.95 0.00 1.97 1.81 0.00 1.69 0.00 0.00 1.55 0.00 0.00 2.89 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.45 1.64 7.81 121 V 7.96 3.55 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 0.91 0.00 0.00 0.88 0.00 0.00 122 L 8.12 3.84 0.00 1.97 1.98 0.93 0.43 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 0.00 123 A 8.36 4.18 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 0.00 0.00 0.00 0.00 0.00 0.00 124 S 8.03 4.28 0.00 4.04 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 0.00 125 K 7.07 4.42 0.00 1.93 1.97 0.00 1.81 0.00 0.00 1.62 0.00 0.00 2.91 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.56 1.56 7.81 126 N 7.96 4.11 0.00 2.71 2.57 0.00 0.00 6.92 7.18 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 0.00 127 F 8.21 4.57 0.00 3.17 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 0.00 128 G 8.64 4.11 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 0.00 129 D 8.93 4.51 0.00 2.82 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 0.00 130 K 8.16 3.82 0.00 1.75 1.69 0.00 1.60 0.00 0.00 1.62 0.00 0.00 2.80 0.00 0.00 2.93 0.00 0.00 0.00 0.00 0.90 1.33 7.81 131 Y 8.09 4.15 0.00 3.43 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 0.00 132 A 8.32 4.23 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 0.00 133 N 8.78 4.38 0.00 2.96 2.89 0.00 0.00 6.89 7.35 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 0.00 134 A 7.79 3.94 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 0.00 135 W 8.57 3.90 0.00 3.61 3.35 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 0.00 136 A 8.28 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 0.00 137 K 7.66 3.96 0.00 1.88 1.83 0.00 1.66 0.00 0.00 1.59 0.00 0.00 2.95 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.45 1.59 7.81 138 L 7.55 3.97 0.00 1.49 1.77 0.68 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 139 V 8.18 3.80 2.37 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 1.28 0.00 0.00 1.19 0.00 0.00 140 A 8.11 4.35 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 0.00 0.00 0.00 0.00 0.00 0.00 141 V 7.33 3.41 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 0.57 0.00 0.00 0.82 0.00 0.00 142 V 7.48 3.46 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 0.22 0.00 0.00 0.87 0.00 0.00 143 Q 8.11 3.83 0.00 2.27 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.58 0.00 0.00 0.00 0.00 0.00 2.59 2.64 0.00 144 A 7.79 3.97 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 0.00 145 A 7.49 4.31 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 0.00 146 L 7.39 4.12 0.00 1.70 1.51 0.56 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00