NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 Q 4.3393 8.3444 119.6924 56.1886 30.9119 176.1249 5 S 4.1205 8.0656 110.5604 58.3538 62.7625 172.2002 6 P 4.4081 0.0000 0.0000 63.5067 32.8311 174.2828 7 Y 3.4601 8.4638 120.1512 58.1906 36.2365 168.3148 8 S 4.5891 7.8094 114.6546 58.5014 69.4001 175.0410 9 A 4.4525 7.5792 116.1911 51.9627 22.0613 176.3572 10 A 4.2657 7.6677 120.8630 50.8485 17.2266 177.1486 11 M 4.1549 7.4177 120.0262 53.7681 32.9821 176.9530 12 A 4.2448 8.1044 122.5313 52.2420 21.5250 176.2874 13 E 4.7955 8.2729 120.4993 56.3201 30.3418 176.6548 14 Q 4.2164 7.7258 122.7318 57.2233 26.7302 175.7419 15 R 4.3311 7.5513 119.4162 55.7564 31.6817 176.6777 16 H 4.4662 8.4027 116.5218 56.8548 33.4826 174.1522 17 Q 4.4221 7.6135 118.0484 57.2474 29.5251 176.8155 18 E 4.0466 8.5934 120.0464 60.2206 29.7570 178.8965 19 W 4.5601 8.4690 128.4977 60.6122 30.6627 177.0784 20 L 3.8702 8.1401 119.3561 58.9669 41.4929 178.9098 21 R 3.9145 8.2177 117.6251 58.8586 29.7341 178.4724 22 F 4.1308 8.2314 121.0013 62.5024 39.9001 177.4112 23 V 2.6984 7.3034 118.3111 63.5662 30.9023 177.1451 24 D 4.2611 8.6757 117.3763 57.4048 41.5111 179.2339 25 L 3.8827 8.3398 120.8944 58.2349 42.1657 178.3254 26 L 3.9017 7.8096 120.0803 57.9852 41.5382 178.5101 27 K 3.7937 7.8749 118.7510 60.0564 31.9364 178.2071 28 N 4.4272 7.7801 114.3395 55.6515 38.6093 177.1379 29 A 4.1806 7.7746 122.0643 55.2011 18.6893 178.8053 30 Y 3.8618 8.4500 118.4103 60.7548 38.3623 178.6247 31 Q 4.0396 7.3527 116.6026 59.4732 29.3411 177.5213 32 N 4.3924 8.2464 116.4296 53.9176 39.4275 174.3998 33 D 4.4003 7.9393 117.9545 54.8415 39.2650 174.2789 34 L 4.7863 7.5057 114.2865 54.8173 42.2581 178.0331 35 H 4.3035 8.2828 117.2874 58.7030 28.2656 177.2512 36 L 3.8870 7.5451 121.9667 57.4370 41.4367 177.1079 37 P 4.2769 0.0000 0.0000 65.7450 31.5211 178.4250 38 L 4.1679 7.7979 117.8227 57.4749 41.4740 179.0918 39 L 4.0305 8.1527 119.5179 58.1767 41.5299 179.2542 40 N 4.8562 7.7281 114.1946 54.8320 38.4988 175.7066 41 L 4.4061 8.1735 121.5657 57.1040 43.0625 177.2602 42 M 4.3533 7.7518 116.6894 55.8149 31.9542 176.0877 43 L 4.4770 7.3630 119.5215 54.5285 46.6624 173.8371 44 T 4.4241 8.2520 120.9800 63.1849 76.4400 173.2626 45 P 4.4824 0.0000 0.0000 63.3161 30.0677 177.1479 46 D 4.4685 9.3896 124.0701 57.0706 41.1777 176.5056 47 E 3.9937 8.1747 119.6695 58.5653 29.6739 178.4865 48 R 3.8307 7.9198 118.1708 60.3168 30.1326 177.6780 49 E 4.1936 8.1741 117.9647 58.2277 29.7212 178.3268 50 A 4.4571 8.4899 122.9376 54.5158 18.4630 179.8482 51 L 4.0135 8.1969 117.8002 57.9859 41.7339 179.5549 52 G 3.9068 7.4599 103.3653 48.8068 0.0000 174.2886 53 T 4.0582 8.1020 118.5102 64.5881 68.2489 176.3345 54 R 3.9382 8.0180 122.2664 59.8164 30.6243 179.1586 55 V 3.6814 7.8210 117.8929 65.6407 31.5342 178.1809 56 R 3.9099 8.2089 118.2091 59.8493 29.9345 178.6406 57 I 3.7189 7.8176 119.1199 64.1058 36.8909 177.9780 58 V 3.4877 7.8631 119.2959 66.6457 31.5790 177.3832 59 E 4.0726 8.4102 118.2244 59.8308 29.5597 179.2889 60 E 4.0329 8.4519 118.1803 59.2284 29.2403 179.2955 61 L 4.0765 8.0856 118.8515 57.5335 41.6183 179.0535 62 L 4.2229 7.5968 118.6495 56.6061 41.9618 177.9305 63 R 4.4964 7.7950 114.8293 56.0953 31.0812 176.8392 64 G 4.1243 7.5688 106.4809 46.5812 0.0000 176.1142 65 E 3.7425 7.6273 121.2203 58.9703 29.8478 177.1719 66 M 4.0417 7.8937 119.2160 56.2602 31.8913 176.6823 67 S 4.6883 8.2266 119.0439 56.6101 63.0325 172.4572 68 Q 4.4604 8.1433 121.0098 56.6846 30.8371 177.4068 69 R 4.6716 7.8529 116.6607 56.2845 30.4070 176.5173 70 E 4.4481 7.9337 114.7570 56.1910 32.8084 174.7241 71 L 3.6839 7.3608 118.8653 55.1750 41.9895 177.4038 72 K 3.7241 8.6724 127.7882 57.6439 30.2501 175.0849 73 N 4.6440 8.0504 111.0718 53.2307 39.1878 175.8015 74 E 3.6522 8.5638 112.5386 57.9988 31.1953 176.1409 75 L 4.3094 7.6950 116.8019 56.2419 41.3188 177.6506 76 G 3.7186 8.0159 106.7766 46.9733 0.0000 173.0376 77 A 4.4388 8.3303 120.6727 51.2903 21.2334 174.2988 78 G 4.0343 7.7077 104.1989 44.1398 0.0000 173.6302 79 I 3.7751 8.0883 125.5552 63.4625 38.5200 177.7076 80 A 4.0063 8.3126 122.2662 54.7455 18.6615 178.4783 81 T 4.0127 7.8052 105.4644 65.0969 68.5802 176.4102 82 I 3.9687 7.2197 110.9235 61.5838 36.8482 177.1462 83 T 4.2778 8.1211 119.0843 66.0781 68.9086 177.0036 84 R 4.1458 8.0557 117.6877 59.3326 29.0019 178.3318 85 G 3.7681 8.0852 104.3344 46.6105 0.0000 174.5220 86 S 4.6145 8.2942 116.2732 59.1274 63.6773 174.9547 87 N 4.8248 7.6952 116.8699 53.1176 39.0411 176.1811 88 S 4.2415 8.3218 115.3040 61.2545 62.4769 174.6862 89 L 4.1252 7.6509 121.7179 56.9966 41.3884 178.2885 90 K 3.8192 8.1667 118.2748 60.0856 32.9294 178.8087 91 A 3.9993 7.9748 120.5515 53.5815 18.6124 177.5044 92 A 4.2541 7.6328 119.0263 51.0482 19.0567 176.0511 93 P 4.4527 0.0000 0.0000 62.6293 32.0207 176.8525 94 V 3.8467 7.9625 119.3532 65.0602 32.3192 177.7086 95 E 4.0777 8.1663 120.4025 58.5983 29.9945 178.9079 96 L 4.0965 7.9557 119.5284 58.5915 41.9265 178.5141 97 R 4.0660 8.3629 117.7031 59.2623 29.9959 178.4267 98 Q 4.2336 7.8271 116.7369 57.5961 29.0353 177.5953 99 W 4.6042 8.0151 128.8819 60.1227 31.2390 177.9226 100 L 3.4526 8.5366 119.3339 58.1164 40.8996 179.2558 101 E 3.9546 8.3716 117.8700 59.7779 28.9839 179.0458 102 E 3.9566 8.8751 118.7474 58.2100 29.5996 178.1511 103 V 3.6191 6.9676 114.9781 62.7806 31.8244 175.3941 104 L 4.3902 7.7966 118.6256 57.5107 43.1315 177.4105 105 L 4.0742 7.1969 117.3398 57.6594 41.9285 178.6749 106 K 4.0271 7.8109 117.5380 59.0037 32.3593 177.3656 107 S 4.1296 7.3845 117.5759 59.0719 64.1280 174.4408 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 4 Q 8.34 4.34 0.00 2.07 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 7.03 0.00 0.00 0.00 0.00 0.00 2.28 2.37 0.00 5 S 8.07 4.12 0.00 3.92 3.89 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 0.00 0.00 0.00 0.00 6 P 0.00 4.41 0.00 2.26 2.07 0.00 3.78 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.09 0.00 7 Y 8.46 3.46 0.00 3.04 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 8 S 7.81 4.59 0.00 3.80 3.74 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 0.00 0.00 0.00 9 A 7.58 4.45 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 10 A 7.67 4.27 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 11 M 7.42 4.15 0.00 1.97 1.98 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.44 0.00 12 A 8.10 4.24 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 13 E 8.27 4.80 0.00 2.01 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 2.13 2.23 0.00 14 Q 7.73 4.22 0.00 2.01 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.57 6.87 0.00 0.00 0.00 0.00 0.00 2.30 2.34 0.00 15 R 7.55 4.33 0.00 1.58 1.80 0.00 3.28 0.00 0.00 3.24 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.57 0.00 16 H 8.40 4.47 0.00 2.98 3.17 0.00 5.65 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 Q 7.61 4.42 0.00 2.20 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.11 6.57 0.00 0.00 0.00 0.00 0.00 2.44 2.38 0.00 18 E 8.59 4.05 0.00 2.29 2.33 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 2.48 2.56 0.00 19 W 8.47 4.56 0.00 3.20 2.99 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 20 L 8.14 3.87 0.00 2.29 1.76 0.95 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 21 R 8.22 3.91 0.00 2.14 1.96 0.00 3.41 0.00 0.00 3.13 7.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.85 0.00 22 F 8.23 4.13 0.00 2.88 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 23 V 7.30 2.70 1.72 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 0.50 0.00 0.00 -0.33 0.00 0.00 24 D 8.68 4.26 0.00 2.71 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 25 L 8.34 3.88 0.00 1.78 1.85 0.93 0.58 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 26 L 7.81 3.90 0.00 1.82 1.60 1.04 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 27 K 7.87 3.79 0.00 1.78 1.89 0.00 1.62 0.00 0.00 1.73 0.00 0.00 3.00 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.46 1.60 7.81 28 N 7.78 4.43 0.00 2.79 2.87 0.00 0.00 7.42 8.14 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 29 A 7.77 4.18 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 30 Y 8.45 3.86 0.00 2.87 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 31 Q 7.35 4.04 0.00 2.28 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.80 0.00 0.00 0.00 0.00 0.00 2.40 2.44 0.00 32 N 8.25 4.39 0.00 2.78 2.85 0.00 0.00 7.23 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 33 D 7.94 4.40 0.00 2.71 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 34 L 7.51 4.79 0.00 1.75 1.75 0.93 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 35 H 8.28 4.30 0.00 3.45 3.58 0.00 5.46 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 L 7.55 3.89 0.00 1.57 1.68 0.83 1.07 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 37 P 0.00 4.28 0.00 2.03 2.11 0.00 3.89 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.04 0.00 38 L 7.80 4.17 0.00 1.80 1.75 0.95 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 39 L 8.15 4.03 0.00 2.05 1.76 1.11 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 40 N 7.73 4.86 0.00 2.82 2.88 0.00 0.00 6.80 7.58 0.00 0.00 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 L 8.17 4.41 0.00 1.57 1.68 0.93 1.09 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 42 M 7.75 4.35 0.00 2.30 2.27 0.00 0.00 0.00 0.00 0.00 2.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.79 2.73 0.00 43 L 7.36 4.48 0.00 1.67 1.50 0.57 0.70 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 44 T 8.25 4.42 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 1.20 0.00 0.00 45 P 0.00 4.48 0.00 2.19 1.86 0.00 3.87 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 1.98 1.95 0.00 46 D 9.39 4.47 0.00 2.77 2.77 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 0.00 0.00 0.00 47 E 8.17 3.99 0.00 2.09 1.87 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 2.30 2.33 0.00 48 R 7.92 3.83 0.00 2.13 1.96 0.00 3.21 0.00 0.00 3.33 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.83 0.00 49 E 8.17 4.19 0.00 2.01 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 2.30 2.50 0.00 50 A 8.49 4.46 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 51 L 8.20 4.01 0.00 1.93 1.72 0.97 0.64 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 52 G 7.46 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 0.00 0.00 0.00 53 T 8.10 4.06 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 1.22 0.00 0.00 54 R 8.02 3.94 0.00 1.87 2.06 0.00 3.15 0.00 0.00 3.13 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.94 0.00 55 V 7.82 3.68 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 1.00 0.00 0.00 0.97 0.00 0.00 56 R 8.21 3.91 0.00 2.09 2.11 0.00 3.28 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.83 0.00 57 I 7.82 3.72 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 1.72 0.92 0.92 0.00 0.00 58 V 7.86 3.49 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 0.77 0.00 0.00 0.98 0.00 0.00 59 E 8.41 4.07 0.00 2.19 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 2.32 2.38 0.00 60 E 8.45 4.03 0.00 2.30 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 2.43 0.00 61 L 8.09 4.08 0.00 1.89 1.75 0.97 0.88 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 62 L 7.60 4.22 0.00 1.72 1.69 0.93 1.14 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 63 R 7.79 4.50 0.00 1.77 1.93 0.00 3.16 0.00 0.00 3.22 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.58 0.00 64 G 7.57 4.12 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 0.00 65 E 7.63 3.74 0.00 1.99 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 2.31 2.40 0.00 66 M 7.89 4.04 0.00 2.00 2.06 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 2.61 2.49 0.00 67 S 8.23 4.69 0.00 3.77 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 68 Q 8.14 4.46 0.00 2.22 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.94 6.92 0.00 0.00 0.00 0.00 0.00 2.29 2.30 0.00 69 R 7.85 4.67 0.00 1.77 1.94 0.00 3.23 0.00 0.00 3.23 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.70 0.00 70 E 7.93 4.45 0.00 1.93 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 2.20 2.25 0.00 71 L 7.36 3.68 0.00 1.72 1.71 0.92 0.90 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 72 K 8.67 3.72 0.00 1.90 1.75 0.00 1.72 0.00 0.00 1.75 0.00 0.00 2.91 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.42 1.41 7.81 73 N 8.05 4.64 0.00 2.73 2.79 0.00 0.00 7.55 7.65 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 74 E 8.56 3.65 0.00 2.14 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 0.00 2.24 2.23 0.00 75 L 7.70 4.31 0.00 1.75 1.84 0.92 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 76 G 8.02 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 77 A 8.33 4.44 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 78 G 7.71 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 0.00 0.00 0.00 79 I 8.09 3.78 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 1.35 1.21 0.92 0.00 0.00 80 A 8.31 4.01 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 81 T 7.81 4.01 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 1.27 0.00 0.00 82 I 7.22 3.97 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 1.49 0.60 0.92 0.00 0.00 83 T 8.12 4.28 4.25 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 1.21 0.00 0.00 84 R 8.06 4.15 0.00 2.01 2.23 0.00 3.36 0.00 0.00 3.36 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.68 0.00 85 G 8.09 3.77 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 0.00 0.00 0.00 0.00 0.00 0.00 86 S 8.29 4.61 0.00 4.02 3.92 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 87 N 7.70 4.82 0.00 2.72 2.82 0.00 0.00 6.92 7.53 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 88 S 8.32 4.24 0.00 3.93 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 89 L 7.65 4.13 0.00 1.68 1.56 0.93 0.87 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 90 K 8.17 3.82 0.00 1.79 1.82 0.00 1.71 0.00 0.00 1.83 0.00 0.00 2.90 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.54 1.41 7.81 91 A 7.97 4.00 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 92 A 7.63 4.25 1.39 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 93 P 0.00 4.45 0.00 2.07 2.00 0.00 3.70 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 2.05 2.09 0.00 94 V 7.96 3.85 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 0.88 0.00 0.00 0.94 0.00 0.00 95 E 8.17 4.08 0.00 2.02 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 2.39 2.34 0.00 96 L 7.96 4.10 0.00 1.84 1.72 0.92 1.08 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 97 R 8.36 4.07 0.00 1.97 2.03 0.00 3.29 0.00 0.00 3.25 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.76 0.00 98 Q 7.83 4.23 0.00 2.26 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.05 6.89 0.00 0.00 0.00 0.00 0.00 2.42 2.39 0.00 99 W 8.02 4.60 0.00 3.15 3.28 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 0.00 100 L 8.54 3.45 0.00 1.90 1.78 0.92 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 101 E 8.37 3.95 0.00 2.00 2.01 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 2.41 2.62 0.00 102 E 8.88 3.96 0.00 1.85 1.59 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 2.19 2.23 0.00 103 V 6.97 3.62 1.67 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 0.46 0.00 0.00 -1.03 0.00 0.00 104 L 7.80 4.39 0.00 1.64 1.58 0.90 0.97 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 0.00 105 L 7.20 4.07 0.00 1.79 1.63 0.90 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 106 K 7.81 4.03 0.00 1.84 1.81 0.00 1.73 0.00 0.00 1.66 0.00 0.00 2.91 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.39 1.39 7.81 107 S 7.38 4.13 0.00 3.58 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