NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 M 4.5421 8.3044 120.2867 55.2785 33.8966 173.9424 3 V 4.2538 8.0648 121.1331 59.8612 33.9786 172.7822 4 W 4.6321 9.1596 135.0000 57.3736 31.6853 174.8781 5 T 4.1639 8.1947 124.0459 61.4621 66.9687 172.5726 6 P 4.5339 0.0000 0.0000 63.2952 32.2507 175.6935 7 V 4.0907 7.3541 119.5367 62.8167 32.8841 175.2942 8 N 4.2395 8.5438 124.7242 54.9887 36.1929 173.5126 9 N 5.0383 7.5847 109.2633 52.9061 39.9989 174.2137 10 K 4.1615 8.3070 116.5813 56.5378 32.9011 176.7534 11 M 4.9899 8.3788 120.7591 53.8796 35.2198 175.1353 12 F 4.6109 8.1305 116.1270 57.3629 41.0265 176.7791 13 E 3.5189 8.3328 121.5611 57.0592 27.6089 175.4035 14 T 3.7798 8.3586 122.2423 66.5566 68.8202 174.1884 15 F 4.5411 9.0621 124.1483 57.5793 36.5699 176.5145 16 S 4.4359 8.1648 115.1950 60.6379 63.0589 174.6089 17 Y 4.3875 8.3353 117.0144 58.2816 38.0890 174.9660 18 L 4.7103 7.5054 119.8872 52.0876 43.7376 174.5047 19 P 4.4378 0.0000 0.0000 61.8828 31.7863 175.0741 20 P 4.3578 0.0000 0.0000 62.7045 31.8310 176.4432 21 L 4.0285 8.2794 122.1882 54.8082 42.2559 177.9778 22 T 4.3030 8.1546 113.7570 61.0526 71.3101 175.5325 23 D 4.3574 8.4983 120.9120 57.5268 40.9001 178.7140 24 E 3.9390 8.0994 119.3993 59.2260 29.7494 178.7835 25 Q 3.9390 7.9123 117.9490 58.6864 28.6993 178.4566 26 I 3.6998 8.0988 121.0096 64.4700 37.1640 178.0358 27 A 4.0104 8.2096 121.3641 55.5070 18.1862 179.6004 28 A 3.9712 7.8662 118.5061 55.3762 18.5307 179.9467 29 Q 4.1222 8.0584 116.5963 58.9833 28.7888 179.0317 30 V 3.7349 8.3169 119.6799 66.2534 31.5628 177.7394 31 D 4.4397 8.4474 118.7617 57.6112 40.4386 178.3632 32 Y 4.1498 8.0858 119.8918 60.6397 38.8704 177.9020 33 I 3.9333 7.9052 120.5497 64.5910 37.4103 178.6700 34 V 3.5653 7.9833 118.7596 65.8526 31.1728 177.9293 35 A 3.9420 7.9765 119.6162 54.4593 18.2519 178.3286 36 N 4.1026 7.1109 112.5498 52.3030 38.8210 175.9131 37 G 3.7446 7.2061 107.9781 45.6833 0.0000 173.7895 38 W 4.9973 7.4659 118.6574 55.9334 30.7922 176.2946 39 I 4.3928 8.9044 123.3715 59.5246 37.7962 174.0290 40 P 4.9021 0.0000 0.0000 62.9724 32.7551 175.1837 41 C 5.0024 8.8314 121.0381 58.4999 35.6658 172.4081 42 L 5.2617 8.7294 124.2532 53.2171 44.2489 175.1721 43 E 5.5994 9.1604 121.5425 54.7423 33.7048 174.8281 44 F 5.6369 9.1904 116.5405 55.6986 42.2320 173.2735 45 A 4.4775 8.3798 120.5817 50.1990 22.6336 176.3016 46 E 4.2166 8.7908 119.8823 55.9348 30.5726 177.7007 47 A 4.3086 8.9245 122.9294 55.9018 18.3218 179.9076 48 D 4.5657 8.1917 112.8863 56.4232 41.0045 177.2826 49 K 4.6152 7.9450 116.9261 56.0208 32.6709 176.6918 50 A 3.9886 7.7282 124.0557 53.6392 19.0964 178.1432 51 Y 4.6532 7.4466 111.5516 55.6083 40.1070 175.7555 52 V 3.8183 8.4165 122.5630 63.8288 32.0012 175.2983 53 S 4.8099 8.9246 119.9344 57.3222 66.2670 173.7990 54 N 5.2789 8.5505 114.6437 52.5053 39.6460 176.1724 55 E 3.9796 8.3389 119.3939 59.7944 29.3673 179.1729 56 S 4.0158 8.7881 115.5429 60.6565 62.8823 176.0541 57 A 2.5800 7.5930 123.2920 53.6365 17.7263 179.0224 58 I 3.5658 6.9216 116.3636 63.7585 38.0003 177.1748 59 R 4.2598 7.5843 116.5978 55.9590 30.5891 176.4611 60 F 4.9782 7.1869 117.9272 56.2453 41.0339 177.5467 61 G 4.0970 8.2399 117.9660 46.2876 0.0000 175.9675 62 S 4.6794 8.4507 114.8805 58.6855 62.3078 174.4240 63 V 4.4362 7.3110 107.2343 61.1939 32.9638 177.5818 64 S 4.5280 8.2072 114.5930 59.3831 63.6250 173.4547 65 C 4.0491 8.0404 119.4284 61.5000 27.9698 173.1412 66 L 3.6851 8.4706 122.8891 55.6125 38.9427 173.1299 67 Y 4.4046 7.6079 119.5526 56.0269 39.9507 174.6586 68 Y 4.8745 7.0895 123.1925 56.4182 42.3871 174.6559 69 D 4.4736 8.9113 123.7060 55.4208 41.6841 176.9490 70 N 4.5169 8.9217 117.1633 54.1087 35.9902 175.9543 71 R 3.9253 7.9399 118.7877 59.3457 30.3127 177.1723 72 Y 4.4185 7.6722 114.7650 57.8799 38.3957 175.2037 73 W 5.0633 8.6755 124.5115 55.5615 32.6024 174.5724 74 T 4.3126 8.1039 117.1916 62.4406 69.5368 174.6105 75 M 4.6284 8.5195 126.8104 55.3878 33.1223 175.1523 76 W 4.8616 9.5814 135.0000 56.4290 31.4409 176.9262 77 K 3.4642 8.6642 128.6026 57.4655 30.7716 178.3195 78 L 4.9197 8.3300 123.9934 52.6765 45.2912 174.0097 79 P 4.3488 0.0000 0.0000 63.3406 31.9602 177.5420 80 M 4.2823 8.4725 123.2079 53.7115 30.4272 175.3271 81 F 4.3230 7.4312 119.1876 58.6495 39.9939 176.3857 82 G 3.9591 9.1113 112.4690 45.6471 0.0000 172.8822 83 C 4.3008 7.7971 121.0822 59.3917 31.6588 173.1956 84 R 4.5094 8.6765 124.5866 55.6348 30.7890 174.7952 85 D 4.8326 7.7404 118.4175 51.4820 42.7849 174.5508 86 P 4.3481 0.0000 0.0000 65.9877 31.3406 178.5591 87 M 4.1452 8.2401 117.1874 58.2634 31.6604 178.5711 88 Q 4.0192 8.0232 119.5736 58.9355 29.2245 178.3875 89 V 3.6161 7.7349 118.9108 66.0881 31.8257 177.8997 90 L 4.0619 8.0176 118.6895 57.8817 41.4013 179.7838 91 R 4.0270 8.1753 118.0834 59.0519 29.9261 178.8814 92 E 4.1537 8.0529 118.5425 59.1230 29.5018 179.0651 93 I 3.5311 7.7884 120.0027 64.3444 37.1706 178.5178 94 V 3.4586 7.5701 118.0090 65.9718 31.4031 177.8142 95 A 3.9370 7.9694 120.4409 55.2198 18.2260 179.1720 96 C 2.0000 7.7443 117.5693 62.1229 31.0250 176.0287 97 T 3.7610 7.5605 111.1546 64.2753 67.9716 176.4213 98 K 3.8138 7.7416 121.9370 59.3785 32.3348 178.4583 99 A 3.9496 7.5367 119.8189 53.5314 19.9751 177.6376 100 F 4.7296 7.6591 115.4649 55.1871 39.1495 173.9936 101 P 4.4365 0.0000 0.0000 64.2660 31.9496 177.8981 102 D 4.6715 8.0673 116.9199 53.8594 41.0895 175.3989 103 A 4.7361 7.3785 120.6632 50.3320 21.5025 176.9759 104 Y 4.2282 8.4632 117.6832 57.7308 39.3294 175.1867 105 V 5.1903 8.9136 123.4555 61.1114 35.1687 174.3570 106 R 5.0061 9.5681 123.5486 54.3026 33.2363 173.6118 107 L 4.8976 8.1389 123.1377 53.6979 43.9699 175.6794 108 V 4.8035 8.5688 118.3624 59.4706 36.2093 174.2432 109 A 4.9815 8.0735 121.6652 50.4646 22.8311 175.1955 110 F 5.2472 9.1036 119.5781 55.7175 42.7095 174.0892 111 D 5.4219 8.7889 122.2222 52.7211 42.5383 176.5847 112 N 4.7319 9.1743 122.9592 54.2404 38.3844 176.2472 113 Q 4.2135 8.4863 118.3501 58.5241 29.0862 177.3566 114 K 4.0591 8.2923 115.1389 56.7446 33.0975 176.4090 115 Q 3.4110 8.0079 118.2785 56.0129 27.0931 172.5809 116 V 4.5266 7.7455 117.3432 60.0380 35.0572 174.2322 117 Q 4.3980 8.6881 123.0480 56.4026 29.3310 175.4754 118 I 4.1807 8.1502 124.9486 61.3390 39.8693 174.3123 119 M 4.4987 6.5731 117.4575 54.1164 34.2666 173.6510 120 G 5.0151 8.2026 110.9531 47.5123 0.0000 171.8748 121 F 4.9413 6.9751 115.2138 55.4456 40.9627 172.6758 122 L 4.5801 8.8809 122.7972 55.4919 42.0234 176.7445 123 V 4.5102 8.7572 118.2981 61.6145 34.0591 175.7017 124 Q 4.6529 7.8093 120.8964 54.4388 32.4502 173.3159 125 R 4.4589 8.1159 121.1161 52.9609 32.9246 173.3824 126 P 4.1937 0.0000 0.0000 62.7046 31.7791 177.6935 127 K 4.0581 8.4470 119.9963 59.3685 32.1477 178.0965 128 T 4.1656 7.7661 106.4510 61.8758 69.3437 174.6824 129 A 4.2657 7.7930 126.7300 52.9718 18.6246 177.5372 130 R 4.7156 8.7964 121.5806 55.9987 31.6341 175.5167 131 D 5.0019 8.6119 115.4860 52.7445 39.8228 175.0644 132 F 5.3471 7.9084 113.1051 55.4158 40.9955 173.8422 133 Q 4.4188 8.3223 119.9652 53.0024 31.3888 174.1864 134 P 4.4774 0.0000 0.0000 62.2879 32.3076 176.9524 135 A 3.9513 8.9002 123.5452 55.6591 18.1318 179.1750 136 N 4.6589 8.0583 109.0087 53.6644 37.8713 175.4765 137 K 4.4201 7.9020 117.9443 56.4014 32.7741 177.4229 138 R 3.5737 7.5865 121.2903 57.7599 30.1316 176.7268 139 S 5.1171 7.5170 110.1415 56.2836 65.9605 174.2355 140 V 3.9836 8.5113 114.6663 61.7050 31.9578 175.6591 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 M 8.30 4.54 0.00 1.98 2.15 0.00 0.00 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.58 0.00 3 V 8.06 4.25 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 1.09 0.00 0.00 0.97 0.00 0.00 4 W 9.16 4.63 0.00 3.48 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 5 T 8.19 4.16 4.08 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 0.00 0.00 1.03 0.00 0.00 6 P 0.00 4.53 0.00 2.23 2.19 0.00 3.78 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 1.96 1.96 0.00 7 V 7.35 4.09 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 0.77 0.00 0.00 0.91 0.00 0.00 8 N 8.54 4.24 0.00 2.76 2.84 0.00 0.00 6.78 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 9 N 7.58 5.04 0.00 2.65 2.71 0.00 0.00 7.30 6.68 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 10 K 8.31 4.16 0.00 1.94 1.52 0.00 0.61 0.00 0.00 1.17 0.00 0.00 2.55 0.00 0.00 2.53 0.00 0.00 0.00 0.00 1.33 1.37 7.81 11 M 8.38 4.99 0.00 2.08 2.10 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.66 0.00 12 F 8.13 4.61 0.00 3.11 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 13 E 8.33 3.52 0.00 2.13 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 2.19 2.13 0.00 14 T 8.36 3.78 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 0.07 0.00 0.00 15 F 9.06 4.54 0.00 3.28 3.15 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 0.00 0.00 0.00 16 S 8.16 4.44 0.00 4.14 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 0.00 17 Y 8.34 4.39 0.00 3.02 3.19 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 18 L 7.51 4.71 0.00 1.83 1.61 0.85 1.35 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 19 P 0.00 4.44 0.00 2.03 2.00 0.00 3.70 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.13 0.00 20 P 0.00 4.36 0.00 2.05 2.02 0.00 3.70 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.17 0.00 21 L 8.28 4.03 0.00 1.61 1.51 0.35 0.55 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 22 T 8.15 4.30 4.22 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 1.19 0.00 0.00 23 D 8.50 4.36 0.00 2.71 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 24 E 8.10 3.94 0.00 2.02 1.92 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 2.36 2.39 0.00 25 Q 7.91 3.94 0.00 2.34 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.58 0.00 0.00 0.00 0.00 0.00 2.26 2.32 0.00 26 I 8.10 3.70 2.06 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.80 1.09 0.00 0.00 27 A 8.21 4.01 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 28 A 7.87 3.97 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 29 Q 8.06 4.12 0.00 2.50 2.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.75 0.00 0.00 0.00 0.00 0.00 2.39 1.98 0.00 30 V 8.32 3.73 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 1.10 0.00 0.00 1.05 0.00 0.00 31 D 8.45 4.44 0.00 2.98 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 32 Y 8.09 4.15 0.00 3.23 3.33 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 33 I 7.91 3.93 2.16 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.20 1.09 0.00 0.00 34 V 7.98 3.57 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 1.02 0.00 0.00 0.98 0.00 0.00 35 A 7.98 3.94 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 36 N 7.11 4.10 0.00 1.44 1.42 0.00 0.00 7.07 7.54 0.00 0.00 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 G 7.21 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 0.00 0.00 0.00 38 W 7.47 5.00 0.00 3.36 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 39 I 8.90 4.39 2.14 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.91 0.78 0.00 0.00 40 P 0.00 4.90 0.00 2.09 1.99 0.00 3.84 0.00 0.00 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.13 0.00 41 C 8.83 5.00 0.00 3.10 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 42 L 8.73 5.26 0.00 1.86 1.63 0.92 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 43 E 9.16 5.60 0.00 2.06 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 0.00 2.35 2.32 0.00 44 F 9.19 5.64 0.00 2.99 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 45 A 8.38 4.48 -0.25 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 46 E 8.79 4.22 0.00 2.18 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 0.00 2.31 2.28 0.00 47 A 8.92 4.31 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 48 D 8.19 4.57 0.00 2.71 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 49 K 7.95 4.62 0.00 1.54 1.69 0.00 1.71 0.00 0.00 1.86 0.00 0.00 2.99 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.34 1.43 7.81 50 A 7.73 3.99 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 Y 7.45 4.65 0.00 2.93 2.75 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 52 V 8.42 3.82 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 0.67 0.00 0.00 0.79 0.00 0.00 53 S 8.92 4.81 0.00 4.06 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 54 N 8.55 5.28 0.00 2.75 2.82 0.00 0.00 6.59 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 55 E 8.34 3.98 0.00 2.15 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 0.00 2.39 2.38 0.00 56 S 8.79 4.02 0.00 3.88 3.76 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 57 A 7.59 2.58 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 58 I 6.92 3.57 1.78 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 1.48 0.81 0.88 0.00 0.00 59 R 7.58 4.26 0.00 1.91 2.02 0.00 3.20 0.00 0.00 3.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.58 0.00 60 F 7.19 4.98 0.00 3.00 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 61 G 8.24 4.10 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 0.00 0.00 0.00 62 S 8.45 4.68 0.00 3.86 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 V 7.31 4.44 1.84 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 0.66 0.00 0.00 0.45 0.00 0.00 64 S 8.21 4.53 0.00 4.09 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 0.00 65 C 8.04 4.05 0.00 2.97 2.95 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 66 L 8.47 3.69 0.00 1.80 1.78 0.94 0.98 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 67 Y 7.61 4.40 0.00 2.95 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 68 Y 7.09 4.87 0.00 2.79 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 69 D 8.91 4.47 0.00 2.79 2.66 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 70 N 8.92 4.52 0.00 3.06 3.25 0.00 0.00 6.99 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 71 R 7.94 3.93 0.00 1.49 1.69 0.00 3.05 0.00 0.00 3.21 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.55 0.00 72 Y 7.67 4.42 0.00 3.04 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 73 W 8.68 5.06 0.00 3.09 3.19 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 74 T 8.10 4.31 2.89 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 0.88 0.00 0.00 75 M 8.52 4.63 0.00 2.06 2.01 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 2.69 2.76 0.00 76 W 9.58 4.86 0.00 3.70 3.31 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 77 K 8.66 3.46 0.00 1.66 0.74 0.00 1.51 0.00 0.00 1.53 0.00 0.00 2.76 0.00 0.00 2.33 0.00 0.00 0.00 0.00 0.84 0.21 7.81 78 L 8.33 4.92 0.00 1.58 1.55 0.99 1.03 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 79 P 0.00 4.35 0.00 0.56 1.78 0.00 3.62 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 2.11 0.00 80 M 8.47 4.28 0.00 2.06 2.01 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.53 0.00 81 F 7.43 4.32 0.00 3.10 2.96 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 82 G 9.11 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 83 C 7.80 4.30 0.00 2.95 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 84 R 8.68 4.51 0.00 1.81 1.88 0.00 3.19 0.00 0.00 3.16 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.58 0.00 85 D 7.74 4.83 0.00 2.72 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 86 P 0.00 4.35 0.00 2.22 2.20 0.00 3.67 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.20 0.00 87 M 8.24 4.15 0.00 2.08 2.27 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.71 0.00 88 Q 8.02 4.02 0.00 2.24 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.81 0.00 0.00 0.00 0.00 0.00 2.40 2.40 0.00 89 V 7.73 3.62 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 1.05 0.00 0.00 1.02 0.00 0.00 90 L 8.02 4.06 0.00 1.90 1.72 0.95 0.92 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 91 R 8.18 4.03 0.00 2.06 2.01 0.00 3.14 0.00 0.00 3.18 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.89 0.00 92 E 8.05 4.15 0.00 2.17 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 0.00 2.62 2.65 0.00 93 I 7.79 3.53 1.99 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 0.87 0.86 0.00 0.00 94 V 7.57 3.46 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 0.97 0.00 0.00 0.94 0.00 0.00 95 A 7.97 3.94 1.51 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 96 C 7.74 2.00 0.00 1.23 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 0.00 0.00 0.00 0.00 97 T 7.56 3.76 4.35 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 1.12 0.00 0.00 98 K 7.74 3.81 0.00 1.79 1.98 0.00 1.76 0.00 0.00 1.68 0.00 0.00 2.99 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.38 1.38 7.81 99 A 7.54 3.95 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 0.00 100 F 7.66 4.73 0.00 2.78 2.75 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 0.00 101 P 0.00 4.44 0.00 2.11 2.10 0.00 3.25 0.00 0.00 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.87 0.00 102 D 8.07 4.67 0.00 2.67 2.67 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 0.00 0.00 0.00 0.00 103 A 7.38 4.74 1.28 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 0.00 0.00 104 Y 8.46 4.23 0.00 2.55 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 0.00 105 V 8.91 5.19 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 0.88 0.00 0.00 106 R 9.57 5.01 0.00 1.81 1.94 0.00 2.31 0.00 0.00 2.25 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.37 0.00 107 L 8.14 4.90 0.00 1.49 0.74 0.91 0.75 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 0.00 108 V 8.57 4.80 1.62 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 0.49 0.00 0.00 0.51 0.00 0.00 109 A 8.07 4.98 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 0.00 110 F 9.10 5.25 0.00 2.99 2.89 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 0.00 111 D 8.79 5.42 0.00 2.38 2.44 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 0.00 112 N 9.17 4.73 0.00 2.93 3.05 0.00 0.00 6.31 7.39 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 0.00 113 Q 8.49 4.21 0.00 2.31 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 7.00 0.00 0.00 0.00 0.00 0.00 2.45 2.54 0.00 114 K 8.29 4.06 0.00 1.75 1.87 0.00 2.14 0.00 0.00 1.61 0.00 0.00 2.96 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.44 1.46 7.81 115 Q 8.01 3.41 0.00 2.11 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.73 0.00 0.00 0.00 0.00 0.00 2.25 2.30 0.00 116 V 7.75 4.53 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 0.58 0.00 0.00 0.92 0.00 0.00 117 Q 8.69 4.40 0.00 2.12 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.89 0.00 0.00 0.00 0.00 0.00 2.17 1.90 0.00 118 I 8.15 4.18 1.22 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.29 0.28 -0.45 0.00 0.00 119 M 6.57 4.50 0.00 2.17 2.25 0.00 0.00 0.00 0.00 0.00 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.74 0.00 120 G 8.20 5.02 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 0.00 121 F 6.98 4.94 0.00 3.18 3.21 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 0.00 122 L 8.88 4.58 0.00 1.67 1.64 0.88 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 123 V 8.76 4.51 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 0.70 0.00 0.00 0.91 0.00 0.00 124 Q 7.81 4.65 0.00 2.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.82 0.00 0.00 0.00 0.00 0.00 2.27 2.23 0.00 125 R 8.12 4.46 0.00 1.29 1.52 0.00 2.21 0.00 0.00 2.88 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 1.24 0.00 126 P 0.00 4.19 0.00 2.09 2.13 0.00 2.20 0.00 0.00 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.51 0.00 127 K 8.45 4.06 0.00 1.74 1.91 0.00 1.72 0.00 0.00 1.74 0.00 0.00 2.99 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.43 1.38 7.81 128 T 7.77 4.17 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 1.21 0.00 0.00 129 A 7.79 4.27 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.80 4.72 0.00 1.80 1.89 0.00 3.32 0.00 0.00 3.29 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.72 0.00 131 D 8.61 5.00 0.00 2.89 2.94 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 0.00 132 F 7.91 5.35 0.00 3.23 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 0.00 133 Q 8.32 4.42 0.00 1.86 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 7.05 0.00 0.00 0.00 0.00 0.00 2.32 2.04 0.00 134 P 0.00 4.48 0.00 2.20 2.17 0.00 3.54 0.00 0.00 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.87 0.00 135 A 8.90 3.95 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 0.00 136 N 8.06 4.66 0.00 2.83 2.94 0.00 0.00 5.88 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 0.00 137 K 7.90 4.42 0.00 1.60 1.71 0.00 1.61 0.00 0.00 1.64 0.00 0.00 2.91 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.30 1.29 7.81 138 R 7.59 3.57 0.00 1.67 0.66 0.00 3.11 0.00 0.00 3.18 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 1.20 0.00 139 S 7.52 5.12 0.00 4.06 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 0.00 140 V 8.51 3.98 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 0.62 0.00 0.00 0.96 0.00 0.00