NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 V 4.0867 8.0549 120.3896 62.4329 32.3981 175.0800 2 L 3.9785 8.2736 127.7365 52.4238 42.2848 176.1206 3 S 4.5178 9.6751 119.4874 57.7524 66.1846 175.1017 4 E 4.2740 8.8160 121.3994 59.5981 29.2646 179.8526 5 G 3.6334 8.0891 105.2614 47.8340 0.0000 175.4655 6 E 3.9255 8.1911 121.0083 58.9872 29.3845 179.4791 7 W 4.4125 8.2613 119.1412 59.7820 29.0316 178.3150 8 Q 4.0795 8.5965 119.8352 59.2564 28.3814 178.4017 9 L 4.0689 7.9464 119.7167 57.6875 41.6671 179.6669 10 V 3.7870 7.9970 118.1323 66.2713 31.6337 178.1283 11 L 4.3420 8.5202 118.5166 57.3260 41.2506 178.9485 12 H 4.1864 8.3321 118.4064 59.3293 30.2673 177.3944 13 V 3.7426 7.7801 121.1721 64.4508 31.3454 178.0827 14 W 3.8662 8.5405 128.8626 60.1122 30.2892 177.8175 15 A 4.0431 8.0539 119.9011 54.7617 18.0593 179.4480 16 K 3.9098 7.6817 117.3337 59.3525 31.9947 179.6681 17 V 2.8698 6.9232 118.0912 65.5898 31.1688 177.2751 18 E 3.9810 7.4161 115.2856 57.5654 29.3594 178.1991 19 A 4.1971 7.4885 120.2589 53.4458 20.1877 177.5843 20 D 4.6579 7.9875 116.6739 52.0036 42.6184 175.5732 21 V 3.5352 7.8387 123.6460 66.0134 32.1215 176.7468 22 A 4.0532 8.0036 120.0622 55.0735 18.2792 179.7302 23 G 3.7213 8.3405 105.5682 45.5283 0.0000 175.7566 24 H 4.1622 8.1761 118.5849 58.4668 28.6555 178.1695 25 G 3.5728 8.3318 107.7433 47.6913 0.0000 175.8701 26 Q 3.8574 8.0809 120.2156 58.8775 28.8051 178.4148 27 D 4.2814 7.8437 119.7417 57.4624 40.8013 179.1466 28 I 3.6662 7.7905 120.1529 64.3708 37.0855 178.5275 29 L 3.4221 7.7689 119.8297 57.6053 41.2692 179.7250 30 I 3.6079 7.6128 119.7895 64.1207 36.9115 178.4281 31 R 3.7722 7.8701 119.5758 59.1919 29.9233 178.0415 32 L 3.9456 7.8312 120.2036 58.5965 41.5610 179.1944 33 F 4.5735 8.1577 117.7133 60.3096 38.5384 178.0907 34 K 4.0189 8.1053 117.7563 59.6825 32.0403 179.4112 35 S 4.2463 8.1291 114.2676 60.4072 64.1750 174.6147 36 H 4.7188 8.0848 118.1494 52.1094 29.2890 171.9486 37 P 4.4909 0.0000 0.0000 64.4635 31.2360 177.5901 38 E 4.0638 8.2572 116.4201 59.5122 29.2007 179.2222 39 T 3.8603 8.2455 111.4044 64.5783 68.8885 176.2995 40 L 3.4754 7.8599 123.3203 57.8190 41.8339 178.5998 41 E 4.0290 7.6371 117.6154 58.8680 29.5968 178.4425 42 K 4.4178 7.9889 116.8264 57.1072 32.6406 177.3303 43 F 4.5871 8.1005 119.0898 55.4848 39.4152 175.5165 44 D 4.4360 8.6604 124.5657 57.4814 40.9283 179.1140 45 R 3.8516 7.8024 116.4882 58.2101 30.1454 177.1330 46 F 5.0561 7.8171 114.2040 56.8661 40.7274 176.9221 47 K 4.0901 8.1006 119.2793 58.8317 32.5768 177.7404 48 H 4.3533 8.1340 114.6968 57.6548 28.8347 175.5204 49 L 4.2734 7.7192 121.6673 54.5128 41.6873 176.7532 50 K 4.5444 9.3383 122.5614 56.1105 34.4151 176.6276 51 T 4.7489 7.4988 108.4289 58.7983 73.1595 174.1502 52 E 3.9111 8.6891 121.8808 59.4214 29.7113 178.8789 53 A 3.9729 7.9640 120.3266 55.2118 18.2574 179.2537 54 E 3.9191 8.1249 116.0688 59.8092 29.9673 179.1617 55 M 4.1813 8.0917 118.6217 58.4937 31.8422 179.0843 56 K 4.0009 8.2058 117.3057 58.8958 32.2789 178.4661 57 A 4.4478 7.6510 118.7950 51.7271 19.1937 176.9839 58 S 4.4205 7.4925 113.5293 56.9328 62.6818 174.4120 59 E 4.0066 8.8248 129.4761 59.2841 29.4680 177.9531 60 D 4.4195 8.1814 117.8880 57.1339 41.2714 177.7926 61 L 3.3836 8.0724 121.0047 57.8207 42.0464 178.8372 62 K 3.8502 7.8973 119.1306 59.3838 32.0917 178.8485 63 K 3.9689 8.3706 118.9817 59.8981 31.9509 178.8539 64 H 4.4264 8.5903 118.5800 59.1206 29.7588 177.4763 65 G 3.5469 8.3877 108.0141 47.6859 0.0000 175.8492 66 V 3.6216 7.8063 120.5025 65.9956 31.5392 178.1300 67 T 3.8790 7.8795 115.5167 66.6878 68.3130 176.5983 68 V 3.5974 7.9469 120.1185 66.2470 31.5695 178.1517 69 L 4.2614 8.1639 118.4617 57.7609 41.4341 179.6652 70 T 3.9676 8.3136 116.1230 66.4708 68.4096 176.4976 71 A 3.9847 8.0250 122.7070 55.1485 18.3894 179.4556 72 L 3.7725 8.1722 119.0611 58.0490 42.1146 179.3190 73 G 3.3017 8.5008 105.8814 47.7350 0.0000 175.4815 74 A 4.0114 7.7233 122.1536 54.7336 18.6300 179.6046 75 I 3.7871 7.6167 118.2455 64.6058 37.2566 178.5902 76 L 3.9557 7.8846 120.1230 57.7578 41.2139 179.5676 77 K 4.0300 7.7666 116.3947 58.1541 32.2684 178.6550 78 K 3.9680 7.8325 118.4033 55.8798 32.7842 176.4253 79 K 2.0000 8.2459 118.4120 56.3795 29.8192 174.4270 80 G 4.0398 7.8328 105.7136 46.0036 0.0000 173.8021 81 H 4.7354 7.8401 117.8396 54.5875 27.5896 174.9648 82 H 5.2884 7.3054 110.6670 54.5678 29.6604 176.6114 83 E 3.9741 8.5850 121.8930 60.4043 28.9742 179.0214 84 A 4.1320 7.9081 118.7086 55.1435 18.5240 179.0583 85 E 4.1118 8.1173 116.7103 59.2871 29.6717 179.1611 86 L 4.0648 8.1028 119.1725 56.9876 41.7014 178.7811 87 K 3.7921 7.9024 119.7466 59.4324 31.9720 176.8803 88 P 4.5367 0.0000 0.0000 65.1103 31.2809 178.0443 89 L 3.9701 7.4525 116.9120 57.9869 41.9979 178.8441 90 A 4.1554 8.4571 121.1042 55.2506 18.2556 179.6293 91 Q 3.9318 8.2258 116.7940 59.1693 28.8237 179.2465 92 S 4.1146 8.3244 115.4461 61.8147 63.0007 176.2521 93 H 4.2285 8.6509 119.7281 58.1326 28.2256 177.7743 94 A 2.6578 8.0268 122.3914 54.6911 18.3424 179.0998 95 T 3.9279 7.4936 105.9446 62.3392 69.6032 175.3083 96 K 4.1630 7.4441 120.1342 58.2467 33.4582 176.8671 97 H 4.2719 8.1330 114.7501 56.1684 29.4894 175.5031 98 K 3.1612 7.5151 117.1598 57.0889 28.4546 176.0377 99 I 4.2155 7.9241 118.7732 58.7026 38.1853 174.9308 100 P 4.4257 0.0000 0.0000 62.2922 32.0553 177.7841 101 I 3.6686 8.6085 121.8507 64.6682 36.9192 178.4849 102 K 3.6862 7.9875 119.7773 59.7811 31.9234 178.2370 103 Y 4.1577 8.0392 116.8133 60.7267 37.7383 178.2208 104 L 4.1988 7.9081 119.9076 57.6450 41.7913 178.8377 105 E 3.9964 8.1111 119.4275 59.2170 29.5512 178.9033 106 F 4.4967 7.8981 117.8777 60.8121 38.9046 177.5704 107 I 3.8899 8.1853 118.1667 63.9873 37.7388 178.0841 108 S 4.1683 8.3041 116.4281 61.4708 62.6155 176.1589 109 E 4.0067 8.5103 121.8042 59.2597 29.3381 178.7175 110 A 4.0174 8.1597 120.8157 55.1324 18.3735 179.6072 111 I 3.6674 8.1074 118.5131 64.7263 37.3037 178.6754 112 I 3.8416 7.8475 120.5226 64.6578 36.9800 178.0026 113 H 4.1247 8.4932 119.0503 59.4294 29.6884 177.5561 114 V 3.6130 8.0789 120.1720 65.9007 31.3381 177.9372 115 L 3.7554 8.0108 118.9866 57.8105 41.0666 179.0139 116 H 4.3763 7.9020 117.2466 59.4009 29.9480 177.2023 117 S 4.2131 7.8770 115.7865 61.6968 62.7649 176.5242 118 R 4.0710 7.8915 119.2871 57.7882 30.7817 176.4456 119 H 5.0495 8.1829 116.3331 54.0452 30.1043 173.4951 120 P 4.2687 0.0000 0.0000 65.9216 31.3782 178.7631 121 G 3.7325 8.1382 106.1460 47.3639 0.0000 173.5611 122 D 5.0612 8.1599 118.1981 53.9948 41.6333 176.3107 123 F 4.9599 8.0831 121.1095 56.3415 39.6543 174.7397 124 G 3.8859 7.9188 107.7952 43.9080 0.0000 172.7434 125 A 3.9183 8.4299 120.8718 55.0143 18.2468 179.4859 126 D 4.1886 7.9931 116.9744 56.7736 39.3724 178.7031 127 A 3.9930 7.7684 121.8678 54.4935 18.3359 179.4543 128 Q 3.1982 7.9128 117.3150 58.7591 28.7264 179.2269 129 G 3.4853 8.1958 106.7743 47.6486 0.0000 175.6474 130 A 3.8791 7.9367 123.2775 55.0486 18.3369 179.4300 131 M 4.0063 8.3801 117.1105 58.6477 32.2850 177.7691 132 N 4.2880 8.4616 117.5634 56.8102 39.0390 176.9156 133 K 4.0543 8.1000 119.4335 59.4350 32.1001 179.1902 134 A 3.8529 8.0162 121.0773 55.1625 18.3043 179.6991 135 L 4.1166 8.2509 117.5490 57.5945 41.6727 179.4952 136 E 4.0028 8.6241 119.3170 59.2428 29.3731 178.9720 137 L 3.9736 8.1589 120.4898 58.0515 42.1475 178.5358 138 F 4.0844 8.2945 120.5496 61.6304 39.2879 177.3562 139 R 3.6336 8.1868 117.3453 58.9123 29.9307 178.8981 140 K 3.8105 8.3790 119.7879 59.8397 32.0224 178.6274 141 D 4.3606 8.2076 119.0302 57.1592 40.6221 178.8718 142 I 3.4422 7.5838 120.2875 64.1262 36.9708 178.2047 143 A 3.6994 8.1685 121.7637 55.0865 18.1278 179.5840 144 A 3.9531 7.8832 119.0734 55.1125 18.3916 180.0962 145 K 3.9790 7.8146 117.1058 59.7403 32.0663 178.9852 146 Y 4.3272 8.4110 117.4427 61.1839 37.8265 178.9189 147 K 3.9502 8.3672 120.3730 59.4202 32.1285 178.1765 148 E 3.9425 7.9095 118.4221 59.5237 29.6378 178.3796 149 L 4.3234 7.8288 115.5424 55.0470 41.8737 177.7849 150 G 3.8732 7.9547 107.2905 45.7938 0.0000 173.1551 151 Y 4.2697 8.0200 126.1095 57.2789 38.7284 175.3077 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 V 8.05 4.09 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 1.03 0.00 0.00 0.95 0.00 0.00 2 L 8.27 3.98 0.00 0.74 0.59 0.52 -0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 3 S 9.68 4.52 0.00 4.04 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 E 8.82 4.27 0.00 2.07 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 0.00 2.50 2.39 0.00 5 G 8.09 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 6 E 8.19 3.93 0.00 1.94 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 0.00 2.21 2.26 0.00 7 W 8.26 4.41 0.00 3.55 3.16 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 8 Q 8.60 4.08 0.00 2.24 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.81 0.00 0.00 0.00 0.00 0.00 2.43 2.60 0.00 9 L 7.95 4.07 0.00 1.96 1.75 0.94 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 10 V 8.00 3.79 2.49 0.00 0.00 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 0.92 0.00 0.00 11 L 8.52 4.34 0.00 1.86 1.81 0.93 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 12 H 8.33 4.19 0.00 3.31 3.57 0.00 5.95 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 13 V 7.78 3.74 2.47 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 0.99 0.00 0.00 0.82 0.00 0.00 14 W 8.54 3.87 0.00 3.65 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 15 A 8.05 4.04 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 16 K 7.68 3.91 0.00 1.43 1.54 0.00 1.61 0.00 0.00 1.45 0.00 0.00 2.71 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.47 1.43 7.81 17 V 6.92 2.87 0.77 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 -0.05 0.00 0.00 0.26 0.00 0.00 18 E 7.42 3.98 0.00 1.86 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 2.28 2.01 0.00 19 A 7.49 4.20 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 20 D 7.99 4.66 0.00 2.70 2.52 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.84 3.54 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 1.06 0.00 0.00 0.89 0.00 0.00 22 A 8.00 4.05 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 23 G 8.34 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 24 H 8.18 4.16 0.00 3.28 3.24 0.00 5.82 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 G 8.33 3.57 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 0.00 0.00 0.00 26 Q 8.08 3.86 0.00 2.22 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.74 0.00 0.00 0.00 0.00 0.00 2.30 2.45 0.00 27 D 7.84 4.28 0.00 2.62 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 28 I 7.79 3.67 1.88 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 1.51 0.61 0.89 0.00 0.00 29 L 7.77 3.42 0.00 1.27 0.75 0.70 0.44 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 30 I 7.61 3.61 1.84 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.54 0.87 0.00 0.00 31 R 7.87 3.77 0.00 1.93 2.07 0.00 3.06 0.00 0.00 2.95 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.62 0.00 32 L 7.83 3.95 0.00 1.79 1.54 1.10 1.14 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 33 F 8.16 4.57 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 34 K 8.11 4.02 0.00 1.69 1.83 0.00 1.69 0.00 0.00 1.68 0.00 0.00 2.99 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.48 1.64 7.81 35 S 8.13 4.25 0.00 3.77 3.53 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 36 H 8.08 4.72 0.00 3.04 2.84 0.00 5.63 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 37 P 0.00 4.49 0.00 2.14 2.11 0.00 3.82 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 1.99 0.00 38 E 8.26 4.06 0.00 2.27 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 1.95 2.27 0.00 39 T 8.25 3.86 4.58 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 0.00 0.00 0.00 1.10 0.00 0.00 40 L 7.86 3.48 0.00 1.37 1.79 0.05 0.85 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 41 E 7.64 4.03 0.00 2.07 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 2.38 2.45 0.00 42 K 7.99 4.42 0.00 1.93 1.72 0.00 1.77 0.00 0.00 1.76 0.00 0.00 3.20 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.73 1.95 7.81 43 F 8.10 4.59 0.00 3.21 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 44 D 8.66 4.44 0.00 2.61 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 45 R 7.80 3.85 0.00 0.67 0.67 0.00 3.02 0.00 0.00 2.93 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.42 0.00 46 F 7.82 5.06 0.00 2.83 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 47 K 8.10 4.09 0.00 1.86 2.25 0.00 1.74 0.00 0.00 1.78 0.00 0.00 3.01 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.43 1.45 7.81 48 H 8.13 4.35 0.00 3.30 3.48 0.00 5.52 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 L 7.72 4.27 0.00 1.62 1.60 0.93 0.82 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 50 K 9.34 4.54 0.00 1.67 1.81 0.00 1.66 0.00 0.00 1.75 0.00 0.00 3.22 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.45 1.48 7.81 51 T 7.50 4.75 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 52 E 8.69 3.91 0.00 2.05 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.36 0.00 53 A 7.96 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 54 E 8.12 3.92 0.00 2.11 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 2.36 2.36 0.00 55 M 8.09 4.18 0.00 2.07 2.24 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.82 2.61 0.00 56 K 8.21 4.00 0.00 1.82 1.85 0.00 1.67 0.00 0.00 1.68 0.00 0.00 3.00 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.43 1.42 7.81 57 A 7.65 4.45 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 58 S 7.49 4.42 0.00 3.95 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 59 E 8.82 4.01 0.00 2.14 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 2.40 2.46 0.00 60 D 8.18 4.42 0.00 2.96 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 61 L 8.07 3.38 0.00 1.35 1.61 -0.14 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 62 K 7.90 3.85 0.00 1.87 1.98 0.00 1.67 0.00 0.00 1.78 0.00 0.00 2.93 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.43 1.45 7.81 63 K 8.37 3.97 0.00 2.10 1.93 0.00 1.76 0.00 0.00 1.63 0.00 0.00 2.96 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.50 1.63 7.81 64 H 8.59 4.43 0.00 3.59 3.47 0.00 5.79 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 65 G 8.39 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.81 3.62 2.28 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 1.12 0.00 0.00 0.99 0.00 0.00 67 T 7.88 3.88 4.44 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 1.29 0.00 0.00 68 V 7.95 3.60 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 1.10 0.00 0.00 0.99 0.00 0.00 69 L 8.16 4.26 0.00 1.82 1.93 0.91 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 70 T 8.31 3.97 4.45 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 1.26 0.00 0.00 71 A 8.03 3.98 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 72 L 8.17 3.77 0.00 1.59 1.57 0.20 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 73 G 8.50 3.30 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 0.00 74 A 7.72 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 75 I 7.62 3.79 1.93 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.73 0.98 0.00 0.00 76 L 7.88 3.96 0.00 1.19 1.57 -0.10 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 77 K 7.77 4.03 0.00 1.66 1.80 0.00 1.70 0.00 0.00 1.72 0.00 0.00 3.16 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.46 1.50 7.81 78 K 7.83 3.97 0.00 1.85 1.82 0.00 1.74 0.00 0.00 1.60 0.00 0.00 3.14 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.63 1.77 7.81 79 K 8.25 2.00 0.00 1.23 0.74 0.00 1.48 0.00 0.00 1.42 0.00 0.00 2.67 0.00 0.00 3.01 0.00 0.00 0.00 0.00 0.30 0.71 7.81 80 G 7.83 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 0.00 0.00 0.00 81 H 7.84 4.74 0.00 3.17 3.23 0.00 5.57 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 H 7.31 5.29 0.00 3.27 3.45 0.00 5.66 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 E 8.58 3.97 0.00 2.09 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 2.42 2.47 0.00 84 A 7.91 4.13 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 85 E 8.12 4.11 0.00 2.24 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 2.40 2.47 0.00 86 L 8.10 4.06 0.00 1.68 1.62 0.72 0.61 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 87 K 7.90 3.79 0.00 1.85 1.84 0.00 1.64 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.46 1.49 7.81 88 P 0.00 4.54 0.00 2.34 2.31 0.00 4.08 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 1.90 0.00 89 L 7.45 3.97 0.00 1.89 1.86 0.93 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 90 A 8.46 4.16 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 91 Q 8.23 3.93 0.00 2.27 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.76 0.00 0.00 0.00 0.00 0.00 2.39 2.63 0.00 92 S 8.32 4.11 0.00 3.90 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 93 H 8.65 4.23 0.00 3.56 3.61 0.00 5.81 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 94 A 8.03 2.66 0.71 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 0.00 0.00 95 T 7.49 3.93 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 1.10 0.00 0.00 96 K 7.44 4.16 0.00 1.54 1.64 0.00 1.48 0.00 0.00 1.67 0.00 0.00 2.94 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.22 1.33 7.81 97 H 8.13 4.27 0.00 2.97 3.11 0.00 5.86 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 98 K 7.52 3.16 0.00 1.81 1.79 0.00 1.65 0.00 0.00 1.64 0.00 0.00 2.91 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.15 1.24 7.81 99 I 7.92 4.22 2.07 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 1.30 0.94 1.11 0.00 0.00 100 P 0.00 4.43 0.00 1.65 1.73 0.00 2.23 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.84 0.00 101 I 8.61 3.67 1.82 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 1.64 0.92 0.80 0.00 0.00 102 K 7.99 3.69 0.00 1.75 1.74 0.00 1.55 0.00 0.00 1.75 0.00 0.00 3.15 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.39 0.59 7.81 103 Y 8.04 4.16 0.00 3.19 3.11 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 0.00 104 L 7.91 4.20 0.00 1.85 1.84 0.70 1.04 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 0.00 105 E 8.11 4.00 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 2.38 2.38 0.00 106 F 7.90 4.50 0.00 3.24 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 0.00 107 I 8.19 3.89 2.04 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.67 1.08 0.00 0.00 108 S 8.30 4.17 0.00 4.20 3.97 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 0.00 109 E 8.51 4.01 0.00 2.14 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 2.39 2.57 0.00 110 A 8.16 4.02 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 0.00 111 I 8.11 3.67 2.09 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 1.60 0.75 1.05 0.00 0.00 112 I 7.85 3.84 2.01 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.14 1.15 0.00 0.00 113 H 8.49 4.12 0.00 3.33 3.44 0.00 5.59 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 V 8.08 3.61 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 0.97 0.00 0.00 0.99 0.00 0.00 115 L 8.01 3.76 0.00 1.21 0.42 0.91 0.77 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 0.00 116 H 7.90 4.38 0.00 3.48 3.55 0.00 5.96 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 S 7.88 4.21 0.00 3.94 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 0.00 118 R 7.89 4.07 0.00 1.38 1.51 0.00 2.72 0.00 0.00 2.70 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.47 0.00 119 H 8.18 5.05 0.00 3.18 3.19 0.00 5.63 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 P 0.00 4.27 0.00 2.18 2.20 0.00 3.66 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 1.93 0.00 121 G 8.14 3.73 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 0.00 0.00 0.00 122 D 8.16 5.06 0.00 2.75 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 0.00 123 F 8.08 4.96 0.00 2.99 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 0.00 124 G 7.92 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 0.00 0.00 0.00 125 A 8.43 3.92 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 0.00 126 D 7.99 4.19 0.00 2.83 2.90 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 0.00 127 A 7.77 3.99 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 0.00 128 Q 7.91 3.20 0.00 1.97 1.91 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 1.78 1.69 0.00 129 G 8.20 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.94 3.88 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 0.00 131 M 8.38 4.01 0.00 2.42 2.42 0.00 0.00 0.00 0.00 0.00 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.76 2.86 0.00 132 N 8.46 4.29 0.00 2.93 2.93 0.00 0.00 7.22 7.48 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 0.00 133 K 8.10 4.05 0.00 1.84 1.67 0.00 1.68 0.00 0.00 1.52 0.00 0.00 2.90 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.38 1.55 7.81 134 A 8.02 3.85 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 0.00 135 L 8.25 4.12 0.00 1.74 1.78 0.97 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 136 E 8.62 4.00 0.00 2.21 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 2.34 2.45 0.00 137 L 8.16 3.97 0.00 1.86 1.97 0.98 1.04 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 0.00 138 F 8.29 4.08 0.00 3.10 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 0.00 139 R 8.19 3.63 0.00 2.06 1.89 0.00 3.17 0.00 0.00 3.26 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.96 0.00 140 K 8.38 3.81 0.00 1.84 1.99 0.00 1.62 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.42 1.47 7.81 141 D 8.21 4.36 0.00 2.69 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 0.00 142 I 7.58 3.44 1.43 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.13 0.03 0.00 0.00 143 A 8.17 3.70 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 0.00 144 A 7.88 3.95 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 0.00 145 K 7.81 3.98 0.00 1.95 1.93 0.00 1.72 0.00 0.00 1.78 0.00 0.00 2.94 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.61 1.61 7.81 146 Y 8.41 4.33 0.00 3.16 3.03 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 0.00 147 K 8.37 3.95 0.00 1.93 2.00 0.00 1.66 0.00 0.00 1.58 0.00 0.00 2.91 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.45 1.45 7.81 148 E 7.91 3.94 0.00 2.04 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 0.00 2.35 2.38 0.00 149 L 7.83 4.32 0.00 1.83 1.68 0.92 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 150 G 7.95 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 0.00 151 Y 8.02 4.27 0.00 2.64 2.54 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