NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 P 4.3078 0.0000 0.0000 61.8660 32.9687 176.7720 2 K 4.4680 7.6307 117.1708 55.1466 33.3483 171.3826 3 L 4.8586 8.3620 121.7934 54.0103 43.5339 177.7036 4 S 4.5478 8.5402 117.1835 57.9008 65.6625 175.4435 5 Q 4.2339 8.5066 120.6459 58.9653 28.4183 177.7082 6 D 4.3404 8.2171 119.6043 56.5746 41.3139 177.1744 7 E 3.9735 8.9922 119.8050 59.8079 29.5302 179.6868 8 I 3.8413 8.0873 118.6491 64.3957 37.5176 177.5555 9 D 4.5989 8.0934 119.8077 57.8546 40.4231 178.7989 10 D 4.4305 8.2465 118.9103 57.5225 40.8526 178.7515 11 L 3.9406 7.9732 120.5768 58.7276 41.4446 178.2234 12 K 4.2923 8.6580 119.2693 57.8506 31.7344 179.2793 13 E 4.0679 7.8256 118.1498 59.9003 29.8831 179.6312 14 V 3.9197 7.7525 118.1758 65.7028 31.3904 177.3675 15 F 3.9181 8.2897 120.6274 61.5017 39.5799 176.6330 16 E 4.1446 9.6821 119.0857 59.5773 29.4308 178.4761 17 L 3.9893 8.7724 120.9004 58.3297 42.2416 178.6716 18 F 4.1541 9.1551 117.3792 58.9299 38.7276 175.9047 19 D 5.3512 7.8856 118.6682 53.7240 41.0954 176.4344 20 F 4.2861 7.7909 119.0946 58.7886 39.6620 175.3460 21 W 4.5185 7.3714 115.4044 57.0867 29.9614 175.7539 22 D 4.6928 7.8822 117.1072 51.5455 40.5284 174.6064 23 G 3.8071 7.6802 108.5716 45.0919 0.0000 173.1996 24 R 3.8986 7.4020 125.3143 54.5277 30.7848 176.0293 25 D 5.5658 9.4540 135.0000 53.4188 39.8544 176.3499 26 G 3.9655 8.5434 108.8086 46.5777 0.0000 173.2798 27 A 5.0946 8.9122 119.8840 50.1225 22.7816 176.8345 28 V 4.4179 9.0883 122.7630 60.6028 34.1141 174.2623 29 D 4.9185 9.1219 127.4992 55.2306 41.6862 177.0439 30 A 3.5678 9.4488 128.9764 54.9569 18.8631 179.3271 31 F 4.1742 8.8918 117.2769 60.7181 39.7171 176.7208 32 K 4.3838 9.3306 119.6683 56.4311 31.9622 177.9828 33 I 4.2801 7.7916 112.7818 62.3203 37.7916 176.9996 34 G 3.7633 7.6129 107.8080 47.3614 0.0000 175.8263 35 D 4.3325 7.7485 120.9440 56.3942 40.7780 179.0210 36 V 3.0135 7.7703 119.4741 65.9852 31.5185 177.7334 37 C 4.1834 8.0639 115.9236 63.0464 27.8272 175.8863 38 R 4.2411 7.4832 119.2678 59.1474 29.7579 178.5494 39 C 4.4002 7.6008 115.1187 62.6037 28.1695 175.8697 40 L 4.3056 7.7792 120.3126 56.4919 41.4067 177.6720 41 G 4.1578 7.6540 116.1923 45.5873 0.0000 172.3652 42 I 4.4869 7.3978 122.5398 59.7320 39.6064 175.3065 43 N 4.9839 8.3140 123.0799 51.4516 37.2159 172.4812 44 P 4.4864 0.0000 0.0000 62.1454 33.0549 176.3857 45 R 4.5555 8.1248 117.9445 54.1831 33.9578 177.1492 46 N 3.8068 8.1279 117.5083 56.2624 38.2682 177.5851 47 E 3.6748 7.2742 118.0510 59.2964 29.6037 178.1908 48 D 4.3294 7.9403 117.0062 57.9120 40.6534 179.2726 49 V 3.7765 8.0857 112.7056 64.2172 31.3675 178.6810 50 F 4.7690 8.3035 117.9354 59.0791 39.3521 176.1087 51 A 4.7346 7.7418 121.0152 50.9414 18.4890 178.2003 52 V 4.2053 7.2107 110.8166 62.5542 36.1122 173.3287 53 G 3.5516 9.4054 114.1503 46.5423 0.0000 174.8748 54 G 4.2723 7.7077 110.4064 44.2276 0.0000 173.2068 55 T 4.4762 8.2266 116.4869 60.8170 70.2036 174.9672 56 H 4.2958 8.7564 120.7073 57.6631 29.1504 175.6887 57 K 4.4240 7.6663 118.3056 53.9784 34.8734 175.3623 58 M 3.8144 7.5569 123.9734 56.4018 32.9173 176.2041 59 G 3.8125 10.7222 109.2733 46.7802 0.0000 173.6019 60 E 4.5730 7.5171 113.8180 55.5697 32.7551 176.6237 61 K 4.3480 7.5748 115.8262 55.7341 35.3491 173.7858 62 S 5.2089 9.0529 122.1771 56.8704 65.6682 173.2048 63 L 5.0384 8.5826 120.4779 52.7457 45.0624 174.1035 64 P 5.4483 0.0000 0.0000 60.4621 33.6393 176.4976 65 F 3.1574 8.9170 123.5214 61.4467 38.9255 177.4240 66 E 4.0805 8.3046 116.8318 58.9064 29.1215 178.0903 67 E 4.2380 7.9761 118.7619 58.5009 30.0937 177.5458 68 F 3.8503 8.9619 121.3481 61.0049 39.2574 176.6609 69 L 3.7688 7.3690 119.5606 57.9178 42.1915 176.8903 70 P 4.2702 0.0000 0.0000 66.0179 31.1264 178.1267 71 A 3.9646 7.4485 118.6929 55.4121 18.0721 178.6698 72 Y 4.1831 7.4798 116.1052 60.0178 39.0276 177.5961 73 E 3.9871 8.5390 120.6091 59.2057 29.5031 178.6793 74 G 3.8489 7.9341 105.7636 48.3576 0.0000 174.8181 75 L 4.1187 7.5930 120.6897 57.5487 41.4641 179.1120 76 M 3.9182 7.4958 118.0379 58.3978 31.8512 177.5502 77 D 4.3817 7.9334 117.4890 56.7411 41.5322 176.4036 78 C 3.4421 7.4508 114.6240 59.7578 27.9627 172.7312 79 E 3.6801 8.5350 125.8616 56.1892 28.8059 175.7645 80 Q 4.3691 8.3883 127.7986 54.1314 30.2960 175.4962 81 G 3.5144 8.7113 113.5733 45.2477 0.0000 172.1981 82 T 4.5345 6.7566 108.1101 58.8455 73.0766 173.8075 83 Y 4.3906 8.6627 121.3159 61.0658 38.4928 178.3179 84 A 3.7252 7.9042 120.7841 55.2338 18.4934 178.7817 85 D 4.2254 7.5268 116.0248 58.7884 40.7260 178.5376 86 Y 4.3128 8.6146 117.7225 59.7486 37.6785 178.5588 87 M 3.7170 8.7003 118.8204 58.1357 32.1403 178.7485 88 E 3.8792 8.3073 119.1347 59.8215 30.1455 179.5776 89 A 4.1620 8.2697 120.6751 55.1940 18.3652 179.4761 90 F 4.4293 7.7877 113.4404 59.3210 38.8209 176.7524 91 K 4.0792 8.1187 119.8369 57.9678 31.8742 177.5193 92 T 4.4035 7.7733 107.7585 62.1355 68.6813 174.9726 93 F 4.6742 8.1885 119.9214 58.0847 42.0071 175.6637 94 D 5.0044 7.8711 122.2165 52.7772 39.3409 176.3780 95 R 3.9829 8.0847 119.2092 59.2290 29.8882 178.6129 96 E 3.9287 8.4342 118.0167 56.8668 29.8285 176.3360 97 G 4.0469 8.7137 106.4317 46.9235 0.0000 173.6664 98 Q 4.4774 8.6490 114.6382 55.4086 30.8738 174.9226 99 G 3.3767 9.6794 104.5906 44.7506 0.0000 173.0398 100 F 5.4534 7.9793 116.1295 54.8645 41.9570 174.5767 101 I 4.6028 8.3424 119.2297 59.5749 41.6810 173.3760 102 S 4.0929 9.1163 122.7914 59.0513 62.5863 175.1502 103 G 3.7533 8.9433 113.4996 48.2430 0.0000 175.6180 104 A 4.0560 7.9134 122.1811 54.4567 18.5868 178.6644 105 E 3.8979 9.3721 118.8435 60.1162 29.6469 178.3448 106 L 3.6328 8.0768 118.7582 58.6751 42.1706 179.1013 107 R 3.8875 8.0356 117.1537 59.8034 30.2566 178.5120 108 H 4.1995 8.5342 118.0128 59.6166 29.8412 176.8232 109 V 3.4600 8.0844 120.0468 66.6564 31.2125 177.7248 110 L 4.1405 8.3846 118.7166 57.2784 41.3136 179.0902 111 S 4.6229 7.9191 109.3449 57.7745 64.1468 174.5176 112 G 4.0823 8.8399 108.1709 45.1249 0.0000 172.6454 113 L 4.8315 7.5860 119.4480 52.7225 46.4461 180.4325 114 G 3.8769 8.0661 109.5339 46.9798 0.0000 177.3665 115 E 4.3024 8.5938 121.2110 53.6954 27.7712 174.0297 116 R 3.8529 7.7921 118.6290 57.0857 30.9671 176.7981 117 L 4.5718 8.3216 124.3839 54.0605 44.2727 175.5559 118 S 4.7445 7.9878 113.4464 57.1559 65.0643 175.0408 119 D 4.4261 9.1232 123.8265 57.6784 40.5426 179.2984 120 E 3.9354 8.1353 117.2303 59.6008 29.7297 178.5489 121 E 3.9002 8.2712 121.0657 58.8044 29.6075 179.0383 122 V 3.6785 8.2452 118.5290 65.7978 31.4424 177.9268 123 D 4.2346 8.1116 118.8079 57.2665 40.6746 177.9053 124 E 3.8984 8.6937 120.2092 59.6923 29.4477 178.9151 125 I 3.7736 7.6703 117.7554 64.0444 37.9301 177.8821 126 I 3.6011 7.7862 120.8704 64.1982 37.0065 177.8783 127 N 4.3308 9.0057 118.7641 56.2941 38.6388 176.8167 128 L 4.1922 8.1560 119.5066 56.5102 41.9238 177.4956 129 T 4.3372 7.5297 106.4035 60.3848 69.9704 173.6171 130 D 4.1774 7.2882 119.1097 55.5940 40.0028 174.5048 131 L 4.1614 7.4669 125.7790 52.8254 40.9329 175.3977 132 Q 3.8613 7.7912 117.3543 55.7250 29.1614 176.9774 133 E 3.8716 8.6622 124.8066 56.3804 30.2091 176.3403 134 D 4.6820 9.2865 126.4261 53.5784 42.7469 180.5540 135 L 2.9157 7.4502 116.1425 55.3468 43.2469 175.7147 136 E 4.2826 8.5920 121.3845 56.8935 31.0257 176.6693 137 G 3.8007 9.3757 106.2905 45.6532 0.0000 173.4865 138 N 5.3182 7.4639 114.7108 51.7653 43.5252 174.7989 139 V 4.5038 7.7941 114.1143 58.9053 35.5771 175.7726 140 K 4.4670 8.1972 123.6658 54.3881 31.6557 177.2787 141 Y 4.1969 7.9509 124.0731 60.1267 37.8763 177.3213 142 E 4.1528 7.6069 121.5871 59.2381 29.8615 178.0678 143 E 4.0868 8.0036 118.5536 59.1510 29.5746 179.2880 144 F 4.4352 8.1176 120.7748 61.2582 39.2913 177.3095 145 V 3.4869 7.8399 116.6909 64.7929 31.6866 177.3605 146 K 4.2884 7.9055 117.9930 59.6295 33.1347 178.1990 147 K 3.9949 8.1082 119.6119 58.8290 31.7145 178.9937 148 V 3.6027 7.5830 120.1565 66.8204 31.3195 178.1747 149 M 4.3014 7.7092 116.8261 58.1104 31.5736 177.6415 150 T 4.4140 8.2258 114.2872 62.9005 69.0070 176.1788 151 G 3.9311 7.4958 112.4373 44.3339 0.0000 172.1472 152 P 4.3879 0.0000 0.0000 63.1021 31.7788 175.9201 153 Y 4.6389 7.2478 116.7917 54.5613 38.1126 172.6341 154 P 4.2221 0.0000 0.0000 63.4594 32.4138 176.9150 155 D 4.5687 8.5761 118.5745 53.5434 39.8516 176.1110 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 P 0.00 4.31 0.00 2.02 2.10 0.00 3.68 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 1.88 2.23 0.00 2 K 7.63 4.47 0.00 1.74 1.68 0.00 1.69 0.00 0.00 1.71 0.00 0.00 3.04 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.17 1.59 7.81 3 L 8.36 4.86 0.00 1.74 1.70 1.10 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 4 S 8.54 4.55 0.00 4.07 4.02 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 Q 8.51 4.23 0.00 2.18 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.94 0.00 0.00 0.00 0.00 0.00 2.47 2.50 0.00 6 D 8.22 4.34 0.00 2.76 2.63 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 7 E 8.99 3.97 0.00 2.08 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.51 0.00 8 I 8.09 3.84 1.95 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.98 1.09 0.00 0.00 9 D 8.09 4.60 0.00 2.96 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 10 D 8.25 4.43 0.00 2.97 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 11 L 7.97 3.94 0.00 1.72 2.01 0.71 0.48 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 12 K 8.66 4.29 0.00 2.09 1.67 0.00 1.68 0.00 0.00 1.44 0.00 0.00 2.49 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.03 1.72 7.81 13 E 7.83 4.07 0.00 2.06 2.04 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 2.42 2.44 0.00 14 V 7.75 3.92 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 1.18 0.00 0.00 1.06 0.00 0.00 15 F 8.29 3.92 0.00 2.87 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 16 E 9.68 4.14 0.00 2.41 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 2.32 2.41 0.00 17 L 8.77 3.99 0.00 1.77 2.00 1.16 0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 18 F 9.16 4.15 0.00 3.17 3.08 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 0.00 19 D 7.89 5.35 0.00 2.30 2.55 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 20 F 7.79 4.29 0.00 2.84 2.87 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 21 W 7.37 4.52 0.00 3.42 3.18 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 22 D 7.88 4.69 0.00 2.88 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 23 G 7.68 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 R 7.40 3.90 0.00 1.83 1.82 0.00 3.38 0.00 0.00 3.30 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.69 0.00 25 D 9.45 5.57 0.00 2.90 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 26 G 8.54 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 0.00 0.00 0.00 27 A 8.91 5.09 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 28 V 9.09 4.42 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 0.98 0.00 0.00 -0.26 0.00 0.00 29 D 9.12 4.92 0.00 2.86 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 30 A 9.45 3.57 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.89 4.17 0.00 3.12 3.18 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 32 K 9.33 4.38 0.00 1.80 1.80 0.00 1.95 0.00 0.00 1.91 0.00 0.00 3.28 0.00 0.00 3.22 0.00 0.00 0.00 0.00 1.68 1.83 7.81 33 I 7.79 4.28 1.71 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.48 1.18 0.00 0.00 34 G 7.61 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 0.00 0.00 0.00 35 D 7.75 4.33 0.00 2.60 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 36 V 7.77 3.01 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 1.20 0.00 0.00 0.67 0.00 0.00 37 C 8.06 4.18 0.00 3.17 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 38 R 7.48 4.24 0.00 1.95 2.03 0.00 3.09 0.00 0.00 3.05 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.61 0.00 39 C 7.60 4.40 0.00 3.15 3.14 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 0.00 0.00 0.00 40 L 7.78 4.31 0.00 1.86 1.80 0.30 0.76 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 41 G 7.65 4.16 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 0.00 42 I 7.40 4.49 1.94 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.42 0.92 0.00 0.00 43 N 8.31 4.98 0.00 2.71 2.76 0.00 0.00 7.06 8.02 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 44 P 0.00 4.49 0.00 1.97 1.94 0.00 3.59 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.09 0.00 45 R 8.12 4.56 0.00 1.75 1.96 0.00 3.08 0.00 0.00 3.13 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.57 0.00 46 N 8.13 3.81 0.00 2.83 1.97 0.00 0.00 7.07 7.75 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 47 E 7.27 3.67 0.00 2.00 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 0.00 2.28 2.34 0.00 48 D 7.94 4.33 0.00 2.80 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 49 V 8.09 3.78 2.04 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 0.87 0.00 0.00 0.80 0.00 0.00 50 F 8.30 4.77 0.00 3.07 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 51 A 7.74 4.73 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 52 V 7.21 4.21 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 0.65 0.00 0.00 0.95 0.00 0.00 53 G 9.41 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 54 G 7.71 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 0.00 0.00 0.00 0.00 55 T 8.23 4.48 4.46 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 1.26 0.00 0.00 56 H 8.76 4.30 0.00 3.06 3.37 0.00 5.83 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 57 K 7.67 4.42 0.00 1.58 1.61 0.00 1.73 0.00 0.00 1.67 0.00 0.00 3.16 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.23 1.28 7.81 58 M 7.56 3.81 0.00 1.85 1.50 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.00 0.00 59 G 10.72 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 E 7.52 4.57 0.00 1.94 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 2.15 2.34 0.00 61 K 7.57 4.35 0.00 1.81 1.65 0.00 1.73 0.00 0.00 1.92 0.00 0.00 2.96 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.34 1.33 7.81 62 S 9.05 5.21 0.00 3.97 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 L 8.58 5.04 0.00 2.03 1.83 1.11 1.09 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 64 P 0.00 5.45 0.00 2.22 2.07 0.00 4.00 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.01 0.00 65 F 8.92 3.16 0.00 2.15 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 66 E 8.30 4.08 0.00 2.02 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 2.39 2.56 0.00 67 E 7.98 4.24 0.00 2.18 2.02 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 2.38 2.39 0.00 68 F 8.96 3.85 0.00 3.31 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 69 L 7.37 3.77 0.00 1.14 1.49 0.96 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 70 P 0.00 4.27 0.00 2.27 2.07 0.00 3.78 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 2.22 2.15 0.00 71 A 7.45 3.96 1.13 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 0.00 0.00 0.00 0.00 0.00 72 Y 7.48 4.18 0.00 2.70 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 73 E 8.54 3.99 0.00 2.34 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 0.00 2.27 2.27 0.00 74 G 7.93 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 L 7.59 4.12 0.00 1.54 1.65 0.88 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 76 M 7.50 3.92 0.00 1.77 1.98 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 1.68 0.00 77 D 7.93 4.38 0.00 2.60 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 78 C 7.45 3.44 0.00 3.10 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 79 E 8.54 3.68 0.00 1.88 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.30 0.00 80 Q 8.39 4.37 0.00 2.02 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.77 0.00 0.00 0.00 0.00 0.00 2.29 2.29 0.00 81 G 8.71 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 82 T 6.76 4.53 4.17 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 1.09 0.00 0.00 83 Y 8.66 4.39 0.00 2.99 3.05 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 0.00 0.00 0.00 0.00 84 A 7.90 3.73 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 85 D 7.53 4.23 0.00 2.37 2.29 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 86 Y 8.61 4.31 0.00 3.02 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 87 M 8.70 3.72 0.00 1.88 1.75 0.00 0.00 0.00 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 1.96 0.00 88 E 8.31 3.88 0.00 1.94 2.02 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 2.39 2.46 0.00 89 A 8.27 4.16 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 90 F 7.79 4.43 0.00 2.83 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 K 8.12 4.08 0.00 2.00 1.94 0.00 1.79 0.00 0.00 1.90 0.00 0.00 3.03 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.52 1.65 7.81 92 T 7.77 4.40 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 1.26 0.00 0.00 93 F 8.19 4.67 0.00 2.92 3.32 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 94 D 7.87 5.00 0.00 3.26 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 95 R 8.08 3.98 0.00 1.97 2.10 0.00 3.22 0.00 0.00 3.20 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 2.00 0.00 96 E 8.43 3.93 0.00 2.01 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.23 0.00 97 G 8.71 4.05 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 Q 8.65 4.48 0.00 1.98 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.88 0.00 0.00 0.00 0.00 0.00 2.20 2.52 0.00 99 G 9.68 3.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 F 7.98 5.45 0.00 2.89 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 0.00 101 I 8.34 4.60 2.00 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 1.19 1.02 0.00 0.00 102 S 9.12 4.09 0.00 3.98 3.83 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 0.00 103 G 8.94 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 A 7.91 4.06 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 0.00 105 E 9.37 3.90 0.00 1.98 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 2.46 2.40 0.00 106 L 8.08 3.63 0.00 1.64 1.74 0.86 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 107 R 8.04 3.89 0.00 2.07 2.02 0.00 3.15 0.00 0.00 3.07 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.78 0.00 108 H 8.53 4.20 0.00 3.31 3.60 0.00 5.81 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 0.00 109 V 8.08 3.46 2.26 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 0.96 0.00 0.00 0.51 0.00 0.00 110 L 8.38 4.14 0.00 1.79 1.79 1.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 111 S 7.92 4.62 0.00 3.96 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 0.00 112 G 8.84 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 0.00 0.00 0.00 0.00 113 L 7.59 4.83 0.00 1.74 1.56 1.09 1.20 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 0.00 114 G 8.07 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 E 8.59 4.30 0.00 1.92 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 2.22 2.26 0.00 116 R 7.79 3.85 0.00 1.74 2.08 0.00 3.18 0.00 0.00 3.25 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.67 0.00 117 L 8.32 4.57 0.00 1.80 1.66 0.93 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 118 S 7.99 4.74 0.00 3.88 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 0.00 119 D 9.12 4.43 0.00 2.71 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 E 8.14 3.94 0.00 2.20 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.38 0.00 121 E 8.27 3.90 0.00 2.12 2.02 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 2.32 2.34 0.00 122 V 8.25 3.68 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 1.00 0.00 0.00 123 D 8.11 4.23 0.00 3.01 2.68 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 0.00 0.00 0.00 0.00 124 E 8.69 3.90 0.00 2.14 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 0.00 2.31 2.34 0.00 125 I 7.67 3.77 1.92 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 1.69 1.29 1.09 0.00 0.00 126 I 7.79 3.60 1.98 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.64 0.79 0.00 0.00 127 N 9.01 4.33 0.00 2.84 2.95 0.00 0.00 7.19 5.19 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 0.00 128 L 8.16 4.19 0.00 1.71 1.68 0.91 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 129 T 7.53 4.34 4.32 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 1.29 0.00 0.00 130 D 7.29 4.18 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 0.00 131 L 7.47 4.16 0.00 1.35 1.33 0.85 -0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 132 Q 7.79 3.86 0.00 2.04 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.69 0.00 0.00 0.00 0.00 0.00 2.68 2.29 0.00 133 E 8.66 3.87 0.00 1.93 1.80 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 2.36 2.30 0.00 134 D 9.29 4.68 0.00 2.97 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 L 7.45 2.92 0.00 1.69 1.79 0.94 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 0.00 0.00 0.00 0.00 0.00 0.00 136 E 8.59 4.28 0.00 1.96 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 2.28 2.29 0.00 137 G 9.38 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 0.00 138 N 7.46 5.32 0.00 2.91 2.99 0.00 0.00 6.74 7.68 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 0.00 139 V 7.79 4.50 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 0.86 0.00 0.00 0.80 0.00 0.00 140 K 8.20 4.47 0.00 1.48 1.44 0.00 1.98 0.00 0.00 1.63 0.00 0.00 2.86 0.00 0.00 2.92 0.00 0.00 0.00 0.00 0.82 0.23 7.81 141 Y 7.95 4.20 0.00 2.59 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 0.00 142 E 7.61 4.15 0.00 1.89 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.65 0.00 143 E 8.00 4.09 0.00 2.02 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 2.39 2.37 0.00 144 F 8.12 4.44 0.00 2.87 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 0.00 145 V 7.84 3.49 2.55 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 1.16 0.00 0.00 1.37 0.00 0.00 146 K 7.91 4.29 0.00 1.98 1.92 0.00 1.64 0.00 0.00 1.89 0.00 0.00 2.90 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.77 1.64 7.81 147 K 8.11 3.99 0.00 2.08 1.87 0.00 1.78 0.00 0.00 1.68 0.00 0.00 2.89 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.48 1.64 7.81 148 V 7.58 3.60 1.78 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 0.67 0.00 0.00 0.84 0.00 0.00 149 M 7.71 4.30 0.00 2.21 2.35 0.00 0.00 0.00 0.00 0.00 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.95 2.70 0.00 150 T 8.23 4.41 4.31 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 1.21 0.00 0.00 151 G 7.50 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 P 0.00 4.39 0.00 1.64 1.97 0.00 3.70 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 1.64 1.85 0.00 153 Y 7.25 4.64 0.00 3.04 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 P 0.00 4.22 0.00 2.07 2.04 0.00 3.75 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.11 0.00 155 D 8.58 4.57 0.00 2.69 2.43 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