NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 V 3.9944 8.0549 120.3857 63.2644 32.0501 176.4499 2 H 4.4556 7.7840 117.9325 54.3165 27.7821 172.4521 3 L 4.5140 8.7077 124.1885 53.2326 44.1840 177.4385 4 T 4.0535 8.3898 120.3259 62.7623 69.7751 173.9323 5 P 4.2257 0.0000 0.0000 65.9097 31.4189 178.8803 6 K 4.0297 7.9333 117.7316 59.2421 32.3064 178.6350 7 E 3.9768 7.9459 118.6279 59.0530 29.3065 179.1391 8 K 3.9384 8.1021 118.7175 59.3650 31.8980 179.6420 9 S 4.1182 7.7769 114.4605 61.4853 62.3401 176.5650 10 A 4.0398 7.9164 123.2049 54.6635 17.9751 180.0203 11 V 3.3509 7.5768 117.1620 66.4366 31.7164 178.5021 12 T 3.9927 7.6462 109.2683 64.6968 68.2918 176.2527 13 A 4.0628 7.6782 123.0553 54.7641 18.5304 178.8995 14 L 3.9564 7.7841 117.7659 57.4702 42.0448 178.7361 15 W 4.2372 8.6984 128.8914 59.7081 30.9053 177.7982 16 G 3.7684 8.0256 105.7357 47.1498 0.0000 174.2798 17 K 4.4357 7.5411 117.8447 56.0465 32.7364 176.7355 18 V 3.6655 7.0798 120.4215 62.3595 32.0457 175.5653 19 N 4.4662 8.3735 125.6537 52.8343 37.5720 175.4595 20 V 3.6123 8.0842 119.5362 63.8205 31.9766 177.6507 21 D 4.5183 7.7798 118.2174 56.1678 41.5825 177.7651 22 E 4.3107 8.1247 117.4499 58.2794 30.4627 177.9889 23 V 3.4594 7.3253 118.0687 66.3404 31.5916 178.3974 24 G 3.7327 8.0382 104.6517 47.7110 0.0000 175.6606 25 G 3.6905 8.0040 107.2119 47.1370 0.0000 175.4323 26 E 4.0703 8.0198 120.5551 58.7579 29.6961 178.9591 27 A 3.9201 7.8639 121.0281 55.0992 18.6096 179.5043 28 L 4.0244 7.8882 118.6736 58.0355 42.0234 179.2585 29 G 3.5969 7.8701 105.2377 48.0985 0.0000 175.9669 30 R 3.8872 8.1412 120.9387 58.4775 30.0056 178.8995 31 L 4.0933 7.8160 120.0877 58.2164 41.6497 179.0538 32 L 4.1477 7.8343 119.8160 56.4570 41.2743 179.4366 33 V 3.6445 7.0208 117.7486 65.4997 31.8110 177.9279 34 V 3.5404 7.7890 117.0922 64.2975 32.8312 175.5513 35 Y 3.8275 7.1549 116.3774 53.7526 37.9726 173.7462 36 P 4.4531 0.0000 0.0000 64.4069 31.5948 177.6056 37 W 4.4403 8.2637 115.0877 59.5912 27.7859 177.9830 38 T 4.3879 7.5900 109.9375 64.1934 68.3124 176.3775 39 Q 4.2708 8.4285 121.6227 58.4573 28.5001 177.9386 40 R 4.0944 7.7333 115.9896 57.8768 29.6975 177.6938 41 F 4.2807 7.7403 117.4439 57.4491 40.6153 175.4655 42 F 4.6502 7.4573 115.9497 56.1871 38.9425 175.1142 43 E 4.2369 7.9607 120.7701 58.9588 30.2037 179.0135 44 S 4.4836 8.1198 111.3488 59.9013 63.5342 175.0924 45 F 4.3733 8.4520 119.6149 58.8443 39.8823 175.5519 46 G 3.9535 8.2791 105.0422 43.7931 0.0000 174.2384 47 D 4.4477 8.6773 125.4536 54.7489 40.7774 175.7001 48 L 4.9104 8.2633 126.7672 54.4729 43.2878 178.5675 49 S 4.2443 8.3524 115.2413 61.1015 63.2173 175.0168 50 T 4.6361 7.4417 111.3876 58.6270 72.3997 173.2174 51 P 4.2230 0.0000 0.0000 66.0423 31.3424 178.8045 52 D 4.3722 8.0820 116.9266 57.1455 40.2349 178.4673 53 A 4.0130 7.7539 120.7707 54.7554 18.1251 179.9545 54 V 3.5663 7.3802 116.2543 66.5329 31.7384 177.9804 55 M 4.3122 7.8185 117.0818 57.9021 31.9372 178.1432 56 G 3.9025 8.0060 103.0866 43.9848 0.0000 173.1752 57 N 4.5300 7.4622 120.9097 52.5095 39.7791 173.9371 58 P 4.2406 0.0000 0.0000 65.6778 31.4738 178.9048 59 K 3.7195 7.9882 116.8704 58.9941 31.6956 179.7270 60 V 3.7154 7.7470 118.1844 65.9971 31.6981 178.0777 61 K 3.9376 7.7313 117.8004 59.4986 30.5900 179.2899 62 A 4.0051 8.0373 121.0528 55.3214 18.1704 179.0745 63 H 4.6967 8.4818 116.7739 58.8844 29.9821 177.7263 64 G 3.6372 8.4650 108.3596 47.4113 0.0000 175.6922 65 K 4.0918 8.1277 121.6126 59.0011 31.9103 179.0311 66 K 4.1047 7.5189 119.1835 59.0567 32.1817 179.4277 67 V 3.7209 7.6062 118.7005 65.8763 31.4832 177.9129 68 L 4.5584 8.3077 120.3780 58.0038 41.9758 179.0622 69 G 3.8003 8.1177 105.6701 47.2247 0.0000 175.5153 70 A 4.1625 7.8736 122.9482 54.8128 18.5607 179.6417 71 F 4.2792 8.3804 116.1239 60.6950 38.8166 178.2228 72 S 4.2456 8.4497 114.3457 61.5719 63.0502 176.0690 73 D 4.6128 8.2090 121.5290 57.2314 39.9878 178.9699 74 G 3.7862 7.9752 105.7660 47.4260 0.0000 175.6937 75 L 4.0161 7.5703 119.4299 56.6758 41.6791 178.3124 76 A 4.3437 7.3528 118.4908 52.5446 20.1252 176.6931 77 H 4.9647 7.5212 113.7608 55.0119 29.4264 175.5699 78 L 4.0819 7.9267 119.9654 57.4904 42.0777 178.9225 79 D 4.5415 7.9890 116.8731 54.9304 40.6463 176.0476 80 N 4.9842 7.8360 117.9672 51.2529 38.9209 174.3041 81 L 4.3266 7.7787 121.7612 56.8469 42.1273 178.6900 82 K 4.0304 8.0750 119.7022 59.5009 32.0368 178.9013 83 G 3.5594 8.0444 104.0321 47.5885 0.0000 175.4872 84 T 3.8773 7.3500 116.1612 65.6672 68.6619 175.9554 85 F 4.6245 7.7466 117.2276 57.1059 38.7584 177.4906 86 A 3.9992 7.3553 123.6161 55.8446 18.0360 180.8270 87 T 3.9007 7.7514 113.6133 66.7177 68.6874 176.9370 88 L 4.1746 7.8509 120.0807 57.2784 41.6209 179.1248 89 S 4.3453 8.1403 114.9086 60.4877 61.9288 175.9002 90 E 3.9660 7.8782 120.5160 58.8176 29.1305 178.9849 91 L 3.9496 7.7290 120.3353 58.6873 42.3339 178.8432 92 H 4.3126 8.5078 115.6403 58.2326 28.6419 176.2022 93 C 4.3808 7.6391 118.7534 60.8202 28.8694 175.8113 94 D 4.3683 7.7392 120.2167 56.7290 40.9229 177.9564 95 K 4.2838 7.8422 116.6660 58.3190 33.0713 177.8825 96 L 4.1523 7.9793 117.2388 55.7431 42.1576 176.7947 97 H 4.3811 7.9430 113.1614 55.9042 25.8021 175.0865 98 V 3.7383 7.9868 118.4296 61.7110 32.6464 174.9432 99 D 4.1637 8.4614 127.0995 53.2076 41.7506 175.0131 100 P 3.3730 0.0000 0.0000 65.6573 30.7412 178.1423 101 E 3.9047 7.8188 119.2204 58.9867 29.5932 178.1990 102 N 4.4077 7.9418 116.2973 55.5587 38.4839 177.3938 103 F 4.5829 7.5014 119.6565 60.5903 39.1283 177.6322 104 R 4.0390 8.0430 117.9648 59.2969 29.9377 178.4358 105 L 3.9915 7.6361 119.2237 57.6000 41.5949 179.1759 106 L 4.2349 8.1099 120.1138 57.9465 42.1529 179.2561 107 G 3.7435 8.1555 105.7016 47.8573 0.0000 175.5261 108 N 4.5249 8.2789 118.4999 55.8650 38.5580 177.7070 109 V 3.7310 7.8917 119.9312 65.4868 31.5096 177.9048 110 L 3.8467 8.0082 120.4514 58.0113 42.0112 179.0956 111 V 3.4545 7.6832 117.8776 66.1450 31.5662 177.8025 112 C 4.1816 7.8556 116.0668 62.3220 27.9547 176.0485 113 V 3.6636 7.5617 120.0706 65.5581 31.1940 178.1155 114 L 3.9029 7.9592 118.9590 57.3297 41.4007 179.1846 115 A 3.7918 7.2540 120.3926 54.9400 18.1528 179.1488 116 H 4.1677 7.7203 115.8051 59.4417 29.9650 176.8402 117 H 4.0418 8.0026 117.2888 57.8750 28.8937 176.8900 118 F 4.6062 8.1812 118.0513 56.2266 39.8111 177.2176 119 G 3.9714 8.6097 107.3202 46.3163 0.0000 177.9036 120 K 4.1183 8.9269 123.5007 58.8272 31.9700 177.6438 121 E 4.0778 7.9391 119.2546 58.6126 30.0901 177.1911 122 F 4.6467 8.0012 123.3867 56.7832 38.0867 175.5230 123 T 4.0862 7.3729 115.0024 60.8045 71.1485 173.2399 124 P 4.1730 0.0000 0.0000 65.4115 30.9577 176.9293 125 P 4.3581 0.0000 0.0000 64.9430 31.4434 178.4947 126 V 3.6122 7.0826 119.3088 65.6264 31.3174 177.6823 127 Q 3.5767 7.5236 119.0315 58.9722 29.0658 177.8475 128 A 3.9483 7.9114 121.5933 55.1725 18.1508 179.5944 129 A 3.9615 7.6207 117.9375 55.6036 18.4793 179.5701 130 Y 4.0691 8.0389 114.9933 60.9643 37.7798 178.5326 131 Q 4.1184 8.5517 119.5882 58.6133 28.6501 178.5634 132 K 4.0406 7.7503 118.6632 58.9760 32.0633 179.6939 133 V 3.6280 7.4915 118.7570 66.2363 31.5185 178.7170 134 V 3.9686 8.2754 111.8764 64.0364 31.3202 178.3063 135 A 4.2747 7.9785 121.1264 54.6142 18.2322 179.8515 136 G 3.5502 7.8041 104.6005 47.7568 0.0000 176.3087 137 V 3.0701 7.8624 120.3600 65.4001 31.3763 177.9749 138 A 3.8373 7.6050 120.3283 55.3171 18.0871 179.2185 139 N 4.4093 8.0477 113.6495 56.2639 39.0492 176.4459 140 A 4.2233 7.2499 121.4266 54.3386 18.7613 178.7825 141 L 3.9081 7.7929 118.1532 56.6982 41.8287 177.6984 142 A 5.0752 7.4882 119.9116 52.4402 19.5470 178.1524 143 H 3.8513 8.0579 122.8754 60.1535 30.1617 176.9707 144 K 4.1926 7.7207 115.9570 57.5008 31.6145 176.8435 145 Y 4.6999 7.6628 116.7306 58.2130 38.7578 175.6595 146 H 4.6110 7.9530 122.5176 55.9522 28.8856 174.9235 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 3.99 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 0.99 0.00 0.00 0.93 0.00 0.00 2 H 7.78 4.46 0.00 3.24 3.22 0.00 5.76 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 L 8.71 4.51 0.00 1.57 1.55 nan 0.84 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 4 T 8.39 4.05 4.37 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 1.22 0.00 0.00 5 P 0.00 4.23 0.00 2.13 2.10 0.00 3.56 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.14 0.00 6 K 7.93 4.03 0.00 1.80 1.77 0.00 1.69 0.00 0.00 1.79 0.00 0.00 2.95 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.48 1.51 7.81 7 E 7.95 3.98 0.00 2.18 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 2.33 2.35 0.00 8 K 8.10 3.94 0.00 1.95 1.80 0.00 1.62 0.00 0.00 1.61 0.00 0.00 2.89 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.39 1.57 7.81 9 S 7.78 4.12 0.00 4.03 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 10 A 7.92 4.04 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 11 V 7.58 3.35 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 0.59 0.00 0.00 0.44 0.00 0.00 12 T 7.65 3.99 4.29 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 1.24 0.00 0.00 13 A 7.68 4.06 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 L 7.78 3.96 0.00 1.95 2.06 0.62 -0.26 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 15 W 8.70 4.24 0.00 3.72 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 16 G 8.03 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 17 K 7.54 4.44 0.00 2.07 2.11 0.00 1.75 0.00 0.00 1.66 0.00 0.00 3.14 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.48 1.54 7.81 18 V 7.08 3.67 1.57 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 0.07 0.00 0.00 0.75 0.00 0.00 19 N 8.37 4.47 0.00 2.64 2.57 0.00 0.00 7.22 7.71 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 20 V 8.08 3.61 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 0.66 0.00 0.00 0.89 0.00 0.00 21 D 7.78 4.52 0.00 2.79 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 22 E 8.12 4.31 0.00 1.92 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 0.00 2.28 2.29 0.00 23 V 7.33 3.46 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 0.78 0.00 0.00 0.62 0.00 0.00 24 G 8.04 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 25 G 8.00 3.69 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 0.00 0.00 0.00 26 E 8.02 4.07 0.00 2.20 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 2.29 2.44 0.00 27 A 7.86 3.92 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 L 7.89 4.02 0.00 1.81 1.64 0.77 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 29 G 7.87 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 R 8.14 3.89 0.00 1.88 1.91 0.00 3.06 0.00 0.00 3.00 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.72 0.00 31 L 7.82 4.09 0.00 1.97 1.93 1.06 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 32 L 7.83 4.15 0.00 1.86 1.68 0.77 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 33 V 7.02 3.64 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 0.72 0.00 0.00 0.95 0.00 0.00 34 V 7.79 3.54 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 0.09 0.00 0.00 0.70 0.00 0.00 35 Y 7.15 3.83 0.00 2.49 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 36 P 0.00 4.45 0.00 2.26 2.15 0.00 3.90 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 2.15 2.11 0.00 37 W 8.26 4.44 0.00 3.61 3.52 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 38 T 7.59 4.39 4.42 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 1.12 0.00 0.00 39 Q 8.43 4.27 0.00 2.30 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.88 0.00 0.00 0.00 0.00 0.00 2.44 2.48 0.00 40 R 7.73 4.09 0.00 1.78 2.01 0.00 2.95 0.00 0.00 2.97 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.92 0.00 41 F 7.74 4.28 0.00 2.58 2.50 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 42 F 7.46 4.65 0.00 2.81 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 0.00 0.00 0.00 0.00 43 E 7.96 4.24 0.00 1.97 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 2.31 2.38 0.00 44 S 8.12 4.48 0.00 4.14 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 F 8.45 4.37 0.00 3.24 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 46 G 8.28 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 D 8.68 4.45 0.00 2.67 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 48 L 8.26 4.91 0.00 1.66 1.62 1.04 1.03 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 49 S 8.35 4.24 0.00 4.00 4.01 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 50 T 7.44 4.64 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 1.21 0.00 0.00 51 P 0.00 4.22 0.00 2.15 2.10 0.00 3.58 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 2.08 2.15 0.00 52 D 8.08 4.37 0.00 2.67 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 53 A 7.75 4.01 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 54 V 7.38 3.57 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 0.90 0.00 0.00 1.03 0.00 0.00 55 M 7.82 4.31 0.00 2.04 2.08 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.91 0.00 56 G 8.01 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 N 7.46 4.53 0.00 3.04 2.82 0.00 0.00 7.14 7.59 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 58 P 0.00 4.24 0.00 2.13 2.04 0.00 3.62 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.15 0.00 59 K 7.99 3.72 0.00 1.56 0.74 0.00 1.06 0.00 0.00 1.23 0.00 0.00 2.78 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.24 1.53 7.81 60 V 7.75 3.72 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 1.13 0.00 0.00 1.08 0.00 0.00 61 K 7.73 3.94 0.00 1.96 1.82 0.00 1.69 0.00 0.00 1.63 0.00 0.00 2.92 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.44 1.59 7.81 62 A 8.04 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 63 H 8.48 4.70 0.00 3.51 3.60 0.00 5.78 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 64 G 8.47 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 K 8.13 4.09 0.00 2.02 1.97 0.00 1.63 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.46 1.72 7.81 66 K 7.52 4.10 0.00 2.16 1.89 0.00 1.77 0.00 0.00 1.67 0.00 0.00 2.95 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.54 1.61 7.81 67 V 7.61 3.72 2.35 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 1.28 0.00 0.00 1.04 0.00 0.00 68 L 8.31 4.56 0.00 2.11 1.92 0.97 0.94 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 69 G 8.12 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 70 A 7.87 4.16 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 F 8.38 4.28 0.00 3.66 3.09 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 72 S 8.45 4.25 0.00 4.26 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 0.00 73 D 8.21 4.61 0.00 2.86 2.50 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 74 G 7.98 3.79 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 0.00 0.00 0.00 75 L 7.57 4.02 0.00 1.51 1.51 -0.30 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 76 A 7.35 4.34 1.20 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 0.00 0.00 0.00 0.00 0.00 0.00 77 H 7.52 4.96 0.00 3.18 3.19 0.00 5.82 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 L 7.93 4.08 0.00 1.60 1.72 0.84 1.09 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 79 D 7.99 4.54 0.00 2.78 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 80 N 7.84 4.98 0.00 2.71 2.67 0.00 0.00 7.06 7.56 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 81 L 7.78 4.33 0.00 1.78 1.83 0.97 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 82 K 8.08 4.03 0.00 1.78 1.75 0.00 1.62 0.00 0.00 1.58 0.00 0.00 2.88 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.30 1.25 7.81 83 G 8.04 3.56 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 0.00 0.00 0.00 84 T 7.35 3.88 4.01 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 0.64 0.00 0.00 85 F 7.75 4.62 0.00 3.19 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 86 A 7.36 4.00 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 87 T 7.75 3.90 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 88 L 7.85 4.17 0.00 1.92 1.75 1.00 0.92 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 89 S 8.14 4.35 0.00 4.01 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 E 7.88 3.97 0.00 2.26 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 2.29 2.52 0.00 91 L 7.73 3.95 0.00 1.72 1.86 0.92 1.44 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 92 H 8.51 4.31 0.00 3.37 3.64 0.00 5.84 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 93 C 7.64 4.38 0.00 2.61 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 D 7.74 4.37 0.00 2.78 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 95 K 7.84 4.28 0.00 1.91 1.83 0.00 1.73 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.36 1.41 7.81 96 L 7.98 4.15 0.00 1.66 1.82 0.80 1.02 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 97 H 7.94 4.38 0.00 3.46 3.50 0.00 5.74 0.00 0.00 0.00 0.00 8.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 7.99 3.74 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 0.30 0.00 0.00 0.59 0.00 0.00 99 D 8.46 4.16 0.00 2.71 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 0.00 100 P 0.00 3.37 0.00 2.17 2.19 0.00 3.23 0.00 0.00 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.57 0.00 101 E 7.82 3.90 0.00 1.96 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 2.23 2.33 0.00 102 N 7.94 4.41 0.00 2.69 2.84 0.00 0.00 6.89 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 0.00 103 F 7.50 4.58 0.00 3.14 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 0.00 104 R 8.04 4.04 0.00 1.92 2.10 0.00 3.19 0.00 0.00 3.34 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.76 0.00 105 L 7.64 3.99 0.00 1.73 1.38 0.44 0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 106 L 8.11 4.23 0.00 1.93 1.84 1.02 1.04 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 0.00 107 G 8.16 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 0.00 108 N 8.28 4.52 0.00 3.08 2.96 0.00 0.00 6.64 7.21 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 0.00 109 V 7.89 3.73 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 1.03 0.00 0.00 1.13 0.00 0.00 110 L 8.01 3.85 0.00 1.73 1.66 0.79 -0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 111 V 7.68 3.45 2.32 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 1.26 0.00 0.00 1.13 0.00 0.00 112 C 7.86 4.18 0.00 3.17 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 0.00 113 V 7.56 3.66 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 0.93 0.00 0.00 0.90 0.00 0.00 114 L 7.96 3.90 0.00 0.99 0.90 0.29 1.02 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 0.00 115 A 7.25 3.79 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 0.00 116 H 7.72 4.17 0.00 3.29 3.44 0.00 5.77 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 H 8.00 4.04 0.00 2.94 2.54 0.00 5.69 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 F 8.18 4.61 0.00 3.37 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 0.00 119 G 8.61 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 0.00 120 K 8.93 4.12 0.00 1.81 1.94 0.00 1.78 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.49 1.47 7.81 121 E 7.94 4.08 0.00 2.13 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 2.38 2.33 0.00 122 F 8.00 4.65 0.00 3.08 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 0.00 123 T 7.37 4.09 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 124 P 0.00 4.17 0.00 2.15 2.14 0.00 3.57 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.16 0.00 125 P 0.00 4.36 0.00 2.21 2.26 0.00 3.56 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.98 0.00 126 V 7.08 3.61 1.93 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 1.06 0.00 0.00 0.88 0.00 0.00 127 Q 7.52 3.58 0.00 1.71 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.53 0.00 0.00 0.00 0.00 0.00 2.42 2.57 0.00 128 A 7.91 3.95 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 A 7.62 3.96 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 0.00 130 Y 8.04 4.07 0.00 3.32 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 0.00 131 Q 8.55 4.12 0.00 2.25 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.82 0.00 0.00 0.00 0.00 0.00 2.75 2.60 0.00 132 K 7.75 4.04 0.00 2.08 1.84 0.00 1.63 0.00 0.00 1.66 0.00 0.00 2.88 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.46 1.61 7.81 133 V 7.49 3.63 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 1.06 0.00 0.00 0.83 0.00 0.00 134 V 8.28 3.97 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 1.13 0.00 0.00 135 A 7.98 4.27 1.38 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 0.00 136 G 7.80 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 0.00 137 V 7.86 3.07 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 -0.23 0.00 0.00 0.89 0.00 0.00 138 A 7.61 3.84 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 N 8.05 4.41 0.00 2.85 2.93 0.00 0.00 7.26 7.78 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 0.00 140 A 7.25 4.22 1.38 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 0.00 141 L 7.79 3.91 0.00 1.31 1.00 0.57 -0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 142 A 7.49 5.08 1.65 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 0.00 0.00 143 H 8.06 3.85 0.00 3.28 3.28 0.00 5.67 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 K 7.72 4.19 0.00 1.58 1.60 0.00 1.82 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.42 1.47 7.81 145 Y 7.66 4.70 0.00 3.20 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 146 H 7.95 4.61 0.00 3.15 3.15 0.00 5.70 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