NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.1680 8.1727 122.0482 56.2887 34.1690 174.0611 2 V 4.4950 8.1208 126.4258 60.7756 32.3129 174.6170 3 F 4.4379 9.9016 128.8427 57.4425 40.3217 174.9361 4 E 4.2976 9.0488 120.8859 55.7455 30.8889 177.2377 5 R 3.2973 8.9563 122.4465 60.4713 29.9405 179.6438 6 C 4.3389 8.0390 115.2562 59.6918 40.7678 175.6278 7 E 3.8735 8.1297 120.7750 59.1141 29.3080 178.5100 8 L 3.4703 7.9519 120.1687 57.7703 42.1067 178.5353 9 A 3.9123 7.7209 120.7364 55.5002 18.3389 179.8947 10 R 3.8919 8.1281 116.4271 59.5320 30.0866 179.4661 11 T 3.8128 7.8542 115.4869 66.7357 68.5212 176.6187 12 L 3.8603 8.2712 121.1094 57.5054 41.5554 179.5201 13 K 3.8823 8.0364 119.5390 59.6624 31.9666 178.9037 14 R 3.9507 7.6834 117.4053 59.0845 30.0596 177.5527 15 L 4.3005 7.5938 116.2222 54.3791 41.7357 177.0877 16 G 3.8740 7.7685 107.0472 46.8517 0.0000 175.1256 17 M 3.9055 7.9180 121.6612 56.6913 32.3152 175.8038 18 D 4.5356 8.0295 117.9159 56.0104 41.2670 175.8183 19 G 3.9368 9.4916 115.8799 45.4796 0.0000 171.4659 20 Y 4.1514 8.1376 121.5537 58.6622 38.8896 176.3415 21 R 3.6152 8.9329 126.8770 57.2731 27.8689 177.1211 22 G 3.8177 8.1434 102.6008 45.8478 0.0000 173.9020 23 I 4.1766 7.6213 121.7519 58.9007 38.3874 175.8859 24 S 4.7684 8.3353 120.2332 57.6593 64.0034 174.7521 25 L 4.1988 9.2982 123.8969 58.7551 41.6306 179.4230 26 A 4.1386 7.6687 118.5303 55.2025 18.1621 179.4915 27 N 4.4019 8.1556 115.0094 56.4089 38.6450 177.5975 28 W 4.2546 8.0178 119.7989 60.0159 29.0964 178.2620 29 M 4.1551 8.5709 118.8479 58.6748 31.4772 177.8280 30 C 3.1143 8.2385 118.7951 59.2450 42.5261 175.4053 31 L 3.9407 8.2489 121.6735 58.2870 41.7829 178.7313 32 A 4.1144 8.3262 120.7982 54.9605 18.2623 179.4549 33 K 2.7959 8.1230 118.1022 59.3565 32.0415 179.1571 34 W 4.2953 7.6425 117.3835 59.1936 29.0515 178.4869 35 E 4.3103 8.4614 118.8696 58.7048 29.2755 177.8468 36 S 4.5273 7.7742 109.5703 56.7635 64.3163 174.3710 37 G 3.5408 8.4589 108.3378 46.9545 0.0000 173.4670 38 Y 3.6500 7.5841 113.5665 58.6908 34.9037 168.6100 39 N 5.3101 7.7503 119.3498 52.0564 40.1923 175.6359 40 T 4.1712 8.9308 117.0762 63.6458 69.2603 175.9227 41 R 4.4703 8.0226 117.1201 55.6504 30.1349 176.2491 42 A 4.3469 7.6065 121.5778 52.7166 19.4388 177.0154 43 T 4.9645 8.3105 110.8272 60.0362 72.3412 172.9272 44 N 4.8832 8.8465 122.4201 52.0306 42.1689 172.4516 45 Y 4.5478 8.7114 128.1298 57.4940 40.6652 173.9522 46 N 4.7847 8.5229 124.6475 51.1981 38.6875 175.2887 47 A 3.7398 8.3459 127.6854 54.8533 18.8962 179.1184 48 G 3.7868 8.0743 104.1226 48.2268 0.0000 173.7700 49 D 4.6687 7.3131 114.3514 51.8687 40.5518 175.6184 50 R 4.0116 8.3391 116.5672 56.9749 28.2493 175.9530 51 S 4.8762 8.0837 113.3896 57.3783 66.0096 172.8142 52 T 5.0625 8.7142 115.7373 61.9260 72.6436 172.8715 53 D 5.4062 8.9882 125.4310 53.2658 43.0985 175.1172 54 Y 5.0433 8.9167 120.7026 57.4275 41.8213 177.4265 55 G 4.4774 9.0297 111.7367 46.0066 0.0000 173.4714 56 I 3.8765 8.2953 116.9569 62.9954 37.8966 177.5735 57 F 4.6227 7.8996 115.4836 56.4923 39.9102 175.1272 58 Q 3.5629 7.9127 119.3117 57.0761 26.6764 174.3347 59 I 4.3474 8.1136 118.8239 61.2979 39.0906 176.8627 60 N 5.4193 9.2303 126.1965 53.3011 39.8050 175.7957 61 S 4.5108 9.2891 120.8062 60.8374 63.5168 175.6171 62 R 3.7370 8.6012 121.9587 58.7231 30.0811 177.4155 63 Y 4.2855 7.3376 113.0958 57.5981 40.5256 177.2612 64 W 4.8766 7.9958 119.0869 57.6954 30.1292 173.4799 65 C 5.5404 7.8992 110.2074 53.7087 44.5726 172.1585 66 N 4.9438 9.0740 119.3841 52.0143 39.8253 174.5853 67 D 4.8220 8.3915 122.5301 51.9875 40.6600 178.2942 68 G 4.0232 8.2808 110.1654 46.5978 0.0000 174.9386 69 K 4.3171 8.1668 116.3481 57.1421 33.3347 176.6401 70 T 4.3144 7.4293 116.7282 61.9469 69.2365 172.8128 71 P 4.2515 0.0000 0.0000 63.4035 31.6973 175.8138 72 G 3.9192 7.5971 110.8600 42.4619 0.0000 173.2379 73 A 4.3617 7.9278 118.3088 52.9906 20.1165 179.2901 74 V 2.6095 7.9149 119.0634 61.7874 34.0314 176.1461 74A R 4.5038 8.7197 116.1734 54.8116 32.5149 175.4768 74B G 3.8399 7.9333 110.6593 45.9276 0.0000 170.1908 74C D 4.6657 8.0534 119.8085 52.9476 41.9326 177.7776 74D S 4.6344 8.4659 119.5766 57.6983 64.5495 173.4839 75 N 4.9468 8.1153 119.4676 52.0416 38.7823 174.8746 76 A 4.3673 8.3893 123.0191 54.9902 18.9656 178.5397 77 C 4.4603 8.5047 110.6202 57.3418 40.9020 173.0121 78 H 4.0935 8.1662 116.4229 56.6011 26.3059 174.3146 79 L 4.8184 8.3448 117.3631 52.8926 46.4044 176.5380 80 S 4.6564 8.3749 115.3671 58.0388 63.3191 176.0350 81 C 4.0668 8.8124 124.5650 59.8028 40.8261 176.3277 82 S 3.9456 7.8000 114.3785 61.4208 61.6290 176.0209 83 A 4.0548 7.7503 122.3851 54.6164 18.1750 177.9868 84 L 4.4370 7.8227 115.9833 55.1548 41.7962 177.6509 85 L 5.0517 7.8394 117.3501 54.5038 42.4044 176.7209 86 Q 4.3584 7.8377 117.8447 55.4029 29.4995 175.9749 87 D 4.4136 8.5040 119.5423 57.0815 41.1358 176.8577 88 N 4.5698 8.0481 118.2459 53.2596 39.3072 174.6008 89 I 4.2981 8.4462 118.7872 61.0098 38.0423 177.0251 90 A 3.9451 8.3278 125.0070 56.0127 18.2175 180.2448 91 D 4.2819 8.0673 116.4559 57.4656 40.9328 178.7105 92 A 4.1240 7.9882 120.8681 55.0296 18.4121 179.7408 93 V 3.3771 8.1832 116.8755 66.1374 31.5390 178.1918 94 A 3.8290 8.0348 120.5253 55.1238 18.0608 178.8479 95 C 4.2085 8.1990 116.7877 59.6931 38.0294 175.6022 96 A 3.8399 8.2026 122.7345 55.0397 17.5620 179.7916 97 K 3.7119 7.5977 116.3728 59.3483 32.3060 179.2611 98 R 4.0674 7.6296 118.8873 59.2551 30.1548 178.5150 99 V 2.2827 7.5431 118.1802 65.8600 31.2701 178.2066 100 V 3.8363 7.6579 109.9934 63.1472 31.2303 178.3410 101 R 4.0642 7.7205 117.5162 57.6720 30.3124 176.7002 102 D 4.6991 7.4064 118.5217 52.8991 41.7425 175.3144 103 P 4.1946 0.0000 0.0000 66.1451 31.6587 178.2334 104 Q 4.0198 8.1611 116.2860 56.5882 29.9777 177.3566 105 G 3.7521 8.1821 107.9305 46.8493 0.0000 175.8241 106 I 3.5761 7.8120 119.4746 63.5531 37.9447 178.0847 107 R 4.1840 7.4132 117.8074 58.0308 29.9917 177.4601 108 A 3.8919 7.5774 120.9056 54.0445 18.4730 177.6183 109 W 4.8389 8.0575 116.5073 55.0911 30.5616 177.7542 110 V 3.7591 8.7241 124.0655 64.8573 30.8612 178.1587 111 A 4.0055 8.3008 120.9760 54.7031 18.0959 179.2233 112 W 4.0243 8.2569 126.7480 60.7058 30.5979 178.4606 113 R 3.7112 8.1843 116.2623 59.3032 29.6728 178.4091 114 N 4.3551 8.0895 115.0476 55.6746 38.7100 176.8651 115 R 4.1104 7.9180 116.1387 55.9100 31.5007 176.0593 116 C 4.5641 7.1561 114.6661 57.6638 42.8708 174.2625 117 Q 3.1289 6.6311 120.2982 57.0191 28.6899 175.4348 118 N 4.2022 8.6408 120.7470 54.3287 36.0416 173.8307 119 R 4.4983 7.2580 115.8510 54.0512 33.0835 175.6748 120 D 4.5603 8.4531 118.9378 54.1199 40.4867 175.7540 121 V 4.6085 8.1737 118.9483 61.3653 32.3224 178.4757 122 R 4.0766 8.0840 122.7954 59.1567 29.7003 178.5952 123 Q 3.9384 8.1713 117.2554 59.8537 27.9817 178.6443 124 Y 4.3228 7.7063 116.7311 59.7569 38.2492 177.1060 125 V 4.3952 7.8531 111.2556 60.4674 33.1411 175.5045 126 Q 4.1630 7.6471 118.2526 57.4419 28.6033 176.6203 127 G 3.9138 8.7665 109.0956 46.8066 0.0000 174.6961 128 C 4.4565 8.1877 115.6850 56.2878 40.6296 174.5589 129 G 3.8818 8.1441 107.2877 46.3248 0.0000 174.1626 130 V 3.9788 7.7839 118.0442 61.0952 31.8786 175.8727 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 K 8.17 4.17 0.00 1.82 1.70 0.00 1.30 0.00 0.00 1.52 0.00 0.00 2.17 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.75 1.04 7.81 2 V 8.12 4.49 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 0.90 0.00 0.00 0.94 0.00 0.00 3 F 9.90 4.44 0.00 2.88 2.84 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 0.00 0.00 0.00 0.00 4 E 9.05 4.30 0.00 1.91 1.85 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 2.29 2.39 0.00 5 R 8.96 3.30 0.00 1.92 1.94 0.00 3.46 0.00 0.00 3.47 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.77 0.00 6 C 8.04 4.34 0.00 3.00 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 7 E 8.13 3.87 0.00 2.07 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 0.00 2.61 2.43 0.00 8 L 7.95 3.47 0.00 1.30 1.34 -0.24 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 9 A 7.72 3.91 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 10 R 8.13 3.89 0.00 1.86 1.99 0.00 3.14 0.00 0.00 3.29 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.80 0.00 11 T 7.85 3.81 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 1.20 0.00 0.00 12 L 8.27 3.86 0.00 1.69 1.60 0.94 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 13 K 8.04 3.88 0.00 1.84 1.95 0.00 1.66 0.00 0.00 1.59 0.00 0.00 2.92 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.44 1.46 7.81 14 R 7.68 3.95 0.00 2.04 2.04 0.00 3.31 0.00 0.00 3.22 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.66 0.00 15 L 7.59 4.30 0.00 1.69 1.56 0.85 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 16 G 7.77 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 17 M 7.92 3.91 0.00 1.24 1.95 0.00 0.00 0.00 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.25 0.00 18 D 8.03 4.54 0.00 2.68 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 19 G 9.49 3.94 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 0.00 0.00 0.00 20 Y 8.14 4.15 0.00 3.36 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 21 R 8.93 3.62 0.00 1.93 1.86 0.00 3.26 0.00 0.00 3.04 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 1.49 0.00 22 G 8.14 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.62 4.18 1.77 0.00 0.00 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.81 -0.32 0.00 0.00 24 S 8.34 4.77 0.00 4.07 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 25 L 9.30 4.20 0.00 2.01 1.82 0.99 1.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 26 A 7.67 4.14 1.52 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 0.00 0.00 27 N 8.16 4.40 0.00 2.80 2.80 0.00 0.00 6.95 7.70 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 28 W 8.02 4.25 0.00 3.57 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 29 M 8.57 4.16 0.00 2.17 2.38 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.96 0.00 30 C 8.24 3.11 0.00 2.63 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 31 L 8.25 3.94 0.00 1.85 1.86 0.57 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 32 A 8.33 4.11 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 33 K 8.12 2.80 0.00 1.63 1.35 0.00 0.67 0.00 0.00 0.61 0.00 0.00 2.22 0.00 0.00 2.55 0.00 0.00 0.00 0.00 0.51 1.33 7.81 34 W 7.64 4.30 0.00 3.33 3.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 E 8.46 4.31 0.00 1.98 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 2.52 2.33 0.00 36 S 7.77 4.53 0.00 4.04 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 37 G 8.46 3.54 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 0.00 38 Y 7.58 3.65 0.00 3.22 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 39 N 7.75 5.31 0.00 2.69 2.77 0.00 0.00 7.02 7.15 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 40 T 8.93 4.17 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 1.44 0.00 0.00 41 R 8.02 4.47 0.00 1.99 2.09 0.00 3.08 0.00 0.00 3.24 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.58 0.00 42 A 7.61 4.35 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 43 T 8.31 4.96 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 1.29 0.00 0.00 44 N 8.85 4.88 0.00 2.84 2.80 0.00 0.00 6.69 6.89 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 45 Y 8.71 4.55 0.00 3.09 2.86 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 46 N 8.52 4.78 0.00 2.65 2.61 0.00 0.00 6.62 7.12 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 47 A 8.35 3.74 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 48 G 8.07 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 49 D 7.31 4.67 0.00 2.70 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 50 R 8.34 4.01 0.00 2.02 2.20 0.00 3.14 0.00 0.00 3.19 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.55 0.00 51 S 8.08 4.88 0.00 3.98 3.94 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 52 T 8.71 5.06 4.20 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 0.56 0.00 0.00 53 D 8.99 5.41 0.00 2.75 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 54 Y 8.92 5.04 0.00 3.05 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 55 G 9.03 4.48 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 0.00 56 I 8.30 3.88 1.70 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 1.82 0.14 0.00 0.00 57 F 7.90 4.62 0.00 3.24 2.98 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 58 Q 7.91 3.56 0.00 2.50 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.94 6.83 0.00 0.00 0.00 0.00 0.00 2.52 2.71 0.00 59 I 8.11 4.35 2.15 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.04 1.15 0.00 0.00 60 N 9.23 5.42 0.00 3.11 3.07 0.00 0.00 6.97 7.35 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 61 S 9.29 4.51 0.00 4.04 4.39 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 62 R 8.60 3.74 0.00 1.51 1.07 0.00 2.76 0.00 0.00 2.91 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.97 0.00 63 Y 7.34 4.29 0.00 1.43 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 0.00 0.00 0.00 64 W 8.00 4.88 0.00 3.68 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 65 C 7.90 5.54 0.00 3.17 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 66 N 9.07 4.94 0.00 2.76 2.69 0.00 0.00 7.12 8.16 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 67 D 8.39 4.82 0.00 2.89 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 68 G 8.28 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 0.00 0.00 0.00 69 K 8.17 4.32 0.00 1.90 1.96 0.00 1.63 0.00 0.00 1.73 0.00 0.00 3.24 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.60 1.50 7.81 70 T 7.43 4.31 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 1.15 0.00 0.00 71 P 0.00 4.25 0.00 2.02 1.99 0.00 3.69 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.09 0.00 72 G 7.60 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 A 7.93 4.36 1.08 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 74 V 7.91 2.61 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 0.82 0.00 0.00 0.92 0.00 0.00 74A R 8.72 4.50 0.00 1.87 1.83 0.00 3.31 0.00 0.00 3.22 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.54 0.00 74B G 7.93 3.84 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74C D 8.05 4.67 0.00 2.64 2.45 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 0.00 74D S 8.47 4.63 0.00 3.90 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 75 N 8.12 4.95 0.00 2.78 2.68 0.00 0.00 6.97 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 76 A 8.39 4.37 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 77 C 8.50 4.46 0.00 3.26 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 78 H 8.17 4.09 0.00 3.34 3.39 0.00 5.63 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 79 L 8.34 4.82 0.00 1.66 1.49 0.96 0.84 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 80 S 8.37 4.66 0.00 3.83 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 81 C 8.81 4.07 0.00 2.28 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 82 S 7.80 3.95 0.00 3.89 3.84 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 0.00 0.00 0.00 0.00 83 A 7.75 4.05 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 L 7.82 4.44 0.00 1.94 1.82 1.06 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 85 L 7.84 5.05 0.00 1.79 1.72 1.14 0.97 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 86 Q 7.84 4.36 0.00 2.24 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.62 7.10 0.00 0.00 0.00 0.00 0.00 2.38 2.54 0.00 87 D 8.50 4.41 0.00 2.62 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 88 N 8.05 4.57 0.00 2.70 2.75 0.00 0.00 6.94 7.94 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 89 I 8.45 4.30 1.81 0.00 0.00 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.61 1.02 0.00 0.00 90 A 8.33 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 91 D 8.07 4.28 0.00 2.72 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 92 A 7.99 4.12 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 93 V 8.18 3.38 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 0.71 0.00 0.00 0.95 0.00 0.00 94 A 8.03 3.83 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 95 C 8.20 4.21 0.00 3.09 3.27 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 96 A 8.20 3.84 0.70 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 0.00 0.00 97 K 7.60 3.71 0.00 1.56 1.29 0.00 1.27 0.00 0.00 0.88 0.00 0.00 2.31 0.00 0.00 2.47 0.00 0.00 0.00 0.00 0.30 0.84 7.81 98 R 7.63 4.07 0.00 1.93 2.13 0.00 3.28 0.00 0.00 3.20 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.94 0.00 99 V 7.54 2.28 1.79 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 -0.29 0.00 0.00 -0.42 0.00 0.00 100 V 7.66 3.84 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 0.99 0.00 0.00 1.44 0.00 0.00 101 R 7.72 4.06 0.00 2.09 2.06 0.00 3.23 0.00 0.00 3.37 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 2.12 0.00 102 D 7.41 4.70 0.00 3.09 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 0.00 103 P 0.00 4.19 0.00 2.01 2.13 0.00 3.68 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 2.02 2.13 0.00 104 Q 8.16 4.02 0.00 2.03 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.92 0.00 0.00 0.00 0.00 0.00 2.41 2.31 0.00 105 G 8.18 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 0.00 106 I 7.81 3.58 1.08 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.05 -0.41 0.00 0.00 107 R 7.41 4.18 0.00 2.04 2.03 0.00 3.22 0.00 0.00 3.27 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.53 0.00 108 A 7.58 3.89 0.78 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 0.00 0.00 109 W 8.06 4.84 0.00 3.53 3.20 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 0.00 110 V 8.72 3.76 2.16 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 0.95 0.00 0.00 0.97 0.00 0.00 111 A 8.30 4.01 1.52 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 0.00 0.00 112 W 8.26 4.02 0.00 3.39 3.47 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 0.00 113 R 8.18 3.71 0.00 2.01 2.00 0.00 3.35 0.00 0.00 3.37 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.15 0.00 114 N 8.09 4.36 0.00 2.66 2.69 0.00 0.00 6.95 7.27 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 0.00 115 R 7.92 4.11 0.00 1.00 0.66 0.00 2.21 0.00 0.00 2.34 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 1.14 0.00 116 C 7.16 4.56 0.00 1.76 2.71 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 0.00 117 Q 6.63 3.13 0.00 0.93 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.52 6.72 0.00 0.00 0.00 0.00 0.00 2.16 2.19 0.00 118 N 8.64 4.20 0.00 2.80 2.83 0.00 0.00 6.88 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 0.00 119 R 7.26 4.50 0.00 1.72 1.81 0.00 3.25 0.00 0.00 3.05 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.73 0.00 120 D 8.45 4.56 0.00 2.62 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 0.00 121 V 8.17 4.61 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 1.00 0.00 0.00 1.05 0.00 0.00 122 R 8.08 4.08 0.00 1.83 2.01 0.00 3.17 0.00 0.00 3.25 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.77 0.00 123 Q 8.17 3.94 0.00 2.02 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.90 0.00 0.00 0.00 0.00 0.00 2.14 1.47 0.00 124 Y 7.71 4.32 0.00 3.14 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 0.00 125 V 7.85 4.40 2.14 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 0.99 0.00 0.00 1.05 0.00 0.00 126 Q 7.65 4.16 0.00 2.22 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.53 0.00 0.00 0.00 0.00 0.00 2.34 2.31 0.00 127 G 8.77 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 C 8.19 4.46 0.00 3.01 3.13 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 0.00 129 G 8.14 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 0.00 130 V 7.78 3.98 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 0.74 0.00 0.00 0.96 0.00 0.00