NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.3637 8.2493 123.5835 52.4975 20.0414 176.2079 2 T 4.5493 8.3154 108.7105 60.9421 71.4887 172.1507 3 K 5.2937 8.4381 123.3098 54.7084 36.5715 176.0876 4 A 5.2947 8.9162 124.0765 50.9816 23.4094 175.0437 5 V 4.9921 8.6142 116.9974 61.1493 35.3833 172.9509 6 C 4.9026 9.0597 121.8497 58.1180 35.1761 172.6059 7 V 4.5447 8.4876 126.1742 61.5852 33.0346 174.1638 8 L 4.7876 9.0377 129.1366 53.6673 43.3965 175.8299 9 K 4.7805 9.1368 123.8455 55.5461 36.0466 175.2926 10 G 4.8455 8.0495 110.2764 45.7869 0.0000 172.5314 11 D 4.7066 8.9717 118.7647 54.8858 41.6046 176.7803 12 G 4.4382 7.1270 109.6700 43.8736 0.0000 171.4492 13 P 4.3383 0.0000 0.0000 64.5686 31.9727 176.7235 14 V 4.2907 7.8580 120.0664 62.7419 31.8203 175.0308 15 Q 4.7885 8.3606 124.4568 55.5608 32.2834 173.5101 16 G 4.1735 8.2549 106.4721 46.2076 0.0000 171.7739 17 I 5.1739 8.0887 119.2102 59.4775 41.0330 175.0428 18 I 4.6659 8.8244 127.7038 59.4841 40.2265 174.4985 19 N 5.1047 8.5368 124.4117 51.4833 41.2585 173.9317 20 F 5.4373 8.9510 119.4210 55.9238 43.4021 173.7812 21 E 5.3398 9.5608 122.2651 54.9408 33.5270 173.7069 22 Q 4.8443 9.3973 127.6234 54.5829 30.9363 175.0003 23 K 4.2034 9.0472 126.8779 57.9514 32.8825 177.0579 24 E 4.7344 7.8707 119.1741 53.6750 32.0644 176.4931 25 S 4.1291 8.9372 120.5418 60.7041 62.9762 174.6379 26 N 4.7290 8.0236 115.2861 52.3446 38.1278 174.7757 27 G 3.9367 7.8981 109.2631 44.0517 0.0000 171.3392 28 P 4.6367 0.0000 0.0000 62.7324 32.5271 175.9052 29 V 4.6030 9.0434 122.1652 61.2149 33.7118 174.4551 30 K 4.7883 9.2423 130.5835 56.0286 33.5222 175.3571 31 V 4.8831 9.2475 128.3909 60.8752 33.8584 174.3006 32 W 5.8316 7.6581 123.5104 55.8267 31.9179 174.9595 33 G 3.6479 7.6915 106.3101 45.8670 0.0000 171.0695 34 S 5.0558 7.8884 114.8279 57.0915 66.6760 174.5003 35 I 5.0699 8.9270 126.4887 59.3778 41.0604 174.7851 36 K 4.7504 9.0734 125.6544 55.2817 36.1446 176.5844 37 G 3.8742 8.6344 105.1299 46.1134 0.0000 172.7411 38 L 4.5459 7.7670 121.9275 52.5230 43.4898 176.0815 39 T 4.2317 8.4009 116.4201 61.2172 68.9900 173.8311 40 E 4.0827 8.7095 122.8097 57.6252 30.4068 175.1493 41 G 4.1215 8.4892 106.7922 44.0262 0.0000 172.2002 42 L 4.8296 8.2303 119.2054 54.6479 42.8694 176.4758 43 H 5.0831 9.1821 119.5999 53.6175 32.9509 173.3559 44 G 4.0429 9.0224 110.5601 46.8540 0.0000 172.6668 45 F 5.3352 8.8002 125.1676 57.1092 42.1872 172.7854 46 H 5.0921 8.7360 122.7028 53.8597 33.7216 173.0130 47 V 4.3459 8.6277 122.1783 62.8494 32.3595 175.2505 48 H 5.0769 9.5365 125.8445 54.6796 30.4450 176.0991 49 E 3.6987 9.1124 122.1904 58.9290 29.5037 177.0721 50 F 4.9751 7.9591 118.0929 54.8162 41.6253 176.9309 51 G 4.1830 8.4287 112.1860 44.8548 0.0000 173.8407 52 D 4.8097 8.0322 118.4406 52.6426 42.8055 174.5533 53 N 5.6034 8.7543 122.8105 52.2961 39.5793 176.5997 54 T 3.8194 8.5449 111.9141 64.1451 68.6507 174.7236 55 A 4.6516 8.3480 124.7093 51.4429 20.3333 177.9384 56 G 3.8734 8.0481 110.8617 47.3174 0.0000 175.2065 57 C 4.1678 8.5663 115.0180 63.1020 27.9355 175.8315 58 T 3.9321 7.9277 117.1302 66.7384 67.8562 176.2150 59 S 4.3066 8.0175 114.6745 60.4764 63.2243 175.6865 60 A 4.4634 7.5330 125.1981 54.1479 18.3062 178.5458 61 G 4.0810 8.1416 105.5584 44.9251 0.0000 170.7949 62 P 4.7215 0.0000 0.0000 61.4766 34.1654 175.1612 63 H 4.3664 8.4157 116.5824 56.0138 29.3425 175.1556 64 F 4.1855 9.0765 125.5426 58.5523 40.2209 175.0899 65 N 5.0935 7.9543 125.7426 51.5033 38.9557 172.8091 66 P 4.0899 0.0000 0.0000 65.5234 31.9543 177.9727 67 L 4.2290 7.6523 115.4642 54.2928 41.6848 177.1181 68 S 4.0295 7.8043 113.4258 59.5269 60.8347 172.7174 69 R 4.3306 7.3510 119.8304 55.4999 31.4761 175.8383 70 K 4.5937 8.4439 117.6097 55.3522 34.2643 176.2139 71 H 4.0530 8.8931 122.9371 56.8713 30.8824 174.8614 72 G 4.3759 8.5552 111.1046 45.6912 0.0000 172.1937 73 G 4.2018 8.7277 108.8228 43.1108 0.0000 173.0462 74 P 4.3738 0.0000 0.0000 65.5209 31.3226 178.3043 75 K 4.1953 7.8827 115.3375 58.1383 32.5155 177.1611 76 D 4.5662 7.6826 118.5397 53.9705 41.3789 176.1438 77 E 3.9759 8.6467 122.5865 58.8507 29.8855 176.6343 78 E 4.2976 7.8826 120.6222 54.9408 28.3629 174.8946 79 R 4.9700 7.6040 118.9716 54.3396 32.7053 175.2412 80 H 4.3463 8.6185 116.5620 55.7582 29.4525 176.4981 81 V 3.4573 8.3607 123.0697 66.1729 31.6728 176.9024 82 G 3.9754 8.4658 105.4698 46.7874 0.0000 173.4544 83 D 5.0229 8.1580 121.4732 53.2790 40.4032 175.7179 84 L 4.5831 8.3062 123.0109 53.2914 42.6830 178.7476 85 G 3.9233 8.4483 108.6792 46.9466 0.0000 173.8738 86 N 5.7008 8.7392 120.8542 51.4156 41.6260 173.8272 87 V 4.3950 8.6083 114.9483 59.8811 34.9889 174.8022 88 T 4.9846 8.2322 118.7763 61.8509 71.2697 172.9725 89 A 4.7244 9.0475 129.7007 50.8890 20.8674 177.1338 90 D 4.7213 8.7918 122.6276 51.7024 41.4900 177.2447 91 K 4.1761 8.4312 116.6881 59.0686 32.2993 177.1236 92 D 4.5648 8.9441 119.3698 53.8259 40.9805 177.1322 93 A 4.4837 8.3323 120.9985 53.0572 16.8670 177.2537 94 V 4.7648 7.4654 118.7371 62.1274 33.8269 174.5726 95 A 5.1191 8.9809 130.0636 49.3880 20.8323 174.8646 96 D 4.8410 8.6243 122.1663 54.7465 42.1672 176.3339 97 V 4.2197 8.8138 124.1237 61.1903 33.8643 174.7545 98 S 4.7037 8.4333 122.5929 57.5275 64.5551 172.8795 99 I 4.8135 9.3181 128.3349 59.4722 41.6443 174.0345 100 E 5.1557 8.8720 126.0041 54.5035 32.0487 174.4564 101 D 4.9102 9.2720 125.8077 52.5003 45.0801 175.4311 102 S 4.8718 8.7960 118.2077 58.2112 63.7469 174.8013 103 V 3.9944 8.3924 122.1137 65.3378 31.7766 176.9018 104 I 4.0255 7.8251 111.2318 61.0665 38.2249 174.5704 105 S 4.7526 8.5142 115.3341 57.2234 65.6021 173.8573 106 L 4.4636 8.6373 122.1409 53.7401 41.6631 176.8015 107 S 4.5172 7.6533 110.1174 59.0694 66.0833 177.7903 108 G 3.8412 8.0581 108.0576 44.6454 0.0000 173.4572 109 D 4.5163 8.5472 117.1355 56.9250 41.0759 176.8089 110 H 4.9616 8.1276 114.7343 55.2769 29.3299 174.0074 111 C 4.2953 7.8652 121.1555 59.9230 31.8227 173.3709 112 I 3.9818 8.1853 118.5063 60.1868 38.2140 175.6309 113 I 3.7622 7.4006 122.6046 63.1916 37.4976 176.2725 114 G 3.8067 9.5288 112.7877 45.6016 0.0000 173.0044 115 R 4.9839 7.5235 119.3973 54.6835 33.8560 174.3389 116 T 5.0094 7.8975 115.7171 62.1132 71.2600 173.6478 117 L 4.6523 8.7155 129.4626 54.3218 43.8051 175.4480 118 V 4.9904 8.8920 126.4214 60.9727 34.8464 174.1619 119 V 4.9978 8.6747 127.3958 60.5899 33.4735 174.9234 120 H 5.2861 8.9440 121.8899 54.1266 30.4287 174.8211 121 E 4.2239 9.4194 122.0907 58.7740 30.1401 176.7372 122 K 4.8280 8.5418 117.1837 53.6220 36.6142 175.7461 123 A 4.4846 8.4816 122.6268 52.7044 19.5727 175.9862 124 D 4.9400 9.7433 122.1527 53.1533 41.7287 176.0423 125 D 4.6077 9.3934 125.1960 53.0790 39.8444 176.8428 126 L 3.4793 10.1490 119.9021 55.8482 39.8392 174.5851 127 G 4.4318 8.6919 103.3172 46.4445 0.0000 175.5045 128 K 4.6056 8.1549 112.9002 56.1053 34.9530 179.0277 129 G 3.7743 7.8598 108.9829 46.1520 0.0000 174.3528 130 G 3.7476 9.0870 108.3088 45.7319 0.0000 172.4414 131 N 4.7063 7.5239 114.9846 50.6654 40.2298 174.3019 132 E 4.0456 8.7432 117.6346 59.3176 29.6327 177.6704 133 E 3.8823 8.2539 119.0135 59.7683 29.6105 178.7306 134 S 4.2315 8.9625 113.2639 61.3765 62.3081 175.4928 135 T 4.2682 7.9991 110.8427 62.6240 68.5796 175.6414 136 K 4.3087 7.7408 119.5991 57.7231 34.2811 176.6953 137 T 4.0758 7.9974 106.3840 60.2094 69.7663 175.0909 138 G 4.0080 8.4115 109.8419 45.7775 0.0000 173.8210 139 N 4.2710 7.9142 114.8538 54.0381 36.7157 175.7844 140 A 4.4350 7.2268 120.2630 52.0784 19.1552 180.1254 141 G 3.8745 7.4255 103.9388 44.9387 0.0000 173.4348 142 S 4.4738 8.3691 114.9921 58.5349 64.8690 173.7095 143 R 4.6217 8.3396 119.4297 55.0865 30.4543 176.6076 144 L 4.3712 9.0230 125.2452 57.2299 43.1802 176.8302 145 A 5.0357 7.7330 117.6348 51.4754 22.7592 174.8951 146 C 5.5789 8.1780 113.8801 58.4384 33.8201 172.6210 147 G 4.3565 8.0391 102.7641 46.1696 0.0000 172.7628 148 V 4.3978 8.3438 121.6476 62.1841 32.6978 175.5409 149 I 4.0903 8.8603 129.8139 61.0141 38.0621 175.2797 150 G 4.4784 8.9238 114.3552 43.8138 0.0000 172.0879 151 I 4.2821 8.3936 121.9469 61.2837 37.6582 175.3396 152 A 4.8310 8.4107 127.2509 49.6546 22.3503 176.0593 153 Q 4.0668 8.5462 118.7499 56.4376 29.2135 176.0081 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 A 8.25 4.36 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 2 T 8.32 4.55 4.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 3 K 8.44 5.29 0.00 1.85 1.76 0.00 1.86 0.00 0.00 1.93 0.00 0.00 3.26 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.55 1.49 7.81 4 A 8.92 5.29 1.07 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 0.00 0.00 5 V 8.61 4.99 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 0.75 0.00 0.00 0.94 0.00 0.00 6 C 9.06 4.90 0.00 3.13 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 7 V 8.49 4.54 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 0.93 0.00 0.00 0.92 0.00 0.00 8 L 9.04 4.79 0.00 1.69 1.58 1.04 0.36 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 9 K 9.14 4.78 0.00 1.77 1.57 0.00 1.62 0.00 0.00 1.64 0.00 0.00 2.81 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.33 1.39 7.81 10 G 8.05 4.85 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 11 D 8.97 4.71 0.00 2.68 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 12 G 7.13 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 0.00 0.00 0.00 0.00 13 P 0.00 4.34 0.00 2.17 2.19 0.00 3.51 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.06 0.00 14 V 7.86 4.29 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 1.10 0.00 0.00 0.95 0.00 0.00 15 Q 8.36 4.79 0.00 2.11 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.45 0.00 0.00 0.00 0.00 0.00 2.53 2.36 0.00 16 G 8.25 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 0.00 0.00 0.00 0.00 17 I 8.09 5.17 1.82 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.73 0.82 0.00 0.00 18 I 8.82 4.67 1.87 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.45 0.48 0.00 0.00 19 N 8.54 5.10 0.00 1.44 1.68 0.00 0.00 6.44 6.21 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 20 F 8.95 5.44 0.00 2.92 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 21 E 9.56 5.34 0.00 2.39 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 2.32 2.54 0.00 22 Q 9.40 4.84 0.00 2.08 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.71 6.79 0.00 0.00 0.00 0.00 0.00 2.47 2.64 0.00 23 K 9.05 4.20 0.00 1.81 1.87 0.00 1.75 0.00 0.00 1.64 0.00 0.00 2.79 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.46 1.45 7.81 24 E 7.87 4.73 0.00 2.01 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 2.26 2.42 0.00 25 S 8.94 4.13 0.00 4.03 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 26 N 8.02 4.73 0.00 2.83 2.95 0.00 0.00 6.00 7.00 0.00 0.00 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 G 7.90 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 28 P 0.00 4.64 0.00 2.11 2.10 0.00 3.51 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.10 0.00 29 V 9.04 4.60 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 1.24 0.00 0.00 1.10 0.00 0.00 30 K 9.24 4.79 0.00 1.91 1.82 0.00 1.45 0.00 0.00 1.13 0.00 0.00 2.44 0.00 0.00 2.48 0.00 0.00 0.00 0.00 1.54 1.42 7.81 31 V 9.25 4.88 2.15 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 0.67 0.00 0.00 1.04 0.00 0.00 32 W 7.66 5.83 0.00 3.52 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 33 G 7.69 3.65 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 0.00 34 S 7.89 5.06 0.00 3.89 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 35 I 8.93 5.07 1.81 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.45 0.89 0.00 0.00 36 K 9.07 4.75 0.00 1.75 1.90 0.00 1.39 0.00 0.00 1.64 0.00 0.00 2.86 0.00 0.00 3.26 0.00 0.00 0.00 0.00 1.35 1.34 7.81 37 G 8.63 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 38 L 7.77 4.55 0.00 1.78 1.48 0.73 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 39 T 8.40 4.23 4.28 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 1.24 0.00 0.00 40 E 8.71 4.08 0.00 2.17 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 2.37 2.33 0.00 41 G 8.49 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 0.00 0.00 0.00 42 L 8.23 4.83 0.00 1.49 1.73 0.91 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 43 H 9.18 5.08 0.00 3.03 3.32 0.00 5.63 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 44 G 9.02 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 45 F 8.80 5.34 0.00 3.00 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 H 8.74 5.09 0.00 3.06 3.03 0.00 5.86 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 V 8.63 4.35 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 0.84 0.00 0.00 0.91 0.00 0.00 48 H 9.54 5.08 0.00 3.07 3.42 0.00 5.70 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 9.11 3.70 0.00 1.63 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 2.09 0.00 50 F 7.96 4.98 0.00 3.03 2.83 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 51 G 8.43 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 D 8.03 4.81 0.00 2.60 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 53 N 8.75 5.60 0.00 2.74 2.73 0.00 0.00 7.35 7.05 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 54 T 8.54 3.82 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 1.24 0.00 0.00 55 A 8.35 4.65 1.24 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 0.00 0.00 56 G 8.05 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 57 C 8.57 4.17 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 58 T 7.93 3.93 4.25 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 1.23 0.00 0.00 59 S 8.02 4.31 0.00 4.15 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 A 7.53 4.46 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 61 G 8.14 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 62 P 0.00 4.72 0.00 2.10 2.14 0.00 3.30 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.11 0.00 63 H 8.42 4.37 0.00 2.88 3.23 0.00 5.75 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 64 F 9.08 4.19 0.00 2.92 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 65 N 7.95 5.09 0.00 2.57 2.42 0.00 0.00 7.16 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 66 P 0.00 4.09 0.00 1.83 1.93 0.00 3.11 0.00 0.00 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.66 0.00 67 L 7.65 4.23 0.00 1.63 1.63 0.90 0.93 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 68 S 7.80 4.03 0.00 4.01 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 69 R 7.35 4.33 0.00 1.67 2.00 0.00 3.25 0.00 0.00 3.34 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.73 0.00 70 K 8.44 4.59 0.00 1.66 1.69 0.00 1.69 0.00 0.00 1.57 0.00 0.00 2.76 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.49 1.51 7.81 71 H 8.89 4.05 0.00 3.30 3.15 0.00 5.78 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 72 G 8.56 4.38 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 73 G 8.73 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 0.00 0.00 0.00 0.00 74 P 0.00 4.37 0.00 2.08 2.20 0.00 3.70 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 2.25 0.00 75 K 7.88 4.20 0.00 1.75 1.87 0.00 1.76 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.44 1.47 7.81 76 D 7.68 4.57 0.00 2.77 2.57 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 77 E 8.65 3.98 0.00 1.90 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 2.28 2.34 0.00 78 E 7.88 4.30 0.00 1.92 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 2.24 2.31 0.00 79 R 7.60 4.97 0.00 1.86 1.78 0.00 2.90 0.00 0.00 2.25 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.58 0.00 80 H 8.62 4.35 0.00 3.56 3.40 0.00 5.66 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 V 8.36 3.46 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.00 0.00 0.47 0.00 0.00 82 G 8.47 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 0.00 0.00 0.00 83 D 8.16 5.02 0.00 2.76 2.83 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 84 L 8.31 4.58 0.00 1.82 1.87 0.91 0.99 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 85 G 8.45 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 86 N 8.74 5.70 0.00 2.59 2.71 0.00 0.00 6.60 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 87 V 8.61 4.40 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 -0.15 0.00 0.00 0.78 0.00 0.00 88 T 8.23 4.98 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 89 A 9.05 4.72 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 90 D 8.79 4.72 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 91 K 8.43 4.18 0.00 1.88 1.99 0.00 1.16 0.00 0.00 1.85 0.00 0.00 2.99 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.40 1.43 7.81 92 D 8.94 4.56 0.00 2.85 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 93 A 8.33 4.48 1.45 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 0.00 0.00 94 V 7.47 4.76 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 1.03 0.00 0.00 0.98 0.00 0.00 95 A 8.98 5.12 1.15 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 0.00 0.00 96 D 8.62 4.84 0.00 2.56 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 V 8.81 4.22 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 0.71 0.00 0.00 0.65 0.00 0.00 98 S 8.43 4.70 0.00 3.89 3.71 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 99 I 9.32 4.81 1.97 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.64 1.01 0.00 0.00 100 E 8.87 5.16 0.00 1.95 1.82 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 2.20 2.30 0.00 101 D 9.27 4.91 0.00 2.88 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 0.00 102 S 8.80 4.87 0.00 4.01 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 0.00 103 V 8.39 3.99 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 0.81 0.00 0.00 0.96 0.00 0.00 104 I 7.83 4.03 1.97 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.83 1.05 0.00 0.00 105 S 8.51 4.75 0.00 3.83 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 0.00 106 L 8.64 4.46 0.00 1.82 1.63 1.00 0.84 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 0.00 107 S 7.65 4.52 0.00 3.98 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 0.00 108 G 8.06 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 0.00 109 D 8.55 4.52 0.00 2.76 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 0.00 110 H 8.13 4.96 0.00 3.23 3.46 0.00 5.65 0.00 0.00 0.00 0.00 6.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 C 7.87 4.30 0.00 3.02 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 0.00 112 I 8.19 3.98 1.64 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.42 0.94 0.00 0.00 113 I 7.40 3.76 1.78 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.73 0.88 0.00 0.00 114 G 9.53 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 0.00 115 R 7.52 4.98 0.00 1.58 1.88 0.00 2.21 0.00 0.00 2.25 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.22 0.00 116 T 7.90 5.01 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 1.26 0.00 0.00 117 L 8.72 4.65 0.00 1.77 1.53 0.39 0.77 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 0.00 118 V 8.89 4.99 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 0.75 0.00 0.00 0.71 0.00 0.00 119 V 8.67 5.00 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 0.79 0.00 0.00 1.00 0.00 0.00 120 H 8.94 5.29 0.00 3.35 3.58 0.00 5.66 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 E 9.42 4.22 0.00 2.07 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 2.37 2.34 0.00 122 K 8.54 4.83 0.00 1.76 1.67 0.00 1.75 0.00 0.00 1.67 0.00 0.00 2.85 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.35 1.38 7.81 123 A 8.48 4.48 1.24 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 0.00 0.00 124 D 9.74 4.94 0.00 2.78 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 0.00 125 D 9.39 4.61 0.00 2.93 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 0.00 126 L 10.15 3.48 0.00 1.83 1.77 0.93 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 127 G 8.69 4.43 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 0.00 128 K 8.15 4.61 0.00 1.97 1.73 0.00 1.66 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 1.34 1.36 7.81 129 G 7.86 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 0.00 130 G 9.09 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 0.00 131 N 7.52 4.71 0.00 2.78 2.80 0.00 0.00 6.24 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 0.00 132 E 8.74 4.05 0.00 2.06 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 2.37 2.36 0.00 133 E 8.25 3.88 0.00 2.11 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 2.38 2.44 0.00 134 S 8.96 4.23 0.00 4.04 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 T 8.00 4.27 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 1.26 0.00 0.00 136 K 7.74 4.31 0.00 1.80 1.81 0.00 1.66 0.00 0.00 1.75 0.00 0.00 3.07 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.33 1.59 7.81 137 T 8.00 4.08 4.13 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 1.13 0.00 0.00 138 G 8.41 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 0.00 0.00 0.00 139 N 7.91 4.27 0.00 3.01 2.90 0.00 0.00 6.90 7.49 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 0.00 140 A 7.23 4.44 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 0.00 141 G 7.43 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 0.00 142 S 8.37 4.47 0.00 3.98 4.06 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 0.00 0.00 0.00 143 R 8.34 4.62 0.00 1.69 1.83 0.00 3.20 0.00 0.00 3.25 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.68 0.00 144 L 9.02 4.37 0.00 1.68 1.70 0.93 1.07 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 0.00 145 A 7.73 5.04 1.22 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 0.00 0.00 146 C 8.18 5.58 0.00 3.02 2.97 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 0.00 147 G 8.04 4.36 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 0.00 148 V 8.34 4.40 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 0.76 0.00 0.00 0.94 0.00 0.00 149 I 8.86 4.09 1.77 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.64 0.34 0.00 0.00 150 G 8.92 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 0.00 151 I 8.39 4.28 1.85 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.53 0.90 0.00 0.00 152 A 8.41 4.83 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 153 Q 8.55 4.07 0.00 2.04 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.79 6.60 0.00 0.00 0.00 0.00 0.00 2.36 2.37 0.00