NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 T 4.3516 8.0333 117.3303 63.2152 70.3325 172.9588 2 E 4.2153 8.8144 127.6832 55.8170 29.5473 175.4174 3 L 4.6383 8.3052 127.3670 54.0421 44.7392 175.6633 4 T 4.6613 7.9534 107.9700 59.5814 72.5149 174.7989 5 K 3.2285 8.8711 122.0285 60.1768 31.9613 179.1491 6 C 4.1544 7.9703 115.7024 59.7503 39.6592 176.1079 7 K 3.8442 7.5783 120.0076 59.4066 31.5302 179.3755 8 V 3.4347 7.7645 118.7679 66.2995 31.1762 178.3001 9 S 4.2275 8.0186 113.2042 61.2604 62.9435 175.9543 10 H 4.5543 8.1454 119.1716 58.3638 28.5330 176.9680 11 A 4.2317 8.2139 120.3639 53.3647 18.7297 178.3592 12 I 4.1997 7.3160 117.2858 60.8216 37.9881 177.6423 13 K 4.0596 7.5256 120.5688 59.7883 31.7752 178.0264 14 D 4.5403 8.0505 116.1384 55.9960 40.6265 176.6178 15 I 4.0870 7.9228 119.3429 60.3571 39.0470 174.5627 16 D 4.6364 7.7819 120.4120 56.7759 41.6097 175.3711 17 G 4.2371 9.9844 115.4798 45.5848 0.0000 173.0339 18 Y 4.0797 7.5688 119.5558 59.2425 38.9149 176.1088 19 Q 3.4228 9.0563 126.7472 57.0572 27.4940 174.5277 20 G 3.9743 8.5646 104.3132 45.0910 0.0000 174.7368 21 I 3.9818 7.3793 122.0360 60.8469 37.7586 176.1230 22 S 5.1536 8.9731 122.3677 56.4196 66.3354 175.0305 23 L 4.4491 8.3306 120.0962 56.5922 41.4183 179.5885 24 L 4.1063 7.8570 119.4693 58.0609 41.7766 178.9512 25 E 3.9064 8.1018 118.1778 58.9872 29.1885 179.6888 26 W 4.0870 7.8716 118.8938 59.6541 29.1473 178.4293 27 A 4.0705 8.0916 120.6194 55.2311 17.7005 178.8923 28 C 2.0000 7.6195 116.8576 58.8620 43.4898 175.9714 29 V 3.4920 7.6214 119.9340 66.0365 31.0283 177.9951 30 L 3.9823 8.7552 119.6550 57.6251 41.3183 179.0773 31 F 2.9928 8.1096 120.6759 61.4448 39.0343 176.8141 32 H 4.0639 7.6356 113.5175 58.0528 28.6573 177.6801 33 T 4.1977 7.8222 117.8209 65.7584 68.7708 175.7190 34 S 4.4446 8.6915 113.5322 56.8522 64.6519 175.6164 35 G 3.4314 7.8503 108.0394 45.2636 0.0000 172.8778 36 Y 3.6582 7.5325 114.6720 58.7577 35.7861 168.6518 37 D 5.1849 7.5308 121.4658 52.7090 41.0299 176.6991 38 T 4.0781 8.2069 119.1857 63.9480 69.4129 175.2963 39 Q 4.7330 7.8691 119.4390 55.4120 29.8928 175.7139 40 A 4.0804 8.5075 122.9445 52.6048 19.6505 177.9926 41 V 4.3822 8.1788 121.3074 61.6963 34.1316 173.9760 42 V 4.3370 8.1098 128.4215 60.9611 33.8917 174.3063 43 N 4.5373 8.7398 125.4806 54.3351 39.1479 172.2579 44 D 4.3797 8.9825 121.5802 54.2860 42.0304 177.1272 45 N 4.6315 8.1836 122.5369 52.4913 40.9632 174.8034 46 G 3.9474 9.2502 109.0736 45.3846 0.0000 170.9601 47 S 4.5345 7.3107 113.1849 56.9868 67.0491 173.0231 48 T 5.0229 9.4380 117.0700 61.8464 72.2830 172.8274 49 E 5.3250 8.6912 124.0547 54.9341 32.5434 174.5394 50 Y 4.8650 9.3314 121.0757 57.3870 41.5643 177.6466 51 G 4.2581 8.8906 112.1154 44.5846 0.0000 173.1673 52 L 3.8666 8.8001 119.3208 58.0689 41.7973 178.8243 53 F 4.7735 8.3756 113.5691 57.0208 40.1598 175.2173 54 Q 3.5790 7.9056 119.2292 57.0491 26.4384 173.7323 55 I 4.2128 8.1104 119.2783 61.0001 39.0100 177.4096 56 S 5.1761 9.2764 122.4395 58.1896 63.4749 174.0980 57 D 4.9702 8.8537 124.3975 53.6433 39.4102 177.5312 58 R 3.5419 7.8681 120.1779 58.8192 30.3261 177.0990 59 F 4.8482 7.6733 112.6934 56.8092 41.8576 176.2758 60 W 4.7484 8.0382 119.9997 57.9671 29.9175 173.3969 61 C 5.3705 7.8047 110.9795 53.5098 41.9979 172.9231 62 K 4.5331 8.9707 122.3119 55.6704 33.0997 175.7025 63 S 5.0156 8.5358 121.1104 56.2746 66.0414 175.3077 64 S 4.2155 8.9294 116.8172 61.3490 62.7438 175.5187 65 E 4.3832 7.7641 116.9010 57.0345 30.6583 176.1600 66 F 4.9961 7.8935 120.5520 56.1847 38.9151 173.5536 67 P 4.5021 0.0000 0.0000 63.3626 31.4978 177.0995 68 E 4.3505 7.2597 115.0773 55.3745 30.7779 176.1681 69 S 4.0713 7.2323 114.2568 58.8388 62.6916 174.2910 70 E 3.8688 8.9965 126.0334 57.7419 30.0220 176.3619 71 N 4.1338 8.2774 117.6734 53.9804 37.8177 174.8901 72 I 3.6497 8.0527 120.5382 64.9369 37.7731 177.5697 73 C 4.4402 8.6560 115.7854 57.1280 40.7356 173.3974 74 G 4.3898 8.3824 108.5154 46.9087 0.0000 173.1186 75 I 4.6153 7.0183 109.7728 58.8061 41.3197 174.2123 76 S 4.6268 8.4244 116.3994 57.8956 63.1755 175.4701 77 C 3.8638 9.0424 126.2078 60.4417 40.5845 176.0225 78 D 4.4123 7.9572 119.5840 57.3434 40.1620 178.3756 79 K 4.2662 7.9328 116.6514 57.6447 31.8953 177.9348 80 L 4.8576 8.1532 121.0540 53.8535 41.7958 177.1137 81 L 5.3156 7.9888 117.7251 53.7574 42.5971 176.4155 82 D 4.8915 7.7399 119.3659 52.6657 41.6523 176.4869 83 D 4.7780 8.6665 122.0642 54.5750 41.2897 175.5098 84 E 4.5026 9.1481 120.7782 55.1633 30.0534 176.6001 85 L 5.0073 8.2432 125.4195 55.0957 42.1161 178.3444 86 D 4.3859 8.2066 119.8219 57.7589 40.8044 178.6764 87 D 4.3568 8.0341 118.4481 56.3037 39.4381 178.1216 88 D 4.3446 7.9157 120.1501 57.2242 40.8433 178.5311 89 I 3.2109 8.3723 120.5372 64.0714 36.9426 178.3633 90 A 3.7812 7.9826 121.7410 55.1210 18.1368 178.9154 91 C 4.1359 8.0443 116.8812 59.4870 43.9400 175.5784 92 A 3.7208 7.5114 122.4268 55.0530 17.7851 179.6712 93 K 3.4194 7.8717 117.0932 59.4047 31.9645 179.7109 94 K 4.0798 7.5835 118.8873 59.2962 32.0309 179.4040 95 I 2.9320 7.4488 120.1559 63.9208 36.8275 178.4630 96 L 4.1464 8.3348 119.7664 57.9645 41.3661 179.4212 97 A 4.1016 7.8518 118.8049 55.1030 18.3794 179.2533 98 I 4.0799 7.8397 117.0535 63.1176 37.7430 176.8935 99 K 4.3969 8.7068 118.1239 55.1229 34.3562 177.0580 100 G 4.1626 8.1763 103.1845 45.1820 0.0000 174.1033 101 I 3.8862 8.2351 118.5520 63.6636 37.8172 176.6458 102 D 4.9381 8.0849 117.6572 55.0995 40.8391 176.4693 103 Y 4.0322 8.0858 122.2926 60.1944 38.8644 176.2661 104 W 4.3718 8.2155 122.0908 55.1936 27.6233 176.9513 105 K 4.0008 8.3490 122.3661 58.2929 31.9558 178.2229 106 A 4.1639 8.0441 121.4294 54.0368 18.7865 178.0896 107 Y 4.0703 8.0360 117.7688 61.0802 39.1361 178.4579 108 K 3.6797 8.1236 119.3250 59.0142 32.5437 176.8937 109 P 4.3435 0.0000 0.0000 65.2093 31.4296 176.8913 110 M 4.4393 8.0396 116.6096 55.4075 33.3652 175.9212 111 C 4.8937 7.9546 115.0331 56.7583 40.7835 174.9353 112 S 3.9880 7.9192 116.3130 59.2997 62.9837 173.4499 113 E 4.6177 7.5214 116.4157 54.8093 32.8086 174.9634 114 K 3.8097 8.3882 115.7722 57.6168 29.1418 174.7773 115 L 4.7684 7.5176 119.0672 55.8600 43.5900 178.8460 116 E 3.9594 8.5699 119.9146 59.3029 29.3973 178.9214 117 Q 3.9112 7.9871 114.5580 58.6249 28.4801 177.0556 118 W 4.5091 8.1600 116.9255 57.0048 29.3897 176.5510 119 R 4.1271 7.5869 119.2362 56.0240 30.1084 174.8663 120 C 4.5625 8.5929 123.7263 56.0440 44.0478 173.2788 121 E 4.4835 8.5298 129.1480 56.1498 29.6527 176.4363 122 K 4.6818 7.5379 115.7081 54.1740 36.5581 175.0058 123 P 4.4579 0.0000 0.0000 62.9691 31.2506 176.4867 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 T 8.03 4.35 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 1.26 0.00 0.00 2 E 8.81 4.22 0.00 1.97 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 2.35 2.43 0.00 3 L 8.31 4.64 0.00 1.51 1.57 0.88 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 4 T 7.95 4.66 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 1.23 0.00 0.00 5 K 8.87 3.23 0.00 1.97 1.87 0.00 2.08 0.00 0.00 2.02 0.00 0.00 2.97 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.56 1.74 7.81 6 C 7.97 4.15 0.00 2.90 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 7 K 7.58 3.84 0.00 1.81 1.79 0.00 1.71 0.00 0.00 1.54 0.00 0.00 2.89 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.43 1.40 7.81 8 V 7.76 3.43 1.90 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 0.92 0.00 0.00 0.59 0.00 0.00 9 S 8.02 4.23 0.00 3.81 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 10 H 8.15 4.55 0.00 3.38 3.29 0.00 5.63 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 11 A 8.21 4.23 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 12 I 7.32 4.20 1.95 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.85 0.75 0.00 0.00 13 K 7.53 4.06 0.00 1.89 1.88 0.00 1.71 0.00 0.00 1.68 0.00 0.00 3.27 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.78 1.68 7.81 14 D 8.05 4.54 0.00 2.59 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 15 I 7.92 4.09 1.64 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 1.14 0.59 0.00 0.00 16 D 7.78 4.64 0.00 2.93 2.69 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 17 G 9.98 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 0.00 0.00 0.00 18 Y 7.57 4.08 0.00 3.13 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 19 Q 9.06 3.42 0.00 2.22 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.58 0.00 0.00 0.00 0.00 0.00 2.30 2.37 0.00 20 G 8.56 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 21 I 7.38 3.98 1.86 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 1.50 0.49 -0.15 0.00 0.00 22 S 8.97 5.15 0.00 4.06 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 23 L 8.33 4.45 0.00 1.81 1.85 1.03 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 24 L 7.86 4.11 0.00 1.76 1.85 0.99 1.09 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 25 E 8.10 3.91 0.00 2.02 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 0.00 2.37 2.37 0.00 26 W 7.87 4.09 0.00 3.39 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 27 A 8.09 4.07 1.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 C 7.62 2.00 0.00 1.23 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 V 7.62 3.49 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 1.04 0.00 0.00 0.81 0.00 0.00 30 L 8.76 3.98 0.00 1.94 1.77 0.48 -0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 31 F 8.11 2.99 0.00 2.87 2.95 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 32 H 7.64 4.06 0.00 3.10 3.34 0.00 5.90 0.00 0.00 0.00 0.00 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 T 7.82 4.20 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 1.49 0.00 0.00 34 S 8.69 4.44 0.00 3.88 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 0.00 35 G 7.85 3.43 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 36 Y 7.53 3.66 0.00 3.28 2.95 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 37 D 7.53 5.18 0.00 2.72 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 38 T 8.21 4.08 4.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 39 Q 7.87 4.73 0.00 1.91 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.83 0.00 0.00 0.00 0.00 0.00 2.56 2.43 0.00 40 A 8.51 4.08 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 41 V 8.18 4.38 1.99 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 0.51 0.00 0.00 0.94 0.00 0.00 42 V 8.11 4.34 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 0.87 0.00 0.00 0.96 0.00 0.00 43 N 8.74 4.54 0.00 2.59 2.67 0.00 0.00 6.93 8.06 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 44 D 8.98 4.38 0.00 2.56 2.34 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 45 N 8.18 4.63 0.00 2.68 2.64 0.00 0.00 6.77 8.40 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 46 G 9.25 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 S 7.31 4.53 0.00 3.72 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 T 9.44 5.02 4.26 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 0.72 0.00 0.00 49 E 8.69 5.33 0.00 2.07 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 2.25 2.35 0.00 50 Y 9.33 4.86 0.00 2.94 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 51 G 8.89 4.26 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 0.00 52 L 8.80 3.87 0.00 1.56 1.65 0.93 0.30 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 53 F 8.38 4.77 0.00 3.25 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 54 Q 7.91 3.58 0.00 2.37 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.83 0.00 0.00 0.00 0.00 0.00 2.49 2.62 0.00 55 I 8.11 4.21 2.03 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 1.02 0.89 1.00 0.00 0.00 56 S 9.28 5.18 0.00 4.19 4.14 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 57 D 8.85 4.97 0.00 2.85 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 58 R 7.87 3.54 0.00 1.40 1.47 0.00 2.86 0.00 0.00 2.75 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.97 0.00 59 F 7.67 4.85 0.00 1.95 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 0.00 0.00 0.00 0.00 60 W 8.04 4.75 0.00 3.61 3.24 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 61 C 7.80 5.37 0.00 3.14 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 62 K 8.97 4.53 0.00 1.84 1.70 0.00 1.55 0.00 0.00 1.68 0.00 0.00 2.87 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.39 1.37 7.81 63 S 8.54 5.02 0.00 3.94 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 64 S 8.93 4.22 0.00 3.92 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 65 E 7.76 4.38 0.00 2.10 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 2.34 2.29 0.00 66 F 7.89 5.00 0.00 2.96 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 67 P 0.00 4.50 0.00 2.02 2.04 0.00 3.64 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.14 0.00 68 E 7.26 4.35 0.00 1.81 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 0.00 1.47 1.76 0.00 69 S 7.23 4.07 0.00 4.44 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 70 E 9.00 3.87 0.00 1.93 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.34 0.00 71 N 8.28 4.13 0.00 2.85 2.73 0.00 0.00 7.00 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 72 I 8.05 3.65 1.81 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.52 1.00 0.00 0.00 73 C 8.66 4.44 0.00 3.33 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 74 G 8.38 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 0.00 0.00 0.00 75 I 7.02 4.62 1.86 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.95 0.94 0.00 0.00 76 S 8.42 4.63 0.00 3.85 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 77 C 9.04 3.86 0.00 2.12 1.31 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 78 D 7.96 4.41 0.00 2.65 2.74 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 79 K 7.93 4.27 0.00 1.89 2.04 0.00 1.56 0.00 0.00 1.69 0.00 0.00 3.13 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.47 1.52 7.81 80 L 8.15 4.86 0.00 1.89 1.81 0.95 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 81 L 7.99 5.32 0.00 1.83 1.76 1.14 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 82 D 7.74 4.89 0.00 2.77 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 83 D 8.67 4.78 0.00 2.65 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 84 E 9.15 4.50 0.00 2.05 1.90 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 2.27 2.26 0.00 85 L 8.24 5.01 0.00 1.74 1.74 0.95 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 86 D 8.21 4.39 0.00 2.74 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 87 D 8.03 4.36 0.00 2.85 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 88 D 7.92 4.34 0.00 2.99 3.01 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 89 I 8.37 3.21 1.91 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.94 0.68 0.00 0.00 90 A 7.98 3.78 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 91 C 8.04 4.14 0.00 3.05 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 92 A 7.51 3.72 0.46 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 0.00 0.00 0.00 93 K 7.87 3.42 0.00 1.59 1.36 0.00 1.35 0.00 0.00 1.17 0.00 0.00 2.46 0.00 0.00 2.71 0.00 0.00 0.00 0.00 0.30 1.13 7.81 94 K 7.58 4.08 0.00 1.90 1.96 0.00 1.73 0.00 0.00 1.75 0.00 0.00 2.99 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.51 1.47 7.81 95 I 7.45 2.93 1.65 0.00 0.00 -0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.33 -0.32 0.00 0.00 96 L 8.33 4.15 0.00 2.19 2.00 1.31 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 97 A 7.85 4.10 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 I 7.84 4.08 2.22 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 1.51 0.78 1.10 0.00 0.00 99 K 8.71 4.40 0.00 1.84 1.97 0.00 2.14 0.00 0.00 2.01 0.00 0.00 3.30 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.47 1.47 7.81 100 G 8.18 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 0.00 101 I 8.24 3.89 1.50 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.37 0.48 0.00 0.00 102 D 8.08 4.94 0.00 2.80 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 0.00 103 Y 8.09 4.03 0.00 2.67 2.44 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 0.00 104 W 8.22 4.37 0.00 3.66 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 0.00 105 K 8.35 4.00 0.00 1.71 1.87 0.00 1.70 0.00 0.00 1.64 0.00 0.00 2.82 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.42 1.52 7.81 106 A 8.04 4.16 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 0.00 107 Y 8.04 4.07 0.00 3.05 3.04 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 0.00 108 K 8.12 3.68 0.00 1.81 1.84 0.00 1.84 0.00 0.00 1.77 0.00 0.00 3.27 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.42 1.53 7.81 109 P 0.00 4.34 0.00 2.14 2.16 0.00 3.81 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.00 0.00 110 M 8.04 4.44 0.00 1.81 2.03 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.62 0.00 111 C 7.95 4.89 0.00 2.74 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 0.00 112 S 7.92 3.99 0.00 3.73 3.78 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 0.00 113 E 7.52 4.62 0.00 2.01 1.86 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 2.17 2.34 0.00 114 K 8.39 3.81 0.00 1.93 1.85 0.00 1.74 0.00 0.00 1.69 0.00 0.00 2.78 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.36 1.45 7.81 115 L 7.52 4.77 0.00 1.79 1.84 0.95 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 116 E 8.57 3.96 0.00 2.05 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 2.39 2.39 0.00 117 Q 7.99 3.91 0.00 1.85 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.55 6.85 0.00 0.00 0.00 0.00 0.00 2.03 1.24 0.00 118 W 8.16 4.51 0.00 3.39 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 0.00 119 R 7.59 4.13 0.00 1.81 1.99 0.00 3.27 0.00 0.00 3.18 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.61 0.00 120 C 8.59 4.56 0.00 2.94 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 0.00 121 E 8.53 4.48 0.00 1.98 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 0.00 2.26 2.24 0.00 122 K 7.54 4.68 0.00 1.66 1.65 0.00 1.74 0.00 0.00 1.69 0.00 0.00 2.98 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.34 1.45 7.81 123 P 0.00 4.46 0.00 2.05 1.97 0.00 3.72 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.08 0.00