NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4141 8.3044 120.3278 54.6287 33.4670 174.4628 2 E 3.7976 8.3272 120.9372 55.2296 30.1655 174.7986 3 A 4.1371 9.2283 129.3501 52.7093 19.9525 177.2163 4 L 4.0781 8.4813 120.6616 55.8245 42.1315 178.4881 5 G 3.8519 9.7827 104.4567 44.9803 0.0000 172.3722 6 A 4.5687 7.3227 116.3473 50.8314 22.0504 176.4992 7 D 4.6826 8.7701 122.0123 53.6665 42.4001 175.7515 8 V 4.6490 8.4178 122.6499 61.3806 34.3071 174.8928 9 T 4.4731 7.8092 123.2045 61.7419 69.2754 174.5753 10 Q 3.9569 8.8472 125.9651 56.8122 28.9343 177.3613 11 G 4.0805 9.0320 109.4000 45.9750 0.0000 172.7068 12 L 5.0600 8.0829 120.2691 52.9031 45.9277 175.0431 13 E 5.1660 8.8210 119.2646 53.9692 34.5931 175.1784 14 K 4.1564 8.3542 122.6991 58.0194 32.3701 176.7835 15 G 4.0646 9.2492 115.6551 45.2464 0.0000 174.0810 16 S 4.2946 8.0525 116.2407 58.7534 64.1239 173.2326 17 L 5.1429 8.4069 123.2712 53.2387 43.1813 175.7547 18 I 4.7586 8.9554 116.7256 59.0594 41.8787 174.5634 19 T 4.4158 8.4935 119.3321 63.7046 69.7001 174.0387 20 C 4.7579 8.5257 126.5957 57.1303 31.6693 174.2201 21 A 4.5155 8.2601 134.7395 50.4721 16.0888 174.7198 22 D 5.0315 7.6119 119.0878 53.2435 42.2435 175.4062 23 N 5.0355 8.3934 115.6740 53.0398 37.6462 175.9022 24 T 3.9425 8.4361 111.9949 64.1003 69.3892 175.0697 25 G 3.9371 8.2693 108.3198 45.0983 0.0000 172.6849 26 A 4.7842 7.4256 122.4198 50.9482 20.6177 176.6503 27 R 4.3883 9.3818 122.6938 57.4623 32.2588 176.1027 28 E 5.1680 8.0497 119.1087 54.1851 32.7487 174.3563 29 L 5.2623 9.1697 126.0679 52.7681 45.6009 175.0884 30 K 4.9212 8.8134 124.7473 54.4331 34.4108 175.4346 31 V 3.9946 8.7524 128.6357 63.4004 31.9927 175.9594 32 I 4.2385 8.4847 127.8739 62.7869 39.4135 175.8794 33 S 4.6776 7.7736 114.9945 57.3329 67.9993 173.4157 34 V 4.5592 8.2122 121.2088 61.0264 33.5875 174.4618 35 H 4.2073 9.1340 128.7603 57.9076 30.0079 175.3156 36 G 3.8576 8.5302 113.1777 46.0238 0.0000 172.5387 37 Y 4.4536 7.8016 121.3820 56.3701 39.8598 174.3823 38 S 4.2662 7.0912 119.6597 56.5838 66.0044 172.9296 39 G 4.1969 7.8712 122.7531 44.7039 0.0000 174.1099 40 T 4.3623 8.4136 117.2867 60.1614 69.8801 171.9695 41 K 3.9063 8.4998 125.5995 58.1793 32.2891 176.8458 42 N 4.4744 8.9823 121.6431 53.6392 37.2672 174.3884 43 R 4.0688 8.0391 119.5926 55.5816 30.5219 175.7598 44 L 4.1901 8.4917 126.2821 53.5079 42.2668 174.9220 45 P 4.4487 0.0000 0.0000 63.4599 31.8401 175.2112 46 K 5.0367 7.8524 122.3494 55.0030 35.2101 175.2706 47 A 4.7365 8.8232 123.2131 50.5452 23.1441 175.4184 48 G 4.2508 9.1868 106.7934 44.2123 0.0000 171.2595 49 L 4.1670 8.7465 121.9116 57.0236 42.1031 177.2738 50 G 4.1751 8.8431 114.7259 45.3482 0.0000 173.4590 51 D 4.7453 8.0978 119.4469 53.9786 42.5858 175.2214 52 K 4.9419 8.6604 122.5859 54.9976 34.0347 175.1454 53 I 5.0683 8.6899 120.5577 59.4049 41.4433 174.5051 54 T 4.7752 8.6391 120.3045 62.9970 70.3583 174.1573 55 V 5.0514 9.2897 124.2364 61.6127 35.8866 173.3833 56 S 5.2126 8.7443 118.2463 56.4044 66.4565 173.2671 57 V 4.3158 8.2545 122.4432 62.7288 31.6422 176.5438 58 T 4.1332 8.6469 125.9821 65.5354 69.3587 175.8538 59 K 4.5466 8.8554 119.2430 53.9210 36.4413 177.7184 60 G 3.7044 8.4962 109.9425 45.1976 0.0000 172.3199 61 T 4.0269 7.8128 110.4880 60.9509 69.4317 173.2261 62 P 4.2153 0.0000 0.0000 66.2539 31.4119 178.3923 63 E 4.1000 8.1190 115.1013 59.6413 29.6513 178.9423 64 M 4.1576 7.7666 117.5332 57.2015 32.3935 177.0968 65 R 4.1503 7.4092 116.5857 58.1394 30.6904 177.3159 66 R 4.0176 8.7572 119.0558 56.4879 29.1460 176.6287 67 Q 4.2377 7.8186 118.2014 55.5798 30.2401 175.3103 68 V 4.4303 8.3029 123.2092 61.6958 32.4654 174.6026 69 L 4.9582 9.2084 127.4122 53.0257 46.5027 175.5988 70 E 5.0003 8.5268 118.6553 55.9396 31.8241 175.1795 71 A 4.9403 8.6143 122.6037 51.2509 23.7666 175.1262 72 V 4.4916 8.2443 118.4114 60.8585 34.7590 174.8145 73 V 3.9673 8.4560 128.5194 63.1541 31.6201 176.2435 74 V 4.1173 8.9830 128.1165 63.6397 33.8242 175.4844 75 R 4.0967 7.4287 117.5272 54.3044 34.8003 174.1451 76 Q 4.9752 7.9755 117.9827 55.2309 31.5321 175.7914 77 R 4.3160 9.1707 120.2986 58.4691 30.4867 177.7942 78 K 4.1866 7.8799 118.6706 55.6007 31.3059 175.3480 79 P 4.9026 0.0000 0.0000 62.9227 32.8021 175.0449 80 I 4.9113 8.5111 114.2248 59.2830 41.5215 173.8918 81 R 5.0200 9.0560 124.2783 54.9685 32.2397 175.2219 82 R 4.8783 8.5523 124.3037 53.7616 32.6251 175.5211 83 P 3.9274 0.0000 0.0000 66.0209 31.4195 177.0132 84 D 4.5881 8.0311 114.3570 53.3323 39.6293 175.6821 85 G 4.1510 8.9172 110.2509 45.9793 0.0000 174.8321 86 T 4.0103 7.4231 114.2855 64.1304 69.5024 173.9720 87 R 5.0457 8.4401 123.2455 54.9982 32.5251 175.9349 88 V 4.4866 8.8199 121.7197 61.0205 34.5938 174.4554 89 K 4.9790 8.4232 125.6038 55.3713 35.6430 175.3531 90 F 4.7171 8.8248 120.2109 55.8345 41.6654 176.2582 91 E 4.1686 9.0418 119.7082 58.4975 29.7015 174.8009 92 D 4.7518 7.7533 115.7701 52.8020 42.8631 173.6386 93 N 5.2350 8.6807 114.9260 51.6667 41.0058 174.2488 94 A 5.2339 8.8838 124.1109 50.6284 23.3804 174.6732 95 A 5.0008 9.0571 120.8726 50.2218 23.7167 175.1557 96 V 4.6011 8.3337 119.0197 60.6928 34.3724 175.3148 97 I 4.2899 8.3419 128.6433 61.8897 38.1148 175.2903 98 V 4.8620 8.4982 124.6436 61.6499 35.2303 174.8143 99 D 4.8916 8.1998 124.4833 51.9372 41.8963 176.4456 100 E 3.9439 8.8134 117.2136 60.0441 29.3997 177.7207 101 N 4.5970 8.8842 113.4374 53.1237 38.7953 175.3186 102 E 3.8649 8.1781 116.8912 56.9848 27.7467 173.6933 103 D 4.8788 8.2301 118.6488 51.4127 42.0468 174.3059 104 P 4.6750 0.0000 0.0000 63.0151 31.6216 176.5273 105 R 3.8883 8.4830 122.9746 58.8552 30.1762 176.8910 106 G 3.9851 7.6910 105.7575 44.8558 0.0000 172.9661 107 T 4.2847 8.7174 115.1786 64.5968 69.2780 175.5723 108 E 4.8459 8.1161 118.7760 54.3695 33.8593 174.8059 109 L 4.9355 8.4893 121.7615 53.1546 43.8244 175.8793 110 K 4.3794 8.5308 123.0994 55.9259 33.7203 177.7484 111 G 3.9176 8.8799 111.7530 44.0823 0.0000 170.7164 112 P 4.8706 0.0000 0.0000 62.5564 32.7289 175.3869 113 I 4.7130 8.5343 120.0868 59.3821 41.6795 174.3302 114 A 5.2024 7.9395 125.9891 50.7991 19.9588 178.9290 115 R 3.9467 9.2606 119.4134 59.4617 30.0250 179.0417 116 E 4.0137 8.3048 117.7728 59.2439 29.3105 179.2955 117 V 3.8098 8.0306 118.1715 65.5856 31.3009 177.9320 118 A 4.0297 7.5765 119.6997 55.1991 18.3153 178.9959 119 Q 4.0881 7.3569 114.2265 59.3854 28.9152 179.6640 120 R 3.9263 7.7346 116.4848 57.8389 31.0308 177.3911 121 F 4.7082 8.0844 123.5239 55.1627 39.4212 176.5389 122 G 3.6493 8.6277 113.1122 47.7765 0.0000 173.2465 123 S 4.5279 8.0730 117.8976 60.2234 62.4579 176.7193 124 V 3.5724 7.8291 121.4105 65.8710 31.5085 177.5269 125 A 4.2224 8.1120 120.7724 55.0356 18.2730 180.1095 126 S 4.6270 8.8071 112.5645 58.3885 63.4614 175.4418 127 A 4.6292 8.4703 122.5884 52.6063 21.7162 177.4599 128 A 4.2254 7.2634 119.7428 52.3286 19.0383 177.7899 129 T 4.3152 8.4303 117.6334 65.2344 69.7386 175.4429 130 M 4.9403 7.7233 119.2777 53.4997 36.5574 174.7764 131 I 4.9518 8.4408 122.3147 59.7247 40.7631 175.4950 132 V 4.0653 9.1459 127.1205 62.8841 31.6536 175.2466 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 M 8.30 4.41 0.00 1.97 2.09 0.00 0.00 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.56 0.00 2 E 8.33 3.80 0.00 1.93 1.74 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 2.24 2.33 0.00 3 A 9.23 4.14 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 4 L 8.48 4.08 0.00 1.66 1.75 0.95 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 5 G 9.78 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 A 7.32 4.57 1.21 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 0.00 0.00 7 D 8.77 4.68 0.00 2.64 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 8 V 8.42 4.65 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 0.84 0.00 0.00 0.96 0.00 0.00 9 T 7.81 4.47 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 1.22 0.00 0.00 10 Q 8.85 3.96 0.00 1.87 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.85 0.00 0.00 0.00 0.00 0.00 2.27 2.47 0.00 11 G 9.03 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 12 L 8.08 5.06 0.00 1.68 1.49 0.88 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 13 E 8.82 5.17 0.00 1.83 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.20 0.00 14 K 8.35 4.16 0.00 1.72 1.72 0.00 1.78 0.00 0.00 1.72 0.00 0.00 2.87 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.45 1.53 7.81 15 G 9.25 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 0.00 0.00 0.00 16 S 8.05 4.29 0.00 3.84 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 17 L 8.41 5.14 0.00 1.50 1.58 0.95 0.75 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 18 I 8.96 4.76 1.99 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 1.36 0.86 0.88 0.00 0.00 19 T 8.49 4.42 4.33 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 1.19 0.00 0.00 20 C 8.53 4.76 0.00 2.96 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 21 A 8.26 4.52 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 0.00 0.00 22 D 7.61 5.03 0.00 2.80 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 23 N 8.39 5.04 0.00 2.81 2.89 0.00 0.00 5.94 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 24 T 8.44 3.94 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 25 G 8.27 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 26 A 7.43 4.78 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 27 R 9.38 4.39 0.00 1.82 1.95 0.00 3.06 0.00 0.00 3.09 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.55 0.00 28 E 8.05 5.17 0.00 2.00 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 2.24 2.28 0.00 29 L 9.17 5.26 0.00 1.51 1.47 0.88 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 30 K 8.81 4.92 0.00 1.78 1.64 0.00 1.62 0.00 0.00 1.57 0.00 0.00 2.80 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.33 1.34 7.81 31 V 8.75 3.99 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 0.84 0.00 0.00 0.94 0.00 0.00 32 I 8.48 4.24 1.87 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 1.22 0.94 0.91 0.00 0.00 33 S 7.77 4.68 0.00 3.75 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 34 V 8.21 4.56 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.81 0.00 0.00 35 H 9.13 4.21 0.00 3.19 3.36 0.00 6.12 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 G 8.53 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 0.00 0.00 0.00 37 Y 7.80 4.45 0.00 3.08 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 38 S 7.09 4.27 0.00 3.63 3.41 0.00 0.00 0.00 0.00 0.00 0.00 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 G 7.87 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 40 T 8.41 4.36 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 1.23 0.00 0.00 41 K 8.50 3.91 0.00 1.75 1.76 0.00 1.92 0.00 0.00 1.71 0.00 0.00 2.79 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.44 1.52 7.81 42 N 8.98 4.47 0.00 2.94 3.00 0.00 0.00 7.06 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 43 R 8.04 4.07 0.00 1.80 2.06 0.00 3.38 0.00 0.00 3.36 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.66 0.00 44 L 8.49 4.19 0.00 1.80 1.61 1.01 1.15 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 45 P 0.00 4.45 0.00 2.09 2.40 0.00 3.68 0.00 0.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.04 0.00 46 K 7.85 5.04 0.00 1.68 1.70 0.00 1.48 0.00 0.00 1.69 0.00 0.00 3.07 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.01 1.13 7.81 47 A 8.82 4.74 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 0.00 0.00 0.00 0.00 0.00 48 G 9.19 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 0.00 0.00 0.00 0.00 49 L 8.75 4.17 0.00 1.73 1.65 1.01 1.12 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 50 G 8.84 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 51 D 8.10 4.75 0.00 2.75 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 52 K 8.66 4.94 0.00 1.92 1.72 0.00 1.76 0.00 0.00 1.86 0.00 0.00 2.77 0.00 0.00 2.62 0.00 0.00 0.00 0.00 1.39 1.49 7.81 53 I 8.69 5.07 1.97 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 1.29 0.55 0.88 0.00 0.00 54 T 8.64 4.78 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 1.21 0.00 0.00 55 V 9.29 5.05 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 1.01 0.00 0.00 0.90 0.00 0.00 56 S 8.74 5.21 0.00 3.90 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 57 V 8.25 4.32 2.23 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 1.00 0.00 0.00 0.91 0.00 0.00 58 T 8.65 4.13 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 1.34 0.00 0.00 59 K 8.86 4.55 0.00 1.72 1.62 0.00 1.73 0.00 0.00 1.81 0.00 0.00 2.81 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.40 1.52 7.81 60 G 8.50 3.70 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 0.00 61 T 7.81 4.03 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 1.25 0.00 0.00 62 P 0.00 4.22 0.00 2.03 2.17 0.00 3.68 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 2.03 2.20 0.00 63 E 8.12 4.10 0.00 1.93 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.35 0.00 64 M 7.77 4.16 0.00 2.05 2.18 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.71 0.00 65 R 7.41 4.15 0.00 1.92 1.89 0.00 3.24 0.00 0.00 3.22 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.75 0.00 66 R 8.76 4.02 0.00 1.97 2.10 0.00 3.15 0.00 0.00 3.22 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.58 0.00 67 Q 7.82 4.24 0.00 2.19 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.78 0.00 0.00 0.00 0.00 0.00 2.37 2.36 0.00 68 V 8.30 4.43 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 0.79 0.00 0.00 0.93 0.00 0.00 69 L 9.21 4.96 0.00 1.51 1.47 0.90 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 70 E 8.53 5.00 0.00 1.99 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 2.32 2.29 0.00 71 A 8.61 4.94 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 0.00 0.00 0.00 0.00 0.00 72 V 8.24 4.49 1.68 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 0.53 0.00 0.00 -0.10 0.00 0.00 73 V 8.46 3.97 2.17 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 0.82 0.00 0.00 0.88 0.00 0.00 74 V 8.98 4.12 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 0.79 0.00 0.00 0.91 0.00 0.00 75 R 7.43 4.10 0.00 1.45 1.12 0.00 3.20 0.00 0.00 3.62 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 1.31 0.00 76 Q 7.98 4.98 0.00 2.07 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.92 0.00 0.00 0.00 0.00 0.00 2.35 2.65 0.00 77 R 9.17 4.32 0.00 1.84 2.06 0.00 3.14 0.00 0.00 3.03 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.69 0.00 78 K 7.88 4.19 0.00 1.76 1.74 0.00 1.69 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.43 1.55 7.81 79 P 0.00 4.90 0.00 2.12 1.96 0.00 3.61 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.10 0.00 80 I 8.51 4.91 2.04 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.34 0.99 0.00 0.00 81 R 9.06 5.02 0.00 1.87 1.81 0.00 3.06 0.00 0.00 3.17 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.75 0.00 82 R 8.55 4.88 0.00 1.92 1.80 0.00 3.22 0.00 0.00 3.17 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.60 0.00 83 P 0.00 3.93 0.00 2.03 2.16 0.00 3.68 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.13 0.00 84 D 8.03 4.59 0.00 2.78 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 85 G 8.92 4.15 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 0.00 86 T 7.42 4.01 4.33 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 1.19 0.00 0.00 87 R 8.44 5.05 0.00 1.67 1.84 0.00 3.32 0.00 0.00 3.15 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.55 0.00 88 V 8.82 4.49 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 0.90 0.00 0.00 89 K 8.42 4.98 0.00 1.98 1.71 0.00 1.60 0.00 0.00 1.70 0.00 0.00 2.76 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.23 1.40 7.81 90 F 8.82 4.72 0.00 3.31 3.06 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 91 E 9.04 4.17 0.00 1.97 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.26 0.00 92 D 7.75 4.75 0.00 2.68 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 93 N 8.68 5.24 0.00 2.62 2.71 0.00 0.00 6.47 7.53 0.00 0.00 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 A 8.88 5.23 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 A 9.06 5.00 1.14 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 0.00 0.00 96 V 8.33 4.60 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 0.96 0.00 0.00 0.90 0.00 0.00 97 I 8.34 4.29 1.83 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 1.07 0.77 0.90 0.00 0.00 98 V 8.50 4.86 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 0.72 0.00 0.00 0.82 0.00 0.00 99 D 8.20 4.89 0.00 2.97 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 0.00 100 E 8.81 3.94 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 2.32 2.34 0.00 101 N 8.88 4.60 0.00 2.93 2.86 0.00 0.00 7.15 7.53 0.00 0.00 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 E 8.18 3.86 0.00 2.29 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.34 0.00 103 D 8.23 4.88 0.00 2.91 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 0.00 104 P 0.00 4.68 0.00 2.15 2.04 0.00 3.77 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.96 0.00 105 R 8.48 3.89 0.00 1.80 1.97 0.00 3.23 0.00 0.00 3.21 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.56 0.00 106 G 7.69 3.99 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 0.00 0.00 0.00 107 T 8.72 4.28 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 1.21 0.00 0.00 108 E 8.12 4.85 0.00 1.86 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.29 0.00 109 L 8.49 4.94 0.00 1.50 1.56 0.97 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 110 K 8.53 4.38 0.00 1.64 1.72 0.00 1.74 0.00 0.00 1.70 0.00 0.00 2.95 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.39 1.36 7.81 111 G 8.88 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 0.00 112 P 0.00 4.87 0.00 2.25 2.14 0.00 3.77 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 2.18 2.12 0.00 113 I 8.53 4.71 1.90 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.66 0.92 0.00 0.00 114 A 7.94 5.20 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 0.00 115 R 9.26 3.95 0.00 1.99 2.26 0.00 2.81 0.00 0.00 3.19 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.66 0.00 116 E 8.30 4.01 0.00 2.13 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 2.43 2.58 0.00 117 V 8.03 3.81 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 1.29 0.00 0.00 1.01 0.00 0.00 118 A 7.58 4.03 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 0.00 119 Q 7.36 4.09 0.00 2.33 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.91 0.00 0.00 0.00 0.00 0.00 2.39 2.42 0.00 120 R 7.73 3.93 0.00 1.39 0.66 0.00 3.09 0.00 0.00 3.00 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.52 0.00 121 F 8.08 4.71 0.00 3.11 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 0.00 122 G 8.63 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 0.00 123 S 8.07 4.53 0.00 4.08 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 0.00 124 V 7.83 3.57 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 1.02 0.00 0.00 0.88 0.00 0.00 125 A 8.11 4.22 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.81 4.63 0.00 4.03 4.15 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 0.00 127 A 8.47 4.63 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 0.00 128 A 7.26 4.23 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 0.00 129 T 8.43 4.32 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 1.22 0.00 0.00 130 M 7.72 4.94 0.00 1.94 1.92 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.56 0.00 131 I 8.44 4.95 1.90 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.63 0.95 0.00 0.00 132 V 9.15 4.07 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 0.92 0.00 0.00 0.98 0.00 0.00