NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.5810 8.3001 118.1953 55.1335 32.5892 174.2614 2 A 4.4709 8.7591 122.1179 49.3360 21.8749 170.8510 3 V 3.9367 9.1132 123.1106 61.9721 33.0010 174.0634 4 L 4.4478 8.4977 128.2646 53.4334 43.0918 176.2601 5 E 4.0703 8.4914 122.8713 55.9909 30.2889 175.6140 6 I 4.1998 8.1236 127.0890 60.0633 38.0584 175.5332 7 I 3.8919 8.8198 127.9608 61.3487 37.3325 175.9769 8 K 4.4410 8.4375 126.3470 55.0565 33.7381 175.7917 9 H 3.9421 8.5029 124.6372 56.1481 29.7878 172.6771 10 P 4.7359 0.0000 0.0000 60.6712 34.0913 173.7059 11 N 4.2102 7.9079 113.3859 53.0802 41.8283 175.3288 12 E 4.0564 8.4997 125.6358 59.2636 30.0857 179.4997 13 V 3.7011 7.8496 118.1145 64.5016 31.4604 178.2120 14 L 4.1131 7.6904 119.5550 56.9001 41.5341 177.5277 15 E 4.7850 7.8759 115.5924 55.4955 29.6790 175.2948 16 T 4.5656 7.5120 117.0830 61.4153 69.2367 173.2633 17 P 4.4159 0.0000 0.0000 63.2639 32.0477 175.6526 18 C 4.7430 8.4757 119.8230 58.8093 29.8106 173.5320 19 E 4.3354 8.6898 121.4597 55.9003 30.5831 176.7185 20 R 4.4720 8.3790 121.1311 56.1086 31.1166 176.6963 21 V 3.6569 8.8603 123.1229 62.7649 32.0678 175.9012 22 I 4.2677 8.1547 126.6208 61.4670 39.2899 175.3015 23 N 4.8721 7.7939 117.2989 51.6690 39.6332 175.2837 24 F 4.3765 8.7248 124.3828 55.5602 38.1148 174.3928 25 D 5.1448 7.5535 124.5499 50.8461 42.5490 177.8777 26 K 4.0534 8.4603 116.9740 59.5033 31.7782 179.2959 27 K 3.9701 8.0798 119.7966 59.0341 32.1616 178.5777 28 L 3.8979 8.2244 120.9233 58.0444 42.0321 179.0786 29 V 3.6075 7.6921 117.9462 65.9375 31.4034 177.9190 30 K 3.9453 8.2781 119.4944 59.1805 31.9096 178.4469 31 L 3.9337 8.0920 120.7757 58.2817 42.0455 179.0706 32 L 4.0137 8.0558 118.8022 57.6609 41.4015 179.7044 33 K 4.0103 8.2442 118.4826 59.6649 32.0098 179.2012 34 D 4.3848 8.4838 119.5242 57.5312 40.6767 178.7560 35 M 4.0514 8.4071 119.6237 58.6325 31.9639 178.2760 36 H 4.1675 8.3525 118.3131 59.4238 30.0178 177.2298 37 E 3.9711 8.0505 120.4914 59.4376 29.3090 179.2788 38 T 3.8482 8.0655 115.9749 66.7567 68.4292 176.1400 39 M 3.9861 8.4039 120.3520 58.8281 32.2124 178.3593 40 L 3.9628 7.8158 119.0273 57.8133 41.5390 179.5212 41 I 3.6879 8.0319 119.1673 63.8735 37.0640 177.2928 42 A 4.3638 7.5961 118.5099 51.0958 18.7733 176.3474 43 D 4.3174 8.1398 116.5569 55.5250 40.1818 173.8578 44 G 4.1471 8.1236 105.2125 44.0982 0.0000 174.7140 45 V 4.3735 8.1995 111.0613 61.1069 33.7448 175.7594 46 G 4.4492 7.7802 106.0039 44.4731 0.0000 172.0838 47 L 4.9176 8.8862 122.6804 53.6089 46.1652 174.3551 48 A 5.0665 9.0239 128.0567 49.7958 21.9261 176.9631 49 A 4.0089 8.9523 123.4579 54.9689 18.3912 178.8683 50 P 4.3578 0.0000 0.0000 65.3645 31.1988 178.2824 51 Q 4.2011 8.3169 117.2492 57.3917 28.2843 177.5209 52 V 4.5792 6.9776 112.4274 60.1770 32.1545 176.3864 53 G 3.8022 8.2182 106.4372 45.7227 0.0000 174.0052 54 V 4.2072 7.4870 119.4257 60.9950 33.6460 176.1643 55 S 4.7876 8.3697 127.9464 57.9524 60.7873 173.1939 56 L 5.1561 7.3611 118.8261 52.8376 45.7408 179.2453 57 Q 4.3531 8.5877 121.4378 55.0080 27.4951 173.7968 58 V 4.7952 7.6569 120.1612 61.0194 35.4683 173.5588 59 A 5.2681 9.0621 128.2752 50.7569 23.5229 174.8170 60 V 4.9905 8.8948 117.6925 60.3885 35.2144 174.8736 61 V 4.9339 8.5413 114.8497 60.2314 36.2364 174.8773 62 D 4.3287 9.1670 123.0280 54.9318 42.2855 174.5295 63 V 4.1470 8.5759 118.0123 62.3250 33.9105 176.3255 64 D 4.7154 7.7516 119.4108 54.1265 42.3065 177.6820 65 D 4.4170 8.6393 122.0815 57.4262 41.3215 177.9069 66 D 4.4819 8.2282 117.6497 56.8819 39.3246 177.7913 67 T 3.8278 7.6937 115.8132 65.3583 69.0654 176.3339 68 G 3.7666 8.4794 109.4642 44.0406 0.0000 171.8826 69 K 4.2990 8.3901 121.0222 56.5277 33.1753 177.8327 70 I 4.4256 8.8817 128.2200 59.6170 39.9147 174.2573 71 E 4.9057 8.7738 127.0156 55.3527 31.0405 176.1073 72 L 4.9547 9.1406 123.8221 53.1038 45.1752 175.4379 73 I 4.8778 8.4579 124.6936 59.9892 40.2956 175.8157 74 N 4.4897 9.1273 123.6439 52.3944 36.7356 172.9663 75 P 4.8441 0.0000 0.0000 63.0070 32.7081 176.5463 76 S 4.7363 9.1223 115.8164 56.8630 66.9480 172.6458 77 I 4.5374 8.2880 122.5818 60.4880 37.3511 175.6131 78 L 4.4129 9.0128 128.0702 56.6304 42.6754 177.1014 79 E 4.9014 7.8541 116.2858 54.9892 34.1975 174.5031 80 K 5.1920 8.5922 120.9803 55.0816 36.3002 175.9505 81 R 4.6139 9.2150 122.1726 55.7112 35.1679 176.1241 82 G 4.3246 9.1783 110.8190 45.1657 0.0000 171.7432 83 E 5.3621 8.2712 116.6387 54.6953 33.5179 175.3645 84 Q 4.6563 9.1377 119.1360 54.6858 32.4460 173.7362 85 V 4.6738 8.1893 121.3453 61.1279 34.3758 174.6209 86 G 4.2143 8.0625 113.3034 45.2518 0.0000 170.2861 87 P 5.3290 0.0000 0.0000 62.9765 32.2487 175.6657 88 E 4.8184 9.6825 122.3009 54.8619 33.5633 174.3337 89 G 4.1494 8.1735 111.4276 45.0544 0.0000 170.8232 90 C 4.5775 7.7267 116.1777 58.0604 34.2456 174.9303 91 L 4.0139 8.6641 126.8795 57.6514 41.5075 178.2330 92 S 4.5166 8.1840 113.1968 59.5526 63.7679 173.3974 93 F 4.9990 8.4097 119.8915 53.8427 38.9407 171.5383 94 P 4.3477 0.0000 0.0000 64.4410 31.4591 177.9420 95 G 4.0237 8.8708 109.9926 45.4387 0.0000 172.4637 96 L 4.6098 7.7698 122.9338 53.8272 42.8569 174.6738 97 Y 5.3852 8.8049 122.7072 56.5425 42.2875 174.5437 98 G 4.3465 9.5493 109.0903 44.5284 0.0000 170.9917 99 E 5.0352 8.7043 122.3827 54.9982 30.7760 175.6231 100 V 4.6548 8.9210 126.2626 61.0939 35.2787 173.4423 101 E 4.8357 8.8310 128.3603 55.3488 30.7163 175.1018 102 R 4.8960 8.9360 124.4684 53.8105 34.9667 174.5906 103 A 4.4603 8.6119 122.4426 52.6895 18.6458 177.3391 104 D 4.5712 8.8356 120.0020 55.8579 42.9428 175.6317 105 Y 5.3253 8.5705 119.8425 55.6169 41.7387 174.7673 106 I 4.8439 8.0682 118.5219 58.8979 41.9516 173.6210 107 K 4.7530 8.6925 124.9250 54.6185 34.7534 174.8151 108 V 4.8568 9.2205 127.7943 61.0196 34.8311 173.8504 109 R 5.0346 8.7394 127.2788 54.6321 32.4511 174.5377 110 A 4.5887 7.9352 126.3239 51.3286 23.6173 174.4039 111 Q 4.9732 9.0659 117.9178 54.3488 32.2810 176.2649 112 N 5.3571 8.6764 119.4574 51.3624 39.6546 175.8049 113 R 4.0434 8.7196 116.2115 59.5254 29.9883 177.9346 114 R 4.2224 8.2075 113.7274 56.1453 30.5089 177.0753 115 G 2.6201 7.9210 107.0454 44.1636 0.0000 173.8206 116 K 4.1459 7.9516 120.1162 55.9215 33.3801 176.3610 117 V 4.3492 8.2548 124.8351 62.3216 32.4444 174.8855 118 F 5.1979 8.6078 122.1775 55.0530 41.8299 173.3959 119 L 5.3367 8.7384 118.5952 52.9612 44.2602 175.9176 120 L 4.8714 9.3252 124.8222 53.3823 45.6228 174.6306 121 E 5.1180 8.9394 124.6120 54.6766 31.8775 175.0523 122 A 4.8076 8.5355 124.0961 50.7224 23.5436 174.5058 123 E 5.5845 7.7474 117.1913 53.5604 34.6937 176.9179 124 G 3.7832 8.8644 109.6639 47.5026 0.0000 176.3965 125 F 4.2383 8.9713 121.7897 61.2001 39.2731 176.7012 126 L 3.7732 7.9982 119.3063 58.0491 41.9706 178.6686 127 A 3.9563 7.8744 120.3347 54.8603 18.2566 179.6221 128 R 3.7443 8.2036 117.4829 59.5118 30.1277 178.5277 129 A 3.7760 7.7594 120.7671 55.2113 18.2545 179.6957 130 I 3.6250 7.7306 118.1553 64.6243 37.1976 178.6772 131 Q 3.9751 8.1889 118.9519 59.1681 28.5837 178.4322 132 H 4.0991 8.3333 119.1980 59.4161 30.0482 177.2818 133 E 4.1731 8.5330 120.5949 59.3776 29.3689 179.3989 134 I 3.8694 8.0530 120.1432 64.3492 37.0559 177.9644 135 D 4.4224 8.2103 119.7779 57.9493 40.6929 178.5058 136 H 4.2379 8.0473 115.9241 59.1314 28.7410 177.4357 137 L 4.2336 7.9907 119.2915 56.5795 41.0974 177.9738 138 H 4.8277 8.0208 115.4599 55.2494 28.9918 174.5921 139 G 3.8866 8.2590 107.2205 46.1288 0.0000 173.2943 140 V 4.4248 7.7383 118.4526 60.6446 33.3264 174.9590 141 L 4.8387 8.0971 126.4034 52.6763 44.0933 177.5136 142 F 4.2270 8.8675 117.1196 60.1103 37.8224 177.6975 143 T 3.1783 7.0007 110.0647 64.1432 68.0999 175.8658 144 S 4.3044 7.8678 115.6591 59.7238 63.2806 174.7009 145 K 4.4185 7.6452 120.3012 55.7389 33.0974 176.3186 146 V 3.7282 7.0299 119.5734 63.0116 31.7737 175.6839 147 T 4.3684 8.1772 117.3848 63.3368 70.2444 175.2289 148 R 4.3791 7.1614 115.4082 55.2916 32.2069 173.9298 149 Y 4.5442 8.3900 118.9934 56.9873 39.7427 174.7256 150 Y 4.6407 8.1145 119.0395 56.9011 40.0182 176.0154 151 E 4.2074 8.8156 118.9587 56.7715 29.9174 176.6900 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 4.58 0.00 2.13 2.15 0.00 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.61 0.00 2 A 8.76 4.47 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 3 V 9.11 3.94 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 0.83 0.00 0.00 0.93 0.00 0.00 4 L 8.50 4.45 0.00 1.64 1.56 0.92 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 5 E 8.49 4.07 0.00 1.99 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 0.00 2.36 2.31 0.00 6 I 8.12 4.20 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 1.40 0.68 0.95 0.00 0.00 7 I 8.82 3.89 1.90 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 1.37 0.71 0.90 0.00 0.00 8 K 8.44 4.44 0.00 1.56 1.62 0.00 1.73 0.00 0.00 1.59 0.00 0.00 2.84 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.35 1.33 7.81 9 H 8.50 3.94 0.00 1.40 2.26 0.00 5.89 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 P 0.00 4.74 0.00 2.03 1.65 0.00 3.76 0.00 0.00 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.78 0.00 11 N 7.91 4.21 0.00 2.77 2.60 0.00 0.00 7.06 7.65 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 12 E 8.50 4.06 0.00 2.06 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 0.00 2.40 2.29 0.00 13 V 7.85 3.70 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 0.97 0.00 0.00 14 L 7.69 4.11 0.00 1.81 1.88 0.86 1.32 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 15 E 7.88 4.79 0.00 1.99 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.27 0.00 16 T 7.51 4.57 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 1.21 0.00 0.00 17 P 0.00 4.42 0.00 2.09 2.23 0.00 3.76 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.02 0.00 18 C 8.48 4.74 0.00 2.95 2.85 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 19 E 8.69 4.34 0.00 1.88 1.83 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 2.31 2.41 0.00 20 R 8.38 4.47 0.00 1.68 1.86 0.00 3.21 0.00 0.00 3.16 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.63 0.00 21 V 8.86 3.66 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 -0.28 0.00 0.00 0.77 0.00 0.00 22 I 8.15 4.27 1.82 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 1.41 0.90 0.92 0.00 0.00 23 N 7.79 4.87 0.00 2.60 2.72 0.00 0.00 6.84 7.45 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 24 F 8.72 4.38 0.00 3.04 3.29 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 25 D 7.55 5.14 0.00 2.88 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 26 K 8.46 4.05 0.00 1.87 1.91 0.00 1.56 0.00 0.00 1.76 0.00 0.00 3.03 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.54 1.57 7.81 27 K 8.08 3.97 0.00 1.81 1.93 0.00 1.71 0.00 0.00 1.72 0.00 0.00 2.87 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.49 1.48 7.81 28 L 8.22 3.90 0.00 1.82 1.86 0.84 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 29 V 7.69 3.61 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 0.96 0.00 0.00 1.00 0.00 0.00 30 K 8.28 3.95 0.00 1.87 1.92 0.00 1.70 0.00 0.00 1.57 0.00 0.00 2.90 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.55 1.45 7.81 31 L 8.09 3.93 0.00 1.86 1.84 0.91 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 32 L 8.06 4.01 0.00 1.89 1.89 1.03 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 33 K 8.24 4.01 0.00 1.95 1.87 0.00 1.68 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.47 1.64 7.81 34 D 8.48 4.38 0.00 2.84 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 35 M 8.41 4.05 0.00 2.05 2.31 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.75 2.55 0.00 36 H 8.35 4.17 0.00 3.19 3.31 0.00 5.58 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 37 E 8.05 3.97 0.00 1.97 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 2.55 2.51 0.00 38 T 8.07 3.85 4.41 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 1.25 0.00 0.00 39 M 8.40 3.99 0.00 2.17 2.10 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.72 0.00 40 L 7.82 3.96 0.00 1.68 1.66 0.81 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 41 I 8.03 3.69 2.04 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 1.45 0.58 0.91 0.00 0.00 42 A 7.60 4.36 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 D 8.14 4.32 0.00 2.82 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 44 G 8.12 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 45 V 8.20 4.37 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 0.92 0.00 0.00 0.89 0.00 0.00 46 G 7.78 4.45 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 0.00 47 L 8.89 4.92 0.00 1.75 1.46 0.94 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 48 A 9.02 5.07 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 A 8.95 4.01 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 P 0.00 4.36 0.00 2.28 2.33 0.00 3.76 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.08 0.00 51 Q 8.32 4.20 0.00 2.24 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.88 0.00 0.00 0.00 0.00 0.00 2.29 2.18 0.00 52 V 6.98 4.58 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 0.79 0.00 0.00 1.01 0.00 0.00 53 G 8.22 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 V 7.49 4.21 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 1.00 0.00 0.00 0.91 0.00 0.00 55 S 8.37 4.79 0.00 3.80 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 56 L 7.36 5.16 0.00 1.43 1.46 0.86 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 57 Q 8.59 4.35 0.00 2.17 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.77 0.00 0.00 0.00 0.00 0.00 2.28 2.42 0.00 58 V 7.66 4.80 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 1.04 0.00 0.00 0.89 0.00 0.00 59 A 9.06 5.27 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 60 V 8.89 4.99 2.12 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 0.81 0.00 0.00 1.03 0.00 0.00 61 V 8.54 4.93 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 0.70 0.00 0.00 0.98 0.00 0.00 62 D 9.17 4.33 0.00 2.70 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 V 8.58 4.15 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 0.99 0.00 0.00 64 D 7.75 4.72 0.00 2.69 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 D 8.64 4.42 0.00 2.67 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 66 D 8.23 4.48 0.00 2.78 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 67 T 7.69 3.83 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 1.20 0.00 0.00 68 G 8.48 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 69 K 8.39 4.30 0.00 1.69 1.65 0.00 1.49 0.00 0.00 1.26 0.00 0.00 2.63 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.35 1.37 7.81 70 I 8.88 4.43 1.87 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 1.16 0.73 0.93 0.00 0.00 71 E 8.77 4.91 0.00 1.92 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 2.29 2.33 0.00 72 L 9.14 4.95 0.00 1.59 1.59 0.96 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 73 I 8.46 4.88 2.22 0.00 0.00 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 1.29 0.84 1.00 0.00 0.00 74 N 9.13 4.49 0.00 2.94 2.86 0.00 0.00 6.98 7.73 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 75 P 0.00 4.84 0.00 2.07 2.04 0.00 3.71 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.98 0.00 76 S 9.12 4.74 0.00 3.81 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 77 I 8.29 4.54 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 1.31 0.58 0.97 0.00 0.00 78 L 9.01 4.41 0.00 1.50 1.73 0.92 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 79 E 7.85 4.90 0.00 1.99 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 2.35 2.38 0.00 80 K 8.59 5.19 0.00 1.61 1.68 0.00 1.73 0.00 0.00 1.71 0.00 0.00 2.70 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.33 1.46 7.81 81 R 9.22 4.61 0.00 1.77 1.76 0.00 3.36 0.00 0.00 3.20 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.63 0.00 82 G 9.18 4.32 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 0.00 83 E 8.27 5.36 0.00 1.82 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 2.22 2.31 0.00 84 Q 9.14 4.66 0.00 2.11 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.76 0.00 0.00 0.00 0.00 0.00 2.53 2.34 0.00 85 V 8.19 4.67 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 0.85 0.00 0.00 0.95 0.00 0.00 86 G 8.06 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 0.00 0.00 0.00 0.00 87 P 0.00 5.33 0.00 2.09 1.84 0.00 3.76 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.84 0.00 88 E 9.68 4.82 0.00 2.17 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.29 0.00 89 G 8.17 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 90 C 7.73 4.58 0.00 2.37 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 91 L 8.66 4.01 0.00 1.69 1.73 0.92 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 92 S 8.18 4.52 0.00 4.04 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 F 8.41 5.00 0.00 3.17 3.08 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 94 P 0.00 4.35 0.00 2.20 2.12 0.00 3.93 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.00 0.00 95 G 8.87 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 96 L 7.77 4.61 0.00 1.88 1.86 0.81 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 97 Y 8.80 5.39 0.00 3.22 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 98 G 9.55 4.35 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 0.00 99 E 8.70 5.04 0.00 1.83 1.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.19 0.00 100 V 8.92 4.65 2.30 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 0.98 0.00 0.00 1.11 0.00 0.00 101 E 8.83 4.84 0.00 2.02 1.83 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 2.25 2.49 0.00 102 R 8.94 4.90 0.00 1.74 1.93 0.00 3.36 0.00 0.00 3.19 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.72 0.00 103 A 8.61 4.46 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 0.00 104 D 8.84 4.57 0.00 2.93 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 0.00 105 Y 8.57 5.33 0.00 3.11 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 0.00 106 I 8.07 4.84 1.72 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.53 0.84 0.00 0.00 107 K 8.69 4.75 0.00 1.86 1.68 0.00 1.62 0.00 0.00 1.62 0.00 0.00 2.95 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.32 1.37 7.81 108 V 9.22 4.86 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 0.92 0.00 0.00 0.89 0.00 0.00 109 R 8.74 5.03 0.00 1.84 1.68 0.00 3.13 0.00 0.00 3.13 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.45 0.00 110 A 7.94 4.59 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 Q 9.07 4.97 0.00 2.04 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.08 6.56 0.00 0.00 0.00 0.00 0.00 2.22 2.16 0.00 112 N 8.68 5.36 0.00 3.06 3.25 0.00 0.00 7.20 7.17 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 0.00 113 R 8.72 4.04 0.00 1.88 2.15 0.00 3.23 0.00 0.00 3.26 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.88 0.00 114 R 8.21 4.22 0.00 1.87 1.90 0.00 3.19 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 1.59 1.63 0.00 115 G 7.92 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 0.00 0.00 0.00 116 K 7.95 4.15 0.00 1.83 1.74 0.00 1.61 0.00 0.00 1.52 0.00 0.00 2.81 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.38 1.51 7.81 117 V 8.25 4.35 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 0.00 0.00 0.84 0.00 0.00 118 F 8.61 5.20 0.00 3.06 3.10 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 0.00 119 L 8.74 5.34 0.00 1.59 1.65 0.95 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 120 L 9.33 4.87 0.00 1.87 1.62 0.92 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 121 E 8.94 5.12 0.00 1.93 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 2.27 2.34 0.00 122 A 8.54 4.81 1.13 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 0.00 0.00 123 E 7.75 5.58 0.00 1.94 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.30 0.00 124 G 8.86 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 0.00 0.00 0.00 125 F 8.97 4.24 0.00 3.12 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 L 8.00 3.77 0.00 1.81 1.79 0.89 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 127 A 7.87 3.96 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 0.00 128 R 8.20 3.74 0.00 1.87 1.94 0.00 3.24 0.00 0.00 3.26 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.75 0.00 129 A 7.76 3.78 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 I 7.73 3.62 1.95 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 1.51 0.64 0.90 0.00 0.00 131 Q 8.19 3.98 0.00 2.22 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.81 0.00 0.00 0.00 0.00 0.00 2.36 2.45 0.00 132 H 8.33 4.10 0.00 3.27 3.47 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 0.00 133 E 8.53 4.17 0.00 2.04 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 0.00 2.57 2.51 0.00 134 I 8.05 3.87 1.89 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 1.54 1.36 0.97 0.00 0.00 135 D 8.21 4.42 0.00 2.84 2.87 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 0.00 136 H 8.05 4.24 0.00 3.45 3.36 0.00 5.62 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 L 7.99 4.23 0.00 1.76 1.60 0.91 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 138 H 8.02 4.83 0.00 3.22 3.29 0.00 5.73 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 0.00 139 G 8.26 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 V 7.74 4.42 2.21 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 0.85 0.00 0.00 1.00 0.00 0.00 141 L 8.10 4.84 0.00 1.80 1.75 1.19 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 142 F 8.87 4.23 0.00 3.41 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 0.00 143 T 7.00 3.18 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 0.14 0.00 0.00 144 S 7.87 4.30 0.00 4.02 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 0.00 145 K 7.65 4.42 0.00 1.68 1.80 0.00 1.70 0.00 0.00 1.62 0.00 0.00 2.91 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.32 1.29 7.81 146 V 7.03 3.73 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.33 0.00 0.00 0.49 0.00 0.00 147 T 8.18 4.37 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 1.14 0.00 0.00 148 R 7.16 4.38 0.00 1.70 1.87 0.00 2.86 0.00 0.00 3.24 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.26 0.00 149 Y 8.39 4.54 0.00 2.84 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 150 Y 8.11 4.64 0.00 3.14 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 0.00 151 E 8.82 4.21 0.00 2.13 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 2.37 2.37 0.00