NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 G 3.9941 8.3549 109.7429 45.9864 0.0000 173.5807 5 S 4.5428 8.5472 113.8214 59.0014 64.0268 174.3681 6 R 3.8403 8.3956 120.6998 59.2192 30.6738 177.7498 7 R 3.7145 7.9739 116.5660 58.5404 30.0283 176.2839 8 Y 4.5196 7.9624 113.0462 57.3894 38.4749 174.8703 9 D 4.5918 7.7616 120.8478 53.6300 40.9808 176.5858 10 S 4.1648 8.7318 123.4228 59.4965 63.7169 174.3284 11 R 3.8157 8.4352 119.6324 56.8894 27.4905 177.6372 12 T 4.0478 7.9420 106.7685 63.9678 69.1658 174.7010 13 T 4.5327 7.4702 113.0498 61.3883 69.0775 173.6750 14 I 4.3705 7.6444 113.6544 59.9905 40.4856 174.6041 15 F 4.8235 8.3362 119.4585 56.7576 39.9462 175.9494 16 S 4.9666 8.4312 117.6984 55.6188 64.2789 173.5935 17 P 3.7002 0.0000 0.0000 65.4365 31.0690 177.2199 18 E 4.2281 8.1180 115.2488 55.9245 29.7035 176.1580 19 G 3.4747 8.8549 108.1299 46.6604 0.0000 173.8795 20 R 4.6021 7.9463 117.3950 54.1213 32.8613 175.8255 21 L 4.4699 7.6884 120.0059 54.0432 41.7598 177.6498 22 Y 3.4155 7.0266 117.5092 60.2815 38.2304 177.8257 23 Q 3.9830 8.0246 118.5861 59.2318 29.1181 179.4254 24 V 3.5650 7.6247 118.5394 66.0018 31.5991 177.5277 25 E 3.9485 8.2124 118.3968 59.9165 29.3924 178.9856 26 Y 4.4354 8.3098 116.5316 61.1042 37.9261 178.6136 27 A 4.0705 8.7967 122.3204 55.2987 18.4980 179.5893 28 L 3.9155 8.1243 117.4222 58.0102 41.4940 179.1577 29 E 3.9333 8.1224 118.0438 59.5175 29.7530 178.6649 30 S 4.3127 8.1642 112.8288 61.6297 62.5093 176.2800 31 I 3.7831 7.7543 122.5915 64.0812 36.5641 178.1688 32 S 4.2254 7.9314 113.9047 60.4088 62.7842 174.4669 33 H 4.7251 7.8259 118.1117 55.4354 29.1330 174.3896 34 A 4.4619 7.8495 123.3133 50.4961 19.7365 177.5242 35 G 4.2413 8.4640 106.8899 46.1328 0.0000 173.4286 36 T 4.3583 8.6183 119.7541 63.1943 69.9424 173.2473 37 A 5.1706 8.5264 126.5120 50.1894 21.8220 175.3272 38 I 4.5959 9.7691 123.4973 59.2958 41.2426 174.8784 39 G 4.4081 8.7238 112.1939 44.5195 0.0000 171.8320 40 I 4.7242 8.7954 125.9159 59.5521 40.9306 174.1995 41 M 4.8961 8.8096 125.9147 53.9547 33.8811 174.9578 42 A 4.7063 8.8124 129.9004 50.0245 21.4086 177.4842 43 S 4.1726 8.7146 114.2744 60.9792 62.7883 175.2708 44 D 4.8290 8.6504 117.6070 51.0470 39.4802 175.7072 45 G 4.0536 6.4763 109.3687 46.3142 0.0000 171.4706 46 I 5.0837 7.7662 118.9242 59.3157 40.9534 175.5849 47 V 4.5160 9.0763 123.7639 61.1128 34.8528 174.2473 48 L 5.2983 8.6242 125.9700 52.9465 44.3145 175.6760 49 A 4.8401 9.2437 125.3504 50.1314 22.3397 174.5512 50 A 4.7580 8.5005 121.9675 50.3389 23.0207 174.6870 51 E 4.4994 9.1153 121.0554 54.2191 31.6301 175.6371 52 R 4.1111 8.5724 126.6480 55.9823 30.3967 176.2864 53 K 3.9752 8.7300 124.8976 56.8789 32.9820 175.3486 54 V 3.0641 8.5529 123.6410 63.7668 30.5218 171.9792 55 T 4.7405 8.0790 114.4761 60.2787 72.1698 172.2080 56 S 4.6413 7.9876 114.7352 57.0308 65.7199 174.8579 57 T 4.0234 8.4550 119.5012 66.6005 68.2550 176.3893 58 L 4.0791 7.7907 119.7798 56.7568 42.0310 177.1480 59 L 3.7575 7.1693 119.2228 55.3580 41.0602 176.6341 60 E 4.1552 8.6574 126.9626 55.8216 28.6412 176.4529 61 Q 4.1958 8.4486 128.2563 58.5888 29.7782 178.0000 62 D 4.3497 8.1764 117.0740 57.6409 40.8745 177.2399 63 T 4.2269 7.2497 109.6463 63.9061 68.7124 174.5527 63A S 4.6609 7.2954 116.0698 57.4666 63.8691 173.8415 64 T 4.2033 7.8405 119.2351 63.1756 71.3285 173.2064 65 E 4.8051 8.6260 122.3276 55.5304 31.3819 176.0445 66 K 4.5119 7.5920 116.0662 56.5901 36.8378 175.6008 67 L 4.9807 7.5985 119.4605 53.2080 43.1644 175.8135 68 Y 4.8360 9.0845 122.2256 55.8551 41.5491 175.0594 69 K 4.5501 8.8626 124.8006 55.8009 33.2610 175.8573 70 L 4.4781 8.6782 125.8132 56.0088 43.2141 175.2156 71 N 5.0648 7.9123 116.2332 52.7985 40.8941 172.7421 72 D 4.7405 8.8012 113.5154 55.1303 42.2023 177.0151 73 K 4.7643 7.9733 116.3716 55.8462 34.3587 175.4554 74 I 5.2255 7.6444 120.3164 59.9335 41.6827 173.8731 75 A 5.1331 9.0831 126.1756 50.9864 23.2943 175.2966 76 V 5.0239 9.1494 111.5785 59.5620 36.5632 174.6043 77 A 5.2670 8.6973 124.2076 50.4089 21.3854 175.8344 78 V 4.6271 8.9620 122.4779 61.4676 34.1687 175.7531 79 A 4.2008 8.2281 126.9103 53.7410 21.3472 173.9459 80 G 3.7021 8.5960 113.3998 45.2060 0.0000 173.1915 81 L 4.1347 8.8890 126.6909 54.7596 41.7557 177.7266 82 T 3.8691 8.8863 121.3990 66.6900 68.3562 175.8591 83 A 4.0144 8.1328 121.9252 55.6186 18.1694 179.1474 84 D 4.4169 8.1775 116.1288 57.4936 40.9409 178.5014 85 A 4.0799 8.3049 121.5458 55.5028 18.3709 179.1007 86 E 3.6136 8.3364 116.9239 59.9368 29.2530 179.6011 87 I 3.7122 7.5204 119.0162 64.9196 37.2470 178.3631 88 L 3.9519 7.6739 119.1073 57.4813 41.4454 179.5484 89 I 3.5169 7.9734 120.3476 64.1826 37.0241 177.9433 90 N 4.2582 8.5383 118.5243 56.9625 38.7806 177.0942 91 T 3.9182 7.5971 109.5295 64.3960 68.7308 176.4759 92 A 3.9060 7.8399 123.8546 55.2386 18.3422 179.5701 93 R 3.8948 8.3215 117.0154 59.5557 30.0563 179.4188 94 I 3.6943 7.8603 119.2700 64.7030 37.2240 177.5896 95 H 4.1182 8.4007 118.9996 59.5067 29.5278 176.6022 96 A 3.9235 8.0453 122.0477 55.4191 18.2389 179.4388 97 Q 3.9726 7.8109 116.2551 59.3484 28.7836 179.0073 98 N 4.2995 8.3589 117.3513 56.6197 38.5478 176.6189 99 Y 4.0819 8.1394 120.7214 60.6704 38.7264 178.1185 100 L 4.5604 8.0136 122.4337 57.7745 42.0733 178.8944 101 K 3.7154 8.4306 118.4548 59.6180 32.1084 178.6205 102 T 3.8178 7.9575 115.7087 65.9867 68.6170 175.7772 103 Y 4.4310 7.5792 115.0532 56.5265 38.9329 175.3533 104 N 4.3711 8.8779 116.9002 53.8101 37.1210 173.8421 105 E 4.8308 7.7847 114.3466 54.6386 33.8879 174.6837 106 D 4.7375 8.6467 121.9851 53.7720 41.4935 176.3103 107 I 2.4574 8.4845 123.8584 60.3474 38.4806 173.6476 108 P 4.0925 0.0000 0.0000 62.4543 31.9182 176.6538 109 V 3.3920 8.1574 123.0795 66.6261 31.2329 177.8846 110 E 3.7741 8.0647 117.9025 59.4819 29.4396 178.8601 111 I 3.5893 7.4138 119.1895 64.1275 37.0929 178.1902 112 L 3.9242 7.5550 120.6671 58.1513 42.0416 178.9625 113 V 2.9490 7.4280 118.2110 65.7159 31.2606 178.0145 114 R 3.8144 8.1586 118.9198 59.0640 29.8978 178.4346 115 R 3.8032 7.7485 118.0616 59.4787 30.1503 178.3987 116 L 3.9319 7.7209 118.6802 58.0964 41.5804 179.8594 117 S 4.2375 8.0754 114.9699 61.6057 62.7051 176.4833 118 D 4.4187 8.2127 121.7739 57.3292 40.3097 178.7931 119 I 3.8156 7.5912 119.4425 64.3382 37.3894 178.3777 120 K 4.2368 7.9910 118.7419 59.6784 31.9906 178.9390 121 Q 4.0756 8.6633 120.2927 59.4733 28.7729 179.5056 122 G 3.5718 8.2583 106.3938 48.0872 0.0000 175.0438 123 Y 4.0384 8.1822 117.0763 59.5740 37.9307 177.7268 124 T 4.3415 7.6771 116.0286 63.8922 69.4006 174.8974 125 Q 4.4085 7.8252 120.0760 56.0924 30.8767 174.3634 126 H 4.6139 7.6395 110.2187 55.4856 29.4509 172.4167 127 G 3.9301 9.5485 109.4272 44.7996 0.0000 175.8058 128 G 3.8802 8.1463 105.2730 45.8838 0.0000 172.8048 129 L 4.7430 6.9850 118.1294 52.1456 44.1865 176.4844 130 R 4.1978 8.1447 116.4310 55.1380 30.2560 174.6916 131 P 4.5216 0.0000 0.0000 62.2169 32.2634 175.5956 132 F 4.4414 8.5618 118.3595 57.0609 40.3242 177.4361 133 G 4.0472 8.9519 115.4441 45.3590 0.0000 172.8604 134 V 4.9226 7.2838 117.0726 61.3465 35.3719 175.3213 135 S 4.6189 8.1764 120.4369 56.7244 66.9712 173.0374 136 F 4.9929 8.7264 121.4721 55.6402 42.2184 174.9343 137 I 4.4065 8.3059 122.7835 59.9235 39.4196 174.1159 138 Y 5.0365 8.7767 125.2519 56.6999 39.3001 175.0893 139 A 4.7480 9.1574 126.7190 50.3365 21.5224 175.2480 140 G 4.5449 8.4868 108.0279 45.9904 0.0000 171.1337 141 Y 4.9814 8.9540 121.1378 55.8132 41.7388 173.9299 142 D 4.5667 7.4450 124.1570 51.4254 42.7028 174.7489 143 D 4.3910 8.3749 117.1346 53.9081 39.7078 176.3921 144 R 4.0787 8.6074 126.4329 56.6249 29.9900 175.5444 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 4 G 8.35 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 5 S 8.55 4.54 0.00 4.04 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 6 R 8.40 3.84 0.00 1.84 1.95 0.00 3.16 0.00 0.00 3.25 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.65 0.00 7 R 7.97 3.71 0.00 1.54 1.04 0.00 2.58 0.00 0.00 2.98 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.37 0.00 8 Y 7.96 4.52 0.00 2.94 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 9 D 7.76 4.59 0.00 2.65 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 S 8.73 4.16 0.00 3.92 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 11 R 8.44 3.82 0.00 2.03 1.97 0.00 3.14 0.00 0.00 3.21 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.70 0.00 12 T 7.94 4.05 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 1.23 0.00 0.00 13 T 7.47 4.53 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 1.23 0.00 0.00 14 I 7.64 4.37 1.95 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 1.73 1.02 0.97 0.00 0.00 15 F 8.34 4.82 0.00 3.09 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 16 S 8.43 4.97 0.00 3.78 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 P 0.00 3.70 0.00 2.09 2.21 0.00 3.77 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 2.12 2.21 0.00 18 E 8.12 4.23 0.00 1.88 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 2.27 2.34 0.00 19 G 8.85 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 R 7.95 4.60 0.00 1.63 1.81 0.00 3.05 0.00 0.00 3.12 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.49 0.00 21 L 7.69 4.47 0.00 1.60 1.50 0.85 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 22 Y 7.03 3.42 0.00 2.85 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 Q 8.02 3.98 0.00 2.15 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.91 0.00 0.00 0.00 0.00 0.00 2.49 2.49 0.00 24 V 7.62 3.56 2.20 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 1.08 0.00 0.00 0.92 0.00 0.00 25 E 8.21 3.95 0.00 1.97 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 2.33 2.39 0.00 26 Y 8.31 4.44 0.00 2.93 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 27 A 8.80 4.07 1.44 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 28 L 8.12 3.92 0.00 1.98 1.75 0.93 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 29 E 8.12 3.93 0.00 2.05 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 0.00 2.37 2.45 0.00 30 S 8.16 4.31 0.00 3.99 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 31 I 7.75 3.78 1.96 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 1.55 0.70 0.94 0.00 0.00 32 S 7.93 4.23 0.00 3.95 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 33 H 7.83 4.73 0.00 3.28 3.34 0.00 5.64 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 34 A 7.85 4.46 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 35 G 8.46 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 36 T 8.62 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 1.20 0.00 0.00 37 A 8.53 5.17 1.16 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 38 I 9.77 4.60 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 1.16 0.84 0.91 0.00 0.00 39 G 8.72 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 0.00 0.00 0.00 0.00 40 I 8.80 4.72 1.88 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 1.12 0.71 0.92 0.00 0.00 41 M 8.81 4.90 0.00 2.01 1.97 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.48 0.00 42 A 8.81 4.71 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 43 S 8.71 4.17 0.00 4.00 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 44 D 8.65 4.83 0.00 2.76 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 45 G 6.48 4.05 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 0.00 0.00 0.00 46 I 7.77 5.08 1.91 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.77 0.98 0.00 0.00 47 V 9.08 4.52 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 0.98 0.00 0.00 0.93 0.00 0.00 48 L 8.62 5.30 0.00 1.52 1.53 0.94 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 49 A 9.24 4.84 1.18 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 50 A 8.50 4.76 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 51 E 9.12 4.50 0.00 1.99 1.81 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 2.21 2.26 0.00 52 R 8.57 4.11 0.00 1.83 1.87 0.00 3.24 0.00 0.00 3.14 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.59 0.00 53 K 8.73 3.98 0.00 1.71 1.70 0.00 1.93 0.00 0.00 1.64 0.00 0.00 2.99 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.42 1.42 7.81 54 V 8.55 3.06 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 0.84 0.00 0.00 0.93 0.00 0.00 55 T 8.08 4.74 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 1.20 0.00 0.00 56 S 7.99 4.64 0.00 3.82 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 T 8.46 4.02 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 58 L 7.79 4.08 0.00 1.61 1.73 0.92 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 59 L 7.17 3.76 0.00 1.63 1.76 0.92 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 60 E 8.66 4.16 0.00 2.09 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 2.37 2.35 0.00 61 Q 8.45 4.20 0.00 2.12 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.49 6.68 0.00 0.00 0.00 0.00 0.00 2.41 2.37 0.00 62 D 8.18 4.35 0.00 2.68 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 T 7.25 4.23 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 1.22 0.00 0.00 63A S 7.30 4.66 0.00 3.98 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 64 T 7.84 4.20 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.62 0.00 0.00 65 E 8.63 4.81 0.00 2.04 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 2.12 2.26 0.00 66 K 7.59 4.51 0.00 1.59 1.76 0.00 1.73 0.00 0.00 1.77 0.00 0.00 2.94 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.40 1.41 7.81 67 L 7.60 4.98 0.00 1.34 1.49 0.88 0.75 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 68 Y 9.08 4.84 0.00 2.85 2.78 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 69 K 8.86 4.55 0.00 1.75 1.77 0.00 1.78 0.00 0.00 1.73 0.00 0.00 2.95 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.49 1.50 7.81 70 L 8.68 4.48 0.00 1.80 1.69 0.92 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 71 N 7.91 5.06 0.00 2.64 2.77 0.00 0.00 7.23 7.76 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 72 D 8.80 4.74 0.00 2.72 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 73 K 7.97 4.76 0.00 1.73 2.07 0.00 1.73 0.00 0.00 2.24 0.00 0.00 2.90 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.49 1.49 7.81 74 I 7.64 5.23 1.89 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 1.29 1.01 0.96 0.00 0.00 75 A 9.08 5.13 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 76 V 9.15 5.02 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 0.38 0.00 0.00 1.02 0.00 0.00 77 A 8.70 5.27 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 78 V 8.96 4.63 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 0.62 0.00 0.00 1.33 0.00 0.00 79 A 8.23 4.20 1.16 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 80 G 8.60 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 81 L 8.89 4.13 0.00 1.65 1.65 0.93 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 82 T 8.89 3.87 4.29 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 1.34 0.00 0.00 83 A 8.13 4.01 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 D 8.18 4.42 0.00 2.98 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 85 A 8.30 4.08 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 E 8.34 3.61 0.00 2.11 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 2.00 2.47 0.00 87 I 7.52 3.71 2.17 0.00 0.00 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 1.80 1.51 1.04 0.00 0.00 88 L 7.67 3.95 0.00 1.88 1.57 0.62 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 89 I 7.97 3.52 1.77 0.00 0.00 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.70 0.75 0.00 0.00 90 N 8.54 4.26 0.00 2.74 2.78 0.00 0.00 7.00 7.23 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 91 T 7.60 3.92 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 92 A 7.84 3.91 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 R 8.32 3.89 0.00 1.98 2.01 0.00 3.11 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.84 0.00 94 I 7.86 3.69 2.04 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.75 0.94 0.00 0.00 95 H 8.40 4.12 0.00 3.29 3.53 0.00 5.80 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 96 A 8.05 3.92 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 Q 7.81 3.97 0.00 2.22 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.72 0.00 0.00 0.00 0.00 0.00 2.59 2.58 0.00 98 N 8.36 4.30 0.00 2.95 2.92 0.00 0.00 6.71 7.14 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 99 Y 8.14 4.08 0.00 3.08 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 0.00 100 L 8.01 4.56 0.00 1.92 1.92 1.11 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 101 K 8.43 3.72 0.00 1.86 1.89 0.00 1.83 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.41 1.46 7.81 102 T 7.96 3.82 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.34 0.00 0.00 103 Y 7.58 4.43 0.00 2.61 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 0.00 104 N 8.88 4.37 0.00 2.83 2.91 0.00 0.00 6.72 7.02 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 0.00 105 E 7.78 4.83 0.00 2.12 1.89 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 2.35 2.59 0.00 106 D 8.65 4.74 0.00 2.70 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 0.00 107 I 8.48 2.46 1.68 0.00 0.00 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 -0.32 0.77 0.00 0.00 108 P 0.00 4.09 0.00 1.96 1.78 0.00 2.66 0.00 0.00 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.89 0.00 109 V 8.16 3.39 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 0.93 0.00 0.00 0.87 0.00 0.00 110 E 8.06 3.77 0.00 1.97 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 2.28 2.31 0.00 111 I 7.41 3.59 1.76 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.62 0.75 0.00 0.00 112 L 7.55 3.92 0.00 1.56 1.67 0.87 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 113 V 7.43 2.95 1.87 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 0.20 0.00 0.00 0.21 0.00 0.00 114 R 8.16 3.81 0.00 1.92 1.96 0.00 3.13 0.00 0.00 3.08 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.59 0.00 115 R 7.75 3.80 0.00 1.89 1.99 0.00 3.12 0.00 0.00 2.97 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 1.57 0.00 116 L 7.72 3.93 0.00 1.80 1.73 0.71 0.70 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 0.00 117 S 8.08 4.24 0.00 4.00 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 0.00 118 D 8.21 4.42 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 0.00 119 I 7.59 3.82 2.00 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 1.56 0.67 0.96 0.00 0.00 120 K 7.99 4.24 0.00 2.06 1.95 0.00 1.81 0.00 0.00 1.65 0.00 0.00 3.01 0.00 0.00 3.22 0.00 0.00 0.00 0.00 1.41 1.55 7.81 121 Q 8.66 4.08 0.00 2.20 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.81 0.00 0.00 0.00 0.00 0.00 2.40 2.59 0.00 122 G 8.26 3.57 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 0.00 0.00 0.00 123 Y 8.18 4.04 0.00 3.22 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 0.00 124 T 7.68 4.34 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 1.16 0.00 0.00 125 Q 7.83 4.41 0.00 1.99 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.67 0.00 0.00 0.00 0.00 0.00 2.24 2.18 0.00 126 H 7.64 4.61 0.00 3.16 3.19 0.00 5.75 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 0.00 127 G 9.55 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 0.00 0.00 0.00 128 G 8.15 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 L 6.98 4.74 0.00 1.77 1.65 0.93 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 130 R 8.14 4.20 0.00 1.91 1.92 0.00 3.00 0.00 0.00 3.20 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.51 0.00 131 P 0.00 4.52 0.00 2.09 2.12 0.00 3.68 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.15 0.00 132 F 8.56 4.44 0.00 2.90 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 0.00 133 G 8.95 4.05 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 0.00 0.00 0.00 134 V 7.28 4.92 1.81 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 -0.16 0.00 0.00 0.93 0.00 0.00 135 S 8.18 4.62 0.00 3.58 3.59 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 0.00 136 F 8.73 4.99 0.00 2.32 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 0.00 0.00 0.00 137 I 8.31 4.41 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 1.24 0.91 0.94 0.00 0.00 138 Y 8.78 5.04 0.00 2.81 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 A 9.16 4.75 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 0.00 140 G 8.49 4.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 Y 8.95 4.98 0.00 2.97 2.78 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 0.00 142 D 7.44 4.57 0.00 2.55 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 0.00 0.00 0.00 0.00 143 D 8.37 4.39 0.00 2.81 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 0.00 144 R 8.61 4.08 0.00 1.66 1.82 0.00 3.23 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 1.49 1.49 0.00