NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9003 8.3393 109.7365 45.4486 0.0000 172.1483 2 S 4.5238 8.4229 120.5243 54.0854 64.6554 172.4368 3 S 4.7757 8.8247 120.1531 56.5967 67.4349 171.4715 4 G 4.0713 8.9110 112.2501 44.7267 0.0000 175.3230 5 S 4.6787 8.7401 110.2301 56.4293 66.8917 175.0044 6 S 4.4292 8.6543 118.8336 58.3021 63.3423 173.9476 7 G 4.5036 8.4557 121.5616 46.8960 0.0000 175.5455 8 S 3.8327 8.2807 113.9747 60.5281 63.0020 174.7937 9 L 3.9323 7.0903 121.7651 54.2708 42.2398 176.1411 10 K 3.7495 8.5091 123.7875 57.5208 32.0471 177.4654 11 S 3.9472 8.3791 120.5877 60.9861 63.2944 176.4337 12 T 3.5584 6.9271 111.6464 64.9125 68.0721 175.2555 13 A 3.9946 7.8399 123.0508 54.8258 18.4540 179.4151 14 K 3.8869 7.9612 116.9147 59.5458 31.9671 179.3923 15 W 4.5509 7.8445 117.1425 60.0573 29.1334 177.9963 16 A 4.1361 8.6922 119.4993 55.0556 17.9110 178.9437 17 A 4.1802 8.0742 118.5226 54.0451 19.0604 177.9319 18 S 4.5813 7.9306 111.3530 55.8200 67.6128 175.0922 19 L 3.0112 8.0754 126.2554 58.2546 41.3996 178.9590 20 E 3.7791 8.1772 117.6204 59.8525 29.2636 179.0544 21 N 4.5508 8.2398 116.0939 56.2022 38.2625 177.2044 22 L 3.8104 8.0743 122.0932 57.7495 41.9289 178.9517 23 L 3.7839 7.4037 117.8174 57.5619 41.7236 178.7153 24 E 4.0919 8.4215 116.8074 58.6549 29.9582 177.5400 25 D 4.6891 7.5105 119.7766 52.9406 42.0645 175.6661 26 P 4.2654 0.0000 0.0000 66.1052 31.5153 178.6678 27 E 4.0796 8.3764 118.3425 58.9355 29.4907 179.3082 28 G 2.6929 7.7136 106.3287 46.8601 0.0000 175.5939 29 V 3.5094 7.1908 121.1619 65.2192 31.5097 177.7864 30 K 3.8605 8.0508 119.3389 59.7704 32.0437 178.8686 31 R 4.0731 8.0203 118.0468 59.1607 30.1491 178.5121 32 F 3.7499 8.4357 120.7469 61.5981 39.2784 177.3509 33 R 3.7432 8.1138 117.2272 59.4399 29.9361 178.4330 34 E 3.8597 7.7526 116.5497 59.7267 29.3748 179.3281 35 F 4.0285 7.9372 118.5921 61.6021 39.6015 176.9122 36 L 3.9853 8.0484 118.3301 57.8049 41.4969 179.5253 37 K 3.8700 8.4773 119.6472 59.3810 31.9639 178.0368 38 K 3.7106 7.2408 117.8641 59.2019 32.0577 177.4061 39 E 4.4695 7.9370 113.9689 55.4015 29.8750 175.9661 40 F 3.8064 7.9095 115.6388 58.6088 37.0032 176.5663 41 S 4.7197 7.7353 114.5196 58.1779 64.1200 175.0373 42 E 3.8562 8.3282 121.0185 59.6531 28.3914 178.8442 43 E 3.9619 8.3603 117.7221 59.4842 28.7346 179.1608 44 N 4.3086 8.4932 117.8058 56.5653 38.6287 177.7931 45 V 3.7836 8.1146 113.8774 64.2506 31.7023 178.7132 46 L 4.0470 7.7931 118.6161 57.6262 41.6459 179.0006 47 F 4.2485 7.8227 120.2677 60.4317 39.3347 177.2907 48 W 3.4759 8.1847 128.0986 60.2252 30.6095 177.6620 49 L 3.9285 8.3732 118.8590 57.8634 41.1568 179.1465 50 A 3.9134 7.4534 119.2860 55.8577 18.1082 179.3578 51 C 3.4095 7.1073 114.5240 63.2436 28.0632 176.4084 52 E 3.8058 7.2190 119.0525 59.1448 28.9247 178.9004 53 D 4.3693 7.8398 118.1001 57.7428 40.8113 178.9844 54 F 4.1852 8.5393 120.0479 61.5892 39.3334 177.0706 55 K 3.9386 8.0775 118.1201 59.7550 32.0477 178.9892 56 K 3.8878 8.1894 119.3284 59.9321 32.1153 178.7798 57 M 3.8452 8.0189 117.9945 56.9921 32.1654 177.3038 58 Q 3.3729 7.5037 114.9885 56.9938 27.3968 173.2834 59 D 4.8348 7.4837 115.2988 51.8167 44.4246 176.7361 60 K 3.8424 8.6079 125.1359 60.1116 32.0540 178.6539 61 T 3.8240 7.9381 115.2010 67.1604 68.4546 175.9536 62 Q 4.0992 8.1130 118.7343 59.5952 28.8053 179.4178 63 M 4.1823 8.0589 119.2703 58.7033 31.8137 178.5331 64 Q 4.0870 8.3968 117.0705 59.9213 29.0842 179.0340 65 E 4.2142 8.2074 118.2458 57.9910 29.6151 178.6630 66 K 3.9445 8.5204 119.1347 60.4716 32.4501 177.8582 67 A 3.9159 9.1243 120.7516 55.8871 18.1816 179.6088 68 K 3.9629 7.9622 114.9946 59.9141 32.6481 178.6432 69 E 3.9324 8.3280 119.1122 59.7211 29.7267 179.0673 70 I 3.9632 8.3474 120.8607 64.0187 37.1276 177.7933 71 Y 4.1198 8.1930 120.3142 61.1472 38.4316 177.6435 72 M 4.6049 8.6266 115.8761 56.5587 32.1709 177.9032 73 T 3.8693 8.0003 117.7565 65.1906 68.9602 176.4133 74 F 4.5827 7.1475 117.2003 58.2113 41.5035 176.8396 75 L 4.1893 7.4531 118.2906 54.5957 40.9576 176.3054 76 S 4.6634 7.0342 113.0963 56.2132 64.7750 174.3299 77 S 4.1912 8.5122 118.3196 61.4248 62.3048 175.6649 78 K 4.2882 7.5924 116.3667 56.2733 30.4927 176.5742 79 A 3.9993 7.6620 124.3686 52.1116 18.0921 179.5018 80 S 4.3083 8.7635 118.5098 61.0427 63.1395 174.4683 81 S 4.5232 7.4681 115.5122 55.6514 64.0507 172.8604 82 Q 4.4639 8.3754 126.8699 53.7928 29.6493 175.8170 83 V 3.9330 8.1077 118.2147 60.9443 32.2280 174.7885 84 N 4.7781 8.3402 119.5171 52.4576 39.7547 174.3736 85 V 4.4900 7.7587 116.9984 60.5372 35.9922 174.0281 86 E 4.0975 8.9910 120.3445 58.7575 29.7985 178.0181 87 G 4.4483 7.2849 103.5263 45.7261 0.0000 172.3760 88 Q 4.4850 8.0397 114.4633 56.6793 29.6133 177.9310 89 S 4.3257 7.8845 114.6610 60.0110 63.3517 175.8217 90 R 3.8981 8.1689 120.7451 59.0983 29.7028 176.2307 91 L 4.3175 7.2480 116.2078 55.7388 41.3035 174.7650 92 N 4.7924 8.5060 114.6663 53.6179 41.5126 174.6717 93 E 3.3540 8.6391 120.3968 59.3457 30.0162 180.4046 94 K 3.8790 8.1836 117.9707 59.4135 32.2578 178.7356 95 I 3.6209 8.0692 118.0583 63.9107 37.9545 176.7070 96 L 4.0834 7.5495 119.2842 57.5687 41.2590 178.0458 97 E 3.5611 7.7914 116.6268 58.5059 29.6932 177.3284 98 E 4.4506 7.6361 126.5373 53.5649 29.9262 173.7417 99 P 4.5637 0.0000 0.0000 62.8543 32.3237 175.6635 100 H 4.9640 8.6273 116.5337 53.6561 30.4185 172.3613 101 P 4.8866 0.0000 0.0000 63.5764 30.3341 177.4346 102 L 4.6371 7.7180 120.0720 55.5725 42.9462 178.4011 103 M 4.1087 7.4324 116.3545 57.7438 31.3867 177.5190 104 F 4.9066 7.5925 117.3393 59.1980 39.9472 178.0376 105 Q 3.7647 7.3112 115.4836 59.0215 29.2679 179.4883 106 K 4.1459 7.6345 119.7927 59.6827 31.9422 179.2505 107 L 4.1072 8.2003 118.6986 58.2413 41.5180 179.3880 108 Q 3.9308 8.8471 119.6580 58.7967 28.7616 177.6001 109 D 4.5252 8.2728 120.4850 57.4085 40.9526 178.4549 110 Q 4.6019 8.1235 118.6531 59.1555 28.5191 178.3799 111 I 3.7479 7.6261 122.2745 63.7954 37.2279 177.8015 112 F 4.1032 8.5304 121.0730 61.7178 39.0861 177.0331 113 N 3.5838 7.8743 115.8776 55.7946 38.1822 176.8351 114 L 3.8865 7.7683 121.7075 58.8474 42.1351 179.1996 115 M 4.0922 8.0243 118.1935 58.0759 31.6208 178.7912 116 K 3.5776 7.4345 118.8465 58.8347 31.8205 177.8109 117 Y 5.1413 6.8873 115.0512 57.2089 39.6963 176.9498 118 D 4.5516 8.5252 119.4264 56.5938 41.8433 177.5358 119 S 4.5555 7.7431 114.2853 61.0808 63.7480 175.6437 120 Y 4.2268 8.8848 121.3795 61.1312 38.7097 178.7136 121 S 3.8322 8.0866 115.4601 61.7552 63.1801 177.4389 122 R 3.8487 7.9964 119.7223 59.4210 30.1018 178.5808 123 F 3.5636 8.2144 120.7742 61.3150 39.0513 177.4223 124 L 3.0174 7.2870 117.2198 57.2372 41.4496 178.9643 125 K 4.3574 7.3732 115.2877 56.5385 33.1558 176.5469 126 S 4.8616 6.9375 115.7760 57.4282 65.0994 175.0749 127 D 4.3519 8.8236 122.8259 57.6140 40.3805 178.7013 128 L 3.9163 7.9156 119.0497 58.1046 42.2113 178.1718 129 F 4.3676 7.7326 119.1070 60.5146 39.8576 176.9858 130 L 3.8298 8.4868 118.9231 58.3920 41.5158 179.9136 131 K 4.0185 8.2731 118.3056 59.8751 31.9702 178.4154 132 H 3.9823 8.0598 117.7890 59.1153 29.6899 176.9018 133 K 3.6062 7.3481 120.2610 59.6419 31.9758 178.5550 134 R 4.0046 8.4436 118.8498 59.0964 29.9624 178.5016 135 T 3.7553 7.8901 113.0928 65.2889 67.2611 175.2870 136 E 3.9364 7.9828 120.6035 57.7436 30.0917 176.3582 137 E 4.6323 7.3492 117.0333 53.8847 33.0630 175.7354 138 E 4.1871 8.5977 121.1169 55.8665 30.5085 175.8880 139 E 4.3788 8.3330 117.4830 55.3352 30.9908 175.1911 140 E 4.6200 8.4083 117.2745 55.0019 31.3671 175.4430 141 D 4.7952 8.5614 120.6548 54.0740 41.4089 176.4001 142 L 4.4092 7.4733 120.1943 53.3215 42.5894 175.7431 143 P 4.5286 0.0000 0.0000 63.5068 31.2582 176.4767 144 S 4.1677 7.8097 115.5544 58.7357 63.1061 173.4673 145 G 4.3804 8.1791 116.6654 42.9738 0.0000 171.0385 146 P 4.5096 0.0000 0.0000 62.2250 29.3771 175.8297 147 S 4.1437 8.6253 122.4655 62.3729 63.0758 176.6506 148 S 3.6134 8.7724 110.8698 58.3073 60.5246 171.9065 149 G 3.5828 8.4891 112.0677 45.0948 0.0000 174.1282 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 G 8.34 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 0.00 0.00 0.00 2 S 8.42 4.52 0.00 4.04 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 3 S 8.82 4.78 0.00 3.96 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 4 G 8.91 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 S 8.74 4.68 0.00 3.95 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 6 S 8.65 4.43 0.00 3.91 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 7 G 8.46 4.50 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 S 8.28 3.83 0.00 3.98 4.03 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 9 L 7.09 3.93 0.00 1.46 1.58 0.88 0.61 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 10 K 8.51 3.75 0.00 1.68 1.70 0.00 1.63 0.00 0.00 1.66 0.00 0.00 3.03 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.39 1.48 7.81 11 S 8.38 3.95 0.00 2.91 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 12 T 6.93 3.56 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.00 0.00 13 A 7.84 3.99 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 14 K 7.96 3.89 0.00 1.75 1.92 0.00 1.66 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.41 1.52 7.81 15 W 7.84 4.55 0.00 3.67 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 16 A 8.69 4.14 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 17 A 8.07 4.18 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 18 S 7.93 4.58 0.00 3.90 3.72 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 19 L 8.08 3.01 0.00 0.27 1.01 -0.08 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 20 E 8.18 3.78 0.00 2.02 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.41 0.00 21 N 8.24 4.55 0.00 3.11 3.03 0.00 0.00 7.12 6.29 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 22 L 8.07 3.81 0.00 1.65 1.46 -0.10 -0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 23 L 7.40 3.78 0.00 1.56 1.59 -0.39 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 24 E 8.42 4.09 0.00 2.08 2.16 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 2.54 2.40 0.00 25 D 7.51 4.69 0.00 2.98 2.86 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 26 P 0.00 4.27 0.00 2.29 2.33 0.00 3.80 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.10 0.00 27 E 8.38 4.08 0.00 2.42 2.35 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 2.54 2.52 0.00 28 G 7.71 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 0.00 0.00 0.00 29 V 7.19 3.51 2.16 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 0.98 0.00 0.00 0.99 0.00 0.00 30 K 8.05 3.86 0.00 2.04 1.90 0.00 1.71 0.00 0.00 1.68 0.00 0.00 2.97 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.46 1.50 7.81 31 R 8.02 4.07 0.00 2.05 2.21 0.00 3.37 0.00 0.00 3.22 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.80 0.00 32 F 8.44 3.75 0.00 2.47 2.79 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 33 R 8.11 3.74 0.00 2.14 1.94 0.00 3.22 0.00 0.00 3.16 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.86 0.00 34 E 7.75 3.86 0.00 2.25 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 0.00 2.62 2.53 0.00 35 F 7.94 4.03 0.00 3.25 3.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 L 8.05 3.99 0.00 1.76 1.68 0.45 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 37 K 8.48 3.87 0.00 1.66 1.77 0.00 1.28 0.00 0.00 1.11 0.00 0.00 2.79 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.02 1.47 7.81 38 K 7.24 3.71 0.00 1.63 1.71 0.00 1.62 0.00 0.00 1.49 0.00 0.00 3.05 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.36 1.62 7.81 39 E 7.94 4.47 0.00 2.06 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.22 0.00 40 F 7.91 3.81 0.00 3.07 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 41 S 7.74 4.72 0.00 3.85 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 42 E 8.33 3.86 0.00 2.08 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.31 0.00 43 E 8.36 3.96 0.00 2.34 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.44 0.00 44 N 8.49 4.31 0.00 2.71 2.92 0.00 0.00 6.86 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 45 V 8.11 3.78 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 0.95 0.00 0.00 0.95 0.00 0.00 46 L 7.79 4.05 0.00 1.86 1.94 1.04 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 47 F 7.82 4.25 0.00 1.51 2.53 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 0.00 0.00 0.00 0.00 48 W 8.18 3.48 0.00 3.39 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 49 L 8.37 3.93 0.00 1.79 1.76 1.02 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 50 A 7.45 3.91 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 C 7.11 3.41 0.00 2.59 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 52 E 7.22 3.81 0.00 1.90 1.72 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 1.67 1.73 0.00 53 D 7.84 4.37 0.00 2.92 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 54 F 8.54 4.19 0.00 3.06 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 K 8.08 3.94 0.00 1.96 2.11 0.00 1.34 0.00 0.00 1.59 0.00 0.00 2.92 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.53 1.52 7.81 56 K 8.19 3.89 0.00 1.80 1.86 0.00 1.66 0.00 0.00 1.65 0.00 0.00 2.98 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.41 1.54 7.81 57 M 8.02 3.85 0.00 1.88 2.14 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 2.81 2.60 0.00 58 Q 7.50 3.37 0.00 2.14 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.54 0.00 0.00 0.00 0.00 0.00 2.31 2.50 0.00 59 D 7.48 4.83 0.00 2.57 2.46 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 60 K 8.61 3.84 0.00 1.79 1.78 0.00 1.73 0.00 0.00 1.80 0.00 0.00 2.97 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.50 1.51 7.81 61 T 7.94 3.82 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 62 Q 8.11 4.10 0.00 2.05 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.60 6.85 0.00 0.00 0.00 0.00 0.00 2.46 2.46 0.00 63 M 8.06 4.18 0.00 2.11 2.29 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 0.93 0.00 64 Q 8.40 4.09 0.00 2.25 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 7.00 0.00 0.00 0.00 0.00 0.00 2.44 2.65 0.00 65 E 8.21 4.21 0.00 2.27 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.34 0.00 66 K 8.52 3.94 0.00 2.22 2.38 0.00 1.65 0.00 0.00 1.77 0.00 0.00 3.11 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.82 1.74 7.81 67 A 9.12 3.92 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 K 7.96 3.96 0.00 1.95 2.05 0.00 1.52 0.00 0.00 1.83 0.00 0.00 2.98 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.79 1.55 7.81 69 E 8.33 3.93 0.00 2.12 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 2.54 2.56 0.00 70 I 8.35 3.96 1.82 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.63 0.93 0.00 0.00 71 Y 8.19 4.12 0.00 3.25 3.19 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 0.00 72 M 8.63 4.60 0.00 2.01 2.17 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 3.03 0.00 73 T 8.00 3.87 3.26 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 -0.05 0.00 0.00 74 F 7.15 4.58 0.00 2.58 2.89 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 75 L 7.45 4.19 0.00 0.65 0.97 1.22 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 76 S 7.03 4.66 0.00 3.77 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 S 8.51 4.19 0.00 3.90 3.83 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 78 K 7.59 4.29 0.00 1.78 1.79 0.00 1.76 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.45 1.38 7.81 79 A 7.66 4.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 S 8.76 4.31 0.00 3.99 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 81 S 7.47 4.52 0.00 4.15 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 82 Q 8.38 4.46 0.00 1.99 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.96 0.00 0.00 0.00 0.00 0.00 2.20 2.47 0.00 83 V 8.11 3.93 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 0.73 0.00 0.00 0.68 0.00 0.00 84 N 8.34 4.78 0.00 2.68 2.72 0.00 0.00 6.81 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 85 V 7.76 4.49 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 0.85 0.00 0.00 0.93 0.00 0.00 86 E 8.99 4.10 0.00 1.99 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 0.00 2.34 2.34 0.00 87 G 7.28 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 88 Q 8.04 4.48 0.00 2.22 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.07 6.66 0.00 0.00 0.00 0.00 0.00 2.25 2.33 0.00 89 S 7.88 4.33 0.00 3.91 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 90 R 8.17 3.90 0.00 1.79 2.02 0.00 3.26 0.00 0.00 3.30 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.67 0.00 91 L 7.25 4.32 0.00 2.07 1.77 0.90 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 92 N 8.51 4.79 0.00 2.75 2.69 0.00 0.00 7.74 7.72 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 93 E 8.64 3.35 0.00 1.99 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 2.27 2.33 0.00 94 K 8.18 3.88 0.00 1.77 1.83 0.00 1.75 0.00 0.00 1.79 0.00 0.00 2.90 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.51 1.37 7.81 95 I 8.07 3.62 1.93 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 1.23 0.75 1.04 0.00 0.00 96 L 7.55 4.08 0.00 1.60 1.61 0.48 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 97 E 7.79 3.56 0.00 2.01 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 2.32 2.38 0.00 98 E 7.64 4.45 0.00 2.00 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 2.08 2.10 0.00 99 P 0.00 4.56 0.00 2.40 2.27 0.00 3.79 0.00 0.00 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.01 0.00 100 H 8.63 4.96 0.00 3.32 3.37 0.00 5.48 0.00 0.00 0.00 0.00 6.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 P 0.00 4.89 0.00 2.24 2.26 0.00 3.68 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.94 0.00 102 L 7.72 4.64 0.00 1.59 1.69 0.98 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 103 M 7.43 4.11 0.00 1.84 1.77 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.91 0.00 104 F 7.59 4.91 0.00 3.01 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 0.00 105 Q 7.31 3.76 0.00 2.24 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.93 0.00 0.00 0.00 0.00 0.00 2.37 2.50 0.00 106 K 7.63 4.15 0.00 2.06 1.88 0.00 1.78 0.00 0.00 1.67 0.00 0.00 3.05 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.49 1.49 7.81 107 L 8.20 4.11 0.00 2.13 2.21 1.42 0.97 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 0.00 108 Q 8.85 3.93 0.00 1.66 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.53 6.24 0.00 0.00 0.00 0.00 0.00 1.96 1.16 0.00 109 D 8.27 4.53 0.00 3.03 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 0.00 110 Q 8.12 4.60 0.00 2.35 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.68 6.88 0.00 0.00 0.00 0.00 0.00 2.73 2.46 0.00 111 I 7.63 3.75 2.31 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.44 1.06 0.00 0.00 112 F 8.53 4.10 0.00 3.45 3.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 N 7.87 3.58 0.00 2.67 2.71 0.00 0.00 6.61 6.87 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 0.00 114 L 7.77 3.89 0.00 1.76 1.78 0.94 0.90 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 0.00 115 M 8.02 4.09 0.00 2.18 1.94 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.58 0.00 116 K 7.43 3.58 0.00 0.79 0.94 0.00 0.61 0.00 0.00 0.78 0.00 0.00 2.55 0.00 0.00 2.80 0.00 0.00 0.00 0.00 0.56 0.21 7.81 117 Y 6.89 5.14 0.00 2.88 2.86 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 0.00 118 D 8.53 4.55 0.00 2.72 2.64 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.74 4.56 0.00 4.08 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 0.00 120 Y 8.88 4.23 0.00 2.75 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 0.00 121 S 8.09 3.83 0.00 4.00 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 0.00 122 R 8.00 3.85 0.00 2.05 2.15 0.00 3.37 0.00 0.00 3.37 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.95 0.00 123 F 8.21 3.56 0.00 2.86 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 0.00 124 L 7.29 3.02 0.00 1.46 1.24 0.29 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 125 K 7.37 4.36 0.00 1.93 1.84 0.00 1.59 0.00 0.00 1.69 0.00 0.00 3.06 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.57 1.59 7.81 126 S 6.94 4.86 0.00 3.96 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 0.00 127 D 8.82 4.35 0.00 2.72 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 0.00 128 L 7.92 3.92 0.00 1.74 1.67 1.02 1.06 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 0.00 129 F 7.73 4.37 0.00 2.30 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 0.00 130 L 8.49 3.83 0.00 1.78 1.75 0.97 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 131 K 8.27 4.02 0.00 1.83 1.86 0.00 1.68 0.00 0.00 1.56 0.00 0.00 2.94 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.51 1.66 7.81 132 H 8.06 3.98 0.00 3.24 3.23 0.00 5.88 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 K 7.35 3.61 0.00 0.89 1.69 0.00 2.15 0.00 0.00 1.85 0.00 0.00 3.13 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.38 1.37 7.81 134 R 8.44 4.00 0.00 1.94 1.87 0.00 3.18 0.00 0.00 3.07 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.74 0.00 135 T 7.89 3.76 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 1.13 0.00 0.00 136 E 7.98 3.94 0.00 2.08 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 0.00 2.25 2.28 0.00 137 E 7.35 4.63 0.00 1.85 1.75 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 2.19 2.16 0.00 138 E 8.60 4.19 0.00 2.05 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.28 0.00 139 E 8.33 4.38 0.00 2.08 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 2.24 2.22 0.00 140 E 8.41 4.62 0.00 2.07 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.29 0.00 141 D 8.56 4.80 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 0.00 142 L 7.47 4.41 0.00 1.70 1.57 0.92 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 143 P 0.00 4.53 0.00 2.17 2.15 0.00 3.76 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 1.98 1.95 0.00 144 S 7.81 4.17 0.00 3.95 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 0.00 145 G 8.18 4.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 146 P 0.00 4.51 0.00 2.19 2.11 0.00 3.80 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 1.98 1.98 0.00 147 S 8.63 4.14 0.00 3.88 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 0.00 148 S 8.77 3.61 0.00 3.97 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 0.00 149 G 8.49 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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