NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4378 8.2893 120.3292 54.9705 34.0185 175.5679 2 K 4.3717 7.6051 115.4108 52.9613 34.7014 175.9541 3 K 4.3993 8.4277 119.9110 56.8780 30.7273 176.5319 4 V 4.3591 7.6411 123.0571 61.8039 34.7807 173.9163 5 A 4.9311 9.5921 128.4020 50.1076 23.7205 174.7957 6 G 4.1854 7.5259 112.0388 45.2682 0.0000 175.8483 7 I 4.6291 7.6044 125.8491 59.7507 41.8431 173.4178 8 V 4.2149 7.8832 118.2910 62.4738 34.4039 171.2389 9 K 4.6397 8.5333 124.8277 56.2901 34.8417 175.0307 10 L 4.4068 7.9460 122.9605 56.1854 42.6380 174.4342 11 Q 4.7730 8.1253 114.1201 56.1836 29.9632 174.3818 12 L 4.5097 7.7492 122.1256 52.0467 43.4790 174.6628 13 P 4.4744 0.0000 0.0000 62.6566 31.5934 175.4195 14 A 3.8630 8.5434 124.3807 53.7407 18.8725 178.3568 15 G 3.8843 7.7927 108.1624 43.5687 0.0000 174.1965 16 K 4.4536 7.3592 115.7780 54.0364 36.4467 176.9729 17 A 4.1612 8.6109 126.3002 52.7787 18.8191 177.6479 18 T 4.6009 7.9807 110.3818 59.2707 69.1132 174.4475 19 P 4.8486 0.0000 0.0000 63.2895 30.7974 178.8437 20 A 4.2761 8.6580 117.5116 53.5682 19.3155 176.9356 21 P 4.3522 0.0000 0.0000 65.6257 31.1139 175.8362 22 P 4.2955 0.0000 0.0000 63.7818 32.6831 177.2603 23 V 3.8109 7.8913 115.5833 60.6055 34.1367 179.9534 24 G 3.9926 9.4691 109.6492 46.0659 0.0000 173.8681 25 P 4.1416 0.0000 0.0000 64.3846 32.1612 177.7009 26 A 3.8153 7.2178 121.1056 54.2848 18.5359 177.1676 27 L 4.8073 7.6817 113.6948 53.9392 42.6419 177.9796 28 G 3.8876 7.5743 109.8119 47.0017 0.0000 175.8530 29 Q 4.3039 7.2173 115.9514 56.5436 28.1536 175.8932 30 Y 4.7079 7.4859 114.1893 57.5368 38.4013 174.7065 31 G 3.6057 9.3793 110.1358 44.7355 0.0000 172.4367 32 A 4.7369 7.4485 124.1434 52.1519 22.3398 175.5114 33 N 5.1179 8.8504 116.6533 51.6804 41.2552 176.1356 34 I 3.9736 8.3572 123.4427 64.4175 37.3584 177.9525 35 M 4.0465 8.2042 119.0345 58.9957 31.6102 178.4165 36 E 4.3021 8.3712 117.2660 58.4841 29.6229 178.4064 37 F 4.6111 7.7942 119.2848 60.2851 39.8488 177.4942 38 T 3.9286 8.4662 114.6884 66.3098 68.3982 174.8147 39 K 4.1792 8.0053 119.5145 56.9383 32.6769 177.8561 40 A 4.0204 7.7850 122.2575 55.7731 19.0303 179.3072 41 F 3.6875 7.2678 118.3381 61.2749 39.1782 176.6527 42 N 4.5534 7.7258 113.2687 53.7818 38.2759 176.2311 43 A 4.1527 7.1204 122.9981 54.7256 19.1123 179.4245 44 Q 4.1498 7.7866 115.7253 57.8858 28.9421 177.8136 45 T 3.8256 7.3302 109.2645 62.8484 68.9073 176.3042 46 A 3.9124 7.6330 123.6132 55.3883 18.5760 178.8845 47 D 4.4809 7.4544 116.6872 56.1349 42.1844 177.1208 48 K 4.5498 7.4105 117.2435 54.6198 32.4543 175.5126 49 G 3.7970 7.6250 109.2051 45.8276 0.0000 170.7080 50 D 4.3643 9.7620 115.2566 54.5475 37.7172 174.3116 51 A 4.1811 7.1535 121.7580 51.9857 21.1851 176.2548 52 I 4.6030 7.8315 111.6597 59.9234 38.2730 172.9621 53 I 4.1647 8.0174 123.4344 59.7088 37.5193 173.8027 54 P 4.4502 0.0000 0.0000 63.4129 31.9633 175.6633 55 V 4.9738 8.0183 122.2847 61.7919 35.4651 173.0290 56 E 4.6645 8.9996 127.2090 55.5701 31.3417 175.0853 57 I 4.9028 7.8835 123.7413 59.8153 40.0936 175.1561 58 T 4.4195 8.0654 120.8679 61.8732 70.9148 173.4313 59 I 4.1410 8.1017 126.8503 60.3551 38.9402 173.8057 60 Y 4.6076 8.4171 118.6633 57.2830 40.4908 176.2080 61 A 4.3425 8.1182 119.1136 52.6651 23.1708 178.9421 62 D 4.3496 8.8904 121.5611 55.9764 40.1945 175.6886 63 R 4.8251 8.8876 121.8244 56.9125 31.2353 174.7168 64 S 4.8041 7.9677 113.3836 57.1227 64.9649 174.3528 65 F 5.1255 7.8878 115.9074 57.6364 40.1076 173.0705 66 T 4.9175 8.0602 109.5383 62.3802 71.6577 172.5372 67 F 5.4883 7.5284 112.5159 57.4037 39.9303 173.7017 68 I 4.6661 8.0177 121.3401 59.6927 40.0300 175.0345 69 T 4.2088 9.0011 123.9231 63.6740 68.8723 174.8600 70 K 4.8961 8.2071 124.2457 56.4896 35.8382 175.5198 71 T 4.7598 8.4981 116.2253 59.9980 70.6169 173.5449 72 P 4.4810 0.0000 0.0000 61.6460 32.1661 174.2920 73 P 4.4052 0.0000 0.0000 63.5263 31.4285 176.3992 74 M 4.6643 8.5262 118.9081 55.5226 32.9315 177.8690 75 S 4.0716 7.9038 116.6361 60.6305 63.1575 175.7416 76 Y 4.1251 7.9415 122.4835 60.6685 38.5041 177.2697 77 L 3.8986 7.9609 118.2117 57.7647 42.0082 179.1772 78 I 3.8852 7.3267 119.4670 64.1471 37.0670 178.3323 79 R 3.8521 7.7483 118.7657 59.4178 29.4508 178.9739 80 K 3.7362 7.7449 118.7866 59.3051 31.9094 178.3332 81 A 4.1355 7.7743 119.2307 53.4530 18.4537 178.1122 82 A 4.5964 7.7461 117.2400 50.4287 20.2342 176.1399 83 G 3.8625 7.7231 104.0158 46.5843 0.0000 174.1412 84 I 4.5923 7.7897 118.4725 59.2870 40.6374 175.8482 85 G 4.1566 8.6987 112.4536 44.7399 0.0000 172.5597 86 K 4.5990 7.6415 118.5377 54.2982 35.3876 177.4298 87 G 3.9638 8.3529 112.6625 45.0465 0.0000 172.2886 88 S 4.6767 8.2833 113.3445 56.2129 65.6663 174.2841 89 S 4.1353 8.9672 119.4906 60.3444 63.0197 173.8097 90 T 4.4294 7.5848 110.8242 58.9009 68.6868 171.9318 91 P 4.4397 0.0000 0.0000 64.4083 32.1151 177.0287 92 N 4.6947 8.0188 115.4336 54.7734 39.8172 175.7442 93 K 3.8353 7.6787 116.4805 57.5722 31.9159 177.4348 94 A 4.2897 7.8705 135.0000 51.1678 18.1013 178.0695 95 K 4.3136 8.0668 120.8430 56.6168 33.9239 176.5425 96 V 3.7335 7.8664 121.0292 62.9400 30.2177 178.6370 97 G 4.0370 8.0123 110.1899 44.9573 0.0000 173.7220 98 K 4.7925 8.5629 125.1117 55.3734 34.9041 173.8342 99 L 4.9761 7.7314 126.9756 53.8802 43.2378 174.7888 100 N 5.1132 8.3699 114.1062 49.9368 42.0938 175.9534 101 W 4.4182 8.0011 119.7200 59.0823 28.2083 178.0416 102 D 4.5974 8.5057 120.8751 57.3193 39.9949 177.9648 103 Q 4.2083 7.8986 116.9195 57.5099 28.9322 177.5113 104 V 4.0529 7.7484 119.0486 63.6941 30.8890 177.7015 105 L 4.0219 7.6516 118.9152 58.1514 41.5334 178.6271 106 E 3.9988 8.0731 112.8356 57.4184 30.4988 177.6662 107 I 3.9189 7.7274 121.7071 64.3064 37.4633 177.5172 108 A 4.4596 7.2559 121.1182 52.2414 18.5554 177.4912 109 K 4.6318 8.0409 117.5393 57.6029 33.8104 176.5886 110 T 4.5138 7.9246 111.6630 64.7314 71.3066 174.4499 111 K 4.5728 8.0098 119.7713 56.4068 31.4272 178.4792 112 M 4.1883 7.9506 119.9304 57.5200 31.5590 176.5467 113 P 4.3905 0.0000 0.0000 64.4014 31.8512 176.5054 114 D 4.6354 7.3600 117.4062 55.3901 42.2163 176.3384 115 L 4.0478 7.8902 119.5775 55.3234 40.8397 175.8658 116 N 4.7161 8.5548 120.7429 52.3529 37.5326 175.0193 117 A 4.2916 7.8417 122.0401 52.1327 20.6356 179.8882 118 G 3.7897 9.0068 110.7867 46.5513 0.0000 176.2527 119 S 4.2759 8.7484 118.3887 57.4374 66.1252 172.2735 120 V 3.3653 8.0647 125.4023 63.5526 31.9007 173.8163 121 E 3.9933 8.1622 116.9482 59.9622 29.6059 178.9776 122 A 3.9619 8.0011 119.8197 55.2768 18.7221 179.3627 123 A 4.0718 8.1345 118.9852 54.0470 18.4060 179.4922 124 A 4.0269 8.4325 119.4549 54.5635 18.5468 178.5232 125 N 4.7083 7.7142 111.7918 53.8981 39.5506 177.1913 126 T 4.0844 7.4347 118.7666 66.6685 68.8701 177.0165 127 V 3.7170 7.7228 119.4503 65.8743 31.3723 177.8391 128 A 4.1602 8.1123 120.4050 55.0117 17.8423 179.5767 129 G 3.4676 7.9431 104.4161 48.2790 0.0000 175.9822 130 T 3.8858 7.8296 117.0788 65.9969 68.6063 176.8714 131 A 3.8998 7.8087 122.4597 54.8352 18.5127 179.4371 132 R 3.9106 8.7153 116.9841 58.9452 30.2273 177.9958 133 S 4.5828 7.3442 112.5451 59.5012 63.5725 175.6086 134 M 4.3267 7.6344 121.2469 56.4115 32.2429 177.4087 135 G 4.9791 6.7698 120.9070 46.3376 0.0000 171.1244 136 V 4.7632 7.2704 113.1905 59.2649 34.6973 175.9658 137 T 4.4042 8.0976 115.3751 61.0110 70.9337 173.6747 138 V 4.3552 8.2216 122.6465 61.8705 32.6957 174.6796 139 E 4.5292 8.9363 128.1234 55.4967 31.5313 176.9435 140 G 4.3590 9.3561 113.7017 45.7142 0.0000 170.4326 141 G 3.6749 8.9219 105.3115 43.3826 0.0000 171.6456 142 P 4.1807 0.0000 0.0000 63.9056 32.0230 177.8231 143 N 4.0846 8.5884 117.0340 54.2197 37.0600 174.5130 144 A 4.1235 8.6832 121.1326 53.6404 18.8347 177.0577 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 8.29 4.44 0.00 2.02 2.17 0.00 0.00 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.46 0.00 2 K 7.61 4.37 0.00 1.95 1.81 0.00 1.58 0.00 0.00 1.72 0.00 0.00 2.94 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.33 1.43 7.81 3 K 8.43 4.40 0.00 1.91 1.92 0.00 1.55 0.00 0.00 1.64 0.00 0.00 2.99 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.43 1.39 7.81 4 V 7.64 4.36 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 0.94 0.00 0.00 0.99 0.00 0.00 5 A 9.59 4.93 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 6 G 7.53 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 0.00 0.00 0.00 0.00 7 I 7.60 4.63 1.76 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.62 0.83 0.00 0.00 8 V 7.88 4.21 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 0.77 0.00 0.00 0.57 0.00 0.00 9 K 8.53 4.64 0.00 1.73 1.68 0.00 1.62 0.00 0.00 1.73 0.00 0.00 2.78 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.28 1.40 7.81 10 L 7.95 4.41 0.00 1.91 1.74 0.75 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 11 Q 8.13 4.77 0.00 2.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.90 6.98 0.00 0.00 0.00 0.00 0.00 2.27 2.40 0.00 12 L 7.75 4.51 0.00 1.67 1.65 0.92 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 13 P 0.00 4.47 0.00 2.06 1.99 0.00 3.74 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.10 0.00 14 A 8.54 3.86 1.09 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 0.00 0.00 15 G 7.79 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 16 K 7.36 4.45 0.00 1.68 1.65 0.00 1.73 0.00 0.00 1.68 0.00 0.00 2.95 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.29 1.36 7.81 17 A 8.61 4.16 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 18 T 7.98 4.60 4.34 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 1.35 0.00 0.00 19 P 0.00 4.85 0.00 2.20 1.75 0.00 3.80 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 1.99 1.96 0.00 20 A 8.66 4.28 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 21 P 0.00 4.35 0.00 2.19 2.19 0.00 3.67 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 1.99 1.99 0.00 22 P 0.00 4.30 0.00 2.08 2.12 0.00 3.73 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.09 0.00 23 V 7.89 3.81 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 0.93 0.00 0.00 0.83 0.00 0.00 24 G 9.47 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 25 P 0.00 4.14 0.00 2.16 2.25 0.00 3.95 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.91 0.00 26 A 7.22 3.82 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 L 7.68 4.81 0.00 1.45 1.61 0.87 0.61 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 28 G 7.57 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 29 Q 7.22 4.30 0.00 1.43 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 7.03 0.00 0.00 0.00 0.00 0.00 2.27 2.29 0.00 30 Y 7.49 4.71 0.00 2.87 2.82 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 0.00 0.00 0.00 31 G 9.38 3.61 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 0.00 0.00 0.00 32 A 7.45 4.74 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 N 8.85 5.12 0.00 3.13 2.85 0.00 0.00 6.95 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 34 I 8.36 3.97 1.89 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 1.57 0.64 0.96 0.00 0.00 35 M 8.20 4.05 0.00 2.07 2.20 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.74 2.65 0.00 36 E 8.37 4.30 0.00 2.39 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 0.00 2.52 2.52 0.00 37 F 7.79 4.61 0.00 2.96 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 38 T 8.47 3.93 4.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 39 K 8.01 4.18 0.00 1.82 1.72 0.00 1.75 0.00 0.00 1.85 0.00 0.00 2.98 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.46 1.67 7.81 40 A 7.78 4.02 1.61 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 0.00 0.00 41 F 7.27 3.69 0.00 1.51 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 0.00 0.00 0.00 0.00 42 N 7.73 4.55 0.00 2.68 2.67 0.00 0.00 7.23 7.35 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 43 A 7.12 4.15 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 44 Q 7.79 4.15 0.00 2.07 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.82 0.00 0.00 0.00 0.00 0.00 2.41 2.57 0.00 45 T 7.33 3.83 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 0.32 0.00 0.00 46 A 7.63 3.91 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 47 D 7.45 4.48 0.00 2.72 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 48 K 7.41 4.55 0.00 1.58 1.67 0.00 1.68 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.35 1.33 7.81 49 G 7.62 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 50 D 9.76 4.36 0.00 2.86 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 51 A 7.15 4.18 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 52 I 7.83 4.60 1.87 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 1.40 0.64 1.01 0.00 0.00 53 I 8.02 4.16 1.92 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 1.49 0.44 0.98 0.00 0.00 54 P 0.00 4.45 0.00 2.15 2.22 0.00 3.87 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.01 0.00 55 V 8.02 4.97 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 1.46 0.00 0.00 1.30 0.00 0.00 56 E 9.00 4.66 0.00 1.98 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 2.35 2.35 0.00 57 I 7.88 4.90 1.71 0.00 0.00 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.44 0.86 0.00 0.00 58 T 8.07 4.42 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 59 I 8.10 4.14 1.74 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.36 0.93 0.00 0.00 60 Y 8.42 4.61 0.00 2.94 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 61 A 8.12 4.34 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 62 D 8.89 4.35 0.00 2.82 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 0.00 0.00 0.00 63 R 8.89 4.83 0.00 1.74 1.94 0.00 3.26 0.00 0.00 3.26 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.73 0.00 64 S 7.97 4.80 0.00 4.01 3.96 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 65 F 7.89 5.13 0.00 2.84 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 66 T 8.06 4.92 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 1.24 0.00 0.00 67 F 7.53 5.49 0.00 3.14 3.21 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 68 I 8.02 4.67 1.95 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.82 0.98 0.00 0.00 69 T 9.00 4.21 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 1.26 0.00 0.00 70 K 8.21 4.90 0.00 1.90 1.61 0.00 1.78 0.00 0.00 1.79 0.00 0.00 2.99 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.41 1.65 7.81 71 T 8.50 4.76 4.27 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 1.26 0.00 0.00 72 P 0.00 4.48 0.00 2.20 2.09 0.00 3.79 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.99 0.00 73 P 0.00 4.41 0.00 2.09 2.06 0.00 3.66 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 2.04 2.13 0.00 74 M 8.53 4.66 0.00 2.08 2.06 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 2.62 2.55 0.00 75 S 7.90 4.07 0.00 3.92 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 76 Y 7.94 4.13 0.00 3.03 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 77 L 7.96 3.90 0.00 1.67 1.71 0.95 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 78 I 7.33 3.89 1.86 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 1.51 0.69 0.89 0.00 0.00 79 R 7.75 3.85 0.00 1.92 2.26 0.00 3.21 0.00 0.00 3.14 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.91 0.00 80 K 7.74 3.74 0.00 1.51 1.73 0.00 1.49 0.00 0.00 1.56 0.00 0.00 2.76 0.00 0.00 2.42 0.00 0.00 0.00 0.00 1.31 1.29 7.81 81 A 7.77 4.14 1.28 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 0.00 0.00 82 A 7.75 4.60 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 83 G 7.72 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 84 I 7.79 4.59 1.85 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 1.33 0.79 0.97 0.00 0.00 85 G 8.70 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 K 7.64 4.60 0.00 1.66 1.63 0.00 1.68 0.00 0.00 1.72 0.00 0.00 3.10 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.33 1.50 7.81 87 G 8.35 3.96 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 0.00 0.00 0.00 88 S 8.28 4.68 0.00 4.03 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 89 S 8.97 4.14 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 90 T 7.58 4.43 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 91 P 0.00 4.44 0.00 2.32 2.29 0.00 3.74 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.99 0.00 92 N 8.02 4.69 0.00 2.72 2.89 0.00 0.00 6.99 7.61 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 93 K 7.68 3.84 0.00 1.75 1.66 0.00 1.74 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.44 1.44 7.81 94 A 7.87 4.29 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 95 K 8.07 4.31 0.00 2.06 1.85 0.00 1.57 0.00 0.00 1.63 0.00 0.00 2.96 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.39 1.42 7.81 96 V 7.87 3.73 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 0.73 0.00 0.00 0.93 0.00 0.00 97 G 8.01 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 0.00 0.00 0.00 98 K 8.56 4.79 0.00 1.72 1.62 0.00 1.71 0.00 0.00 1.73 0.00 0.00 2.75 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.29 1.40 7.81 99 L 7.73 4.98 0.00 1.73 1.62 0.94 0.91 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 0.00 100 N 8.37 5.11 0.00 2.43 2.56 0.00 0.00 7.44 7.95 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 0.00 101 W 8.00 4.42 0.00 3.58 3.54 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 0.00 102 D 8.51 4.60 0.00 2.57 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 Q 7.90 4.21 0.00 2.19 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.04 6.85 0.00 0.00 0.00 0.00 0.00 2.37 2.38 0.00 104 V 7.75 4.05 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 1.09 0.00 0.00 1.02 0.00 0.00 105 L 7.65 4.02 0.00 1.86 1.74 1.01 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 106 E 8.07 4.00 0.00 2.09 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 2.36 2.39 0.00 107 I 7.73 3.92 2.08 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.17 0.94 0.00 0.00 108 A 7.26 4.46 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 0.00 109 K 8.04 4.63 0.00 1.78 1.80 0.00 1.62 0.00 0.00 1.72 0.00 0.00 3.11 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.32 1.49 7.81 110 T 7.92 4.51 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 0.00 111 K 8.01 4.57 0.00 2.04 1.81 0.00 1.68 0.00 0.00 1.72 0.00 0.00 3.00 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.42 1.43 7.81 112 M 7.95 4.19 0.00 2.21 2.33 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 2.66 2.57 0.00 113 P 0.00 4.39 0.00 2.08 2.17 0.00 3.68 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.12 0.00 114 D 7.36 4.64 0.00 2.85 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 0.00 115 L 7.89 4.05 0.00 1.67 1.67 0.94 0.81 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 0.00 116 N 8.55 4.72 0.00 2.83 2.90 0.00 0.00 6.24 7.26 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 0.00 117 A 7.84 4.29 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 0.00 118 G 9.01 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 0.00 0.00 0.00 119 S 8.75 4.28 0.00 3.80 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 0.00 120 V 8.06 3.37 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 0.81 0.00 0.00 0.93 0.00 0.00 121 E 8.16 3.99 0.00 2.07 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 2.38 2.43 0.00 122 A 8.00 3.96 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 0.00 123 A 8.13 4.07 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 0.00 124 A 8.43 4.03 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 0.00 125 N 7.71 4.71 0.00 2.70 2.86 0.00 0.00 7.07 8.12 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 0.00 126 T 7.43 4.08 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 1.22 0.00 0.00 127 V 7.72 3.72 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 1.04 0.00 0.00 1.00 0.00 0.00 128 A 8.11 4.16 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 G 7.94 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 0.00 130 T 7.83 3.89 4.42 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 1.23 0.00 0.00 131 A 7.81 3.90 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 0.00 132 R 8.72 3.91 0.00 1.88 2.00 0.00 3.26 0.00 0.00 3.23 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.68 0.00 133 S 7.34 4.58 0.00 3.71 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 0.00 134 M 7.63 4.33 0.00 1.98 2.20 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 2.62 2.56 0.00 135 G 6.77 4.98 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 0.00 0.00 0.00 136 V 7.27 4.76 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 0.74 0.00 0.00 0.97 0.00 0.00 137 T 8.10 4.40 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 0.00 138 V 8.22 4.36 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 0.86 0.00 0.00 0.97 0.00 0.00 139 E 8.94 4.53 0.00 2.11 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 2.28 2.26 0.00 140 G 9.36 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 0.00 0.00 0.00 0.00 141 G 8.92 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 P 0.00 4.18 0.00 2.03 1.98 0.00 3.78 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.06 0.00 143 N 8.59 4.08 0.00 2.88 2.90 0.00 0.00 7.08 7.35 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 0.00 144 A 8.68 4.12 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