NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 7 K 4.2717 8.3144 120.1360 56.0649 33.8381 174.8136 8 V 3.7743 7.8437 119.0588 61.4271 32.5076 173.4635 9 L 4.6558 9.2183 130.9675 53.4268 43.7281 174.8777 10 K 4.4741 8.6738 127.1808 55.5664 33.7203 176.1614 11 I 5.0302 8.3471 124.8665 59.4851 40.3946 174.4064 12 Q 4.5809 9.2444 128.6255 54.2943 31.1343 174.0453 13 L 4.7353 8.5245 126.8739 54.2323 42.0561 176.8766 14 R 4.4413 9.0293 123.9325 57.4868 31.5684 176.3206 15 S 4.6106 7.7284 111.6053 56.3095 66.2213 174.2795 16 A 4.1524 8.4532 122.1649 54.3282 18.1254 178.5354 17 S 4.3558 7.7211 110.0863 59.1972 63.4280 174.6752 18 A 4.3574 7.5238 123.0500 51.9599 18.9137 176.8943 19 T 4.4651 7.9473 115.5385 61.1189 71.8836 174.5942 20 V 3.7099 8.1849 125.5789 62.1167 32.1730 173.8978 21 P 5.2521 0.0000 0.0000 62.9667 32.1334 175.8026 22 T 4.8991 8.6021 118.4471 61.5225 71.4031 173.5008 23 K 4.4270 8.2730 125.2880 55.9224 32.7437 178.5345 24 G 3.6711 8.7832 113.1507 47.7656 0.0000 173.1953 25 S 4.5498 7.3744 112.7955 56.6949 66.0018 175.1309 26 A 4.0482 8.5850 123.8669 54.5979 18.1622 178.5192 27 T 4.4483 7.2323 102.0754 60.9305 69.3179 174.2490 28 A 3.9768 7.5700 124.8221 52.6004 18.8292 178.4344 29 A 4.0304 8.5882 124.2208 54.0734 19.1708 178.0031 30 G 4.2408 7.6192 101.3750 44.6129 0.0000 171.6334 31 Y 4.6944 8.7397 119.0560 56.1297 40.0663 175.3399 32 D 4.8741 9.4738 125.2341 54.4533 42.4047 175.2610 33 I 4.8446 8.6272 123.3189 59.8898 39.7649 174.1010 34 Y 5.1090 8.7306 123.6142 55.9736 39.9455 175.5804 35 A 4.5096 9.2453 126.4590 52.3710 19.4347 177.9850 36 S 4.8728 9.0293 114.9801 58.5405 64.2508 174.1718 37 Q 4.6705 7.7777 118.3385 54.2567 32.6832 174.3154 38 D 4.7192 8.6809 122.4767 55.0807 41.6934 175.5257 39 I 4.3996 8.4813 120.1558 60.4523 42.0988 172.9108 40 T 4.9174 8.4328 123.7230 61.8413 70.9887 173.7074 41 I 4.3057 8.7100 127.8454 59.4168 38.7040 173.8868 42 P 4.9273 0.0000 0.0000 61.8436 32.7137 175.9024 43 A 4.1755 9.1001 124.6763 53.5324 19.0039 177.4812 44 M 3.4634 7.9805 119.2669 54.9747 31.0052 176.8049 45 G 4.2584 7.8687 106.5037 45.9060 0.0000 171.9223 46 Q 5.0494 8.6879 118.2010 55.8343 31.7863 173.6733 47 G 4.1486 8.6328 105.2587 45.5534 0.0000 171.9004 48 M 5.0515 8.4440 120.2821 53.5062 34.3979 174.9207 49 V 4.1170 8.9745 127.6105 62.1680 33.1889 175.4381 50 S 4.9236 8.7056 123.9115 58.5582 63.7810 174.8422 51 T 4.4896 8.6823 111.0991 60.5754 70.7271 173.8138 52 D 4.4814 8.7352 121.3170 55.2044 39.1615 172.7409 53 I 5.2059 7.6705 110.3153 59.3244 41.3430 174.2472 54 S 5.0658 8.8217 118.5882 57.0252 66.8606 172.9615 55 F 5.3623 7.8982 115.0018 56.2240 41.0270 173.6696 56 T 4.6770 8.8394 116.9301 61.9159 70.5876 174.6909 57 V 4.1943 8.6304 119.9120 60.0842 33.0877 174.5229 58 P 4.4765 0.0000 0.0000 62.2124 32.5544 176.5419 59 V 3.6980 8.3275 121.7236 65.0593 31.8976 176.4990 60 G 4.0124 9.4650 114.6840 45.1741 0.0000 172.0310 61 T 5.3082 7.6075 108.5401 59.8631 72.4836 172.2063 62 Y 4.9567 8.7202 119.1282 55.0741 42.1732 174.5120 63 G 4.2170 9.0857 107.6326 45.0817 0.0000 172.6578 64 R 5.1144 8.5026 127.3134 54.9008 31.9877 175.2045 65 I 4.5812 8.7569 128.4512 60.8683 37.4732 175.1400 66 A 4.9968 9.2665 129.5548 49.1274 22.3563 173.5250 67 P 4.7915 0.0000 0.0000 62.3946 32.8405 176.2106 68 R 4.3412 8.3782 120.4741 55.6062 31.4080 178.0843 69 S 4.2835 8.6555 117.1741 61.2048 63.1548 176.9452 70 G 3.6194 8.0239 108.9377 47.8343 0.0000 175.5555 71 L 3.8583 7.8598 120.8540 56.9560 41.5138 179.3391 72 A 4.4237 7.5721 122.0560 54.6522 18.1367 179.9331 73 V 3.4638 7.5756 115.3311 66.0519 31.7673 177.7768 74 K 4.1793 8.0819 118.0528 58.1070 32.2598 176.8586 75 N 4.7461 7.7527 112.9092 52.0310 39.8149 174.5219 76 G 3.8601 7.8694 106.5187 46.5127 0.0000 172.9570 77 I 4.7381 7.3595 119.9410 59.6176 39.1934 174.6801 78 Q 4.9112 8.9569 127.4833 54.3160 32.4786 174.3828 79 T 4.6437 8.7421 115.6152 61.6223 70.2106 173.9662 80 G 4.3834 8.8912 111.3495 43.6932 0.0000 175.3943 81 A 3.5631 10.1215 124.3600 52.8488 17.7283 179.0314 82 G 4.0075 9.1011 108.1709 47.3967 0.0000 172.3359 83 V 4.6690 7.5975 119.7653 61.4967 32.4967 174.9084 84 V 4.2531 8.8265 129.6688 61.1402 33.1782 175.0102 85 D 4.8464 8.6153 127.8800 54.0077 41.6218 177.5751 86 R 3.9893 8.9317 121.5808 59.4865 30.1934 177.0207 87 D 4.7435 7.9931 114.5838 54.0839 41.1477 175.4391 88 Y 4.3222 7.9850 122.4852 57.7051 39.0218 175.3008 89 T 4.1517 7.8015 115.4278 61.0010 69.8347 174.2319 90 G 3.3943 5.4609 111.2456 44.3402 0.0000 172.5871 91 E 4.1240 8.3191 120.3319 55.9060 30.0025 176.2494 92 V 4.0439 8.5331 127.4209 62.7106 32.1601 175.2359 93 K 4.8498 8.6725 126.4434 54.6221 35.3134 175.4335 94 V 4.2582 8.4903 123.6877 61.3495 33.5632 174.6153 95 V 4.3889 8.3020 128.3046 61.9375 33.0869 174.3291 96 L 5.1754 8.6430 127.6187 52.9549 45.0642 175.3746 97 F 5.1462 9.2065 122.1187 55.8154 41.7374 174.4154 98 N 5.0648 9.1904 122.0747 52.3975 40.4014 173.9322 99 H 5.0228 9.2412 123.7821 55.9208 29.7995 175.5542 100 S 4.6499 8.4989 115.3477 56.9716 65.5984 174.5683 101 Q 4.3889 8.5486 116.4510 55.9130 28.5896 175.7231 102 R 4.7405 7.7503 117.7138 53.9602 32.5198 175.6131 103 D 4.7410 8.9888 123.4593 54.9647 41.9750 175.7528 104 F 5.0259 9.2615 124.4833 56.5785 41.4701 173.8766 105 A 4.6065 8.3282 128.6154 50.7446 20.1438 175.9306 106 I 4.2857 8.3926 123.8839 59.3207 40.0269 175.0799 107 K 5.0125 9.0196 126.0882 53.8723 35.0462 175.7875 108 K 3.9340 8.8303 123.9036 58.7020 32.3032 177.0712 109 G 4.1210 9.3118 115.0519 45.0881 0.0000 173.1000 110 D 4.7372 8.1590 120.2904 53.8895 42.4666 175.7257 111 R 4.5158 8.3933 121.2752 55.7770 30.5777 176.6536 112 V 4.4889 8.4026 115.9777 61.1103 33.8185 174.7650 113 A 4.5643 7.3231 121.0208 51.5727 22.8348 174.5765 114 Q 4.8934 8.8638 115.3866 54.6955 32.3480 174.0339 115 L 4.8679 9.2153 124.9634 54.2571 43.7852 175.0762 116 I 4.6624 8.6234 126.9763 59.6461 40.2609 175.1569 117 L 4.4997 8.4967 127.3049 53.6531 40.8707 174.4226 118 E 4.1784 8.3112 122.5245 55.4635 30.7769 176.1177 119 K 4.8672 8.6746 124.8619 56.4370 32.9322 176.2454 120 I 4.7490 8.4589 116.9945 59.5177 41.4799 174.7129 121 V 4.1004 8.3966 122.6542 61.9085 31.3175 174.7433 122 D 5.0370 8.7322 125.9234 52.9772 39.6749 175.6603 123 D 4.8398 7.7181 117.8284 53.0721 39.8151 175.6127 124 A 4.1027 8.1138 121.3618 53.3479 19.1665 177.3411 125 Q 4.3534 8.3596 121.2015 54.7464 29.9338 175.2713 126 I 4.1372 8.2411 126.6859 60.3076 38.0700 175.2583 127 V 4.3092 8.1619 124.6374 60.7642 33.6393 174.7745 128 V 3.9551 8.3575 127.2386 62.3530 32.1995 175.2809 129 V 4.6176 7.9128 118.9331 59.3002 35.3680 175.5072 130 D 4.5002 8.6978 121.5204 57.3695 40.9219 177.3300 131 S 4.6098 7.4443 110.3445 57.0612 65.1569 174.1105 132 L 4.0720 8.4306 126.6115 55.8638 41.9953 176.8916 133 E 4.1442 7.9187 122.3671 56.5216 29.7681 174.2070 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 7 K 8.31 4.27 0.00 1.77 1.91 0.00 1.72 0.00 0.00 1.72 0.00 0.00 2.90 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.35 1.45 7.81 8 V 7.84 3.77 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 0.71 0.00 0.00 0.94 0.00 0.00 9 L 9.22 4.66 0.00 1.49 1.40 0.66 -0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 10 K 8.67 4.47 0.00 1.80 1.73 0.00 1.66 0.00 0.00 1.66 0.00 0.00 2.85 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.43 1.42 7.81 11 I 8.35 5.03 1.87 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.81 0.96 0.00 0.00 12 Q 9.24 4.58 0.00 2.07 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.90 0.00 0.00 0.00 0.00 0.00 2.24 2.29 0.00 13 L 8.52 4.74 0.00 1.56 1.59 0.90 0.97 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 14 R 9.03 4.44 0.00 1.80 1.96 0.00 3.07 0.00 0.00 3.26 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.55 0.00 15 S 7.73 4.61 0.00 3.93 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 16 A 8.45 4.15 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 17 S 7.72 4.36 0.00 3.91 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 A 7.52 4.36 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 19 T 7.95 4.47 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 0.01 0.00 0.00 20 V 8.18 3.71 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 0.80 0.00 0.00 0.91 0.00 0.00 21 P 0.00 5.25 0.00 1.91 2.14 0.00 3.72 0.00 0.00 4.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.07 0.00 22 T 8.60 4.90 4.48 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 1.30 0.00 0.00 23 K 8.27 4.43 0.00 1.60 1.76 0.00 1.69 0.00 0.00 1.52 0.00 0.00 2.34 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.12 0.62 7.81 24 G 8.78 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 25 S 7.37 4.55 0.00 4.02 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 26 A 8.58 4.05 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 27 T 7.23 4.45 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 28 A 7.57 3.98 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 29 A 8.59 4.03 1.23 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 0.00 0.00 0.00 30 G 7.62 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 31 Y 8.74 4.69 0.00 2.87 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 32 D 9.47 4.87 0.00 2.52 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 0.00 0.00 0.00 0.00 33 I 8.63 4.84 1.90 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.05 1.02 0.00 0.00 34 Y 8.73 5.11 0.00 2.85 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 35 A 9.25 4.51 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 36 S 9.03 4.87 0.00 3.87 4.12 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 37 Q 7.78 4.67 0.00 1.90 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.98 0.00 0.00 0.00 0.00 0.00 2.27 2.34 0.00 38 D 8.68 4.72 0.00 2.54 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 39 I 8.48 4.40 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 1.21 1.35 0.88 0.00 0.00 40 T 8.43 4.92 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 41 I 8.71 4.31 2.07 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.17 0.95 0.00 0.00 42 P 0.00 4.93 0.00 2.10 1.99 0.00 3.75 0.00 0.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.11 0.00 43 A 9.10 4.18 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 44 M 7.98 3.46 0.00 2.20 2.15 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.71 0.00 45 G 7.87 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 0.00 0.00 0.00 0.00 46 Q 8.69 5.05 0.00 1.68 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.68 0.00 0.00 0.00 0.00 0.00 2.24 2.28 0.00 47 G 8.63 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 48 M 8.44 5.05 0.00 1.97 1.90 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 2.42 2.47 0.00 49 V 8.97 4.12 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 0.95 0.00 0.00 50 S 8.71 4.92 0.00 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 0.00 51 T 8.68 4.49 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 1.34 0.00 0.00 52 D 8.74 4.48 0.00 2.90 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 53 I 7.67 5.21 1.99 0.00 0.00 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 1.37 1.40 1.05 0.00 0.00 54 S 8.82 5.07 0.00 3.68 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 55 F 7.90 5.36 0.00 2.98 2.94 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 56 T 8.84 4.68 4.30 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 1.34 0.00 0.00 57 V 8.63 4.19 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.00 0.00 1.10 0.00 0.00 58 P 0.00 4.48 0.00 2.08 1.98 0.00 3.60 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 2.11 2.21 0.00 59 V 8.33 3.70 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 0.95 0.00 0.00 60 G 9.46 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 0.00 0.00 0.00 61 T 7.61 5.31 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 1.22 0.00 0.00 62 Y 8.72 4.96 0.00 3.29 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 63 G 9.09 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 R 8.50 5.11 0.00 1.60 1.68 0.00 3.21 0.00 0.00 3.33 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.76 0.00 65 I 8.76 4.58 1.94 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.03 0.97 0.00 0.00 66 A 9.27 5.00 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 67 P 0.00 4.79 0.00 2.09 2.15 0.00 3.78 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.23 0.00 68 R 8.38 4.34 0.00 1.87 1.85 0.00 3.06 0.00 0.00 3.36 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.59 0.00 69 S 8.66 4.28 0.00 4.03 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 70 G 8.02 3.62 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 71 L 7.86 3.86 0.00 1.60 1.46 0.97 0.85 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 72 A 7.57 4.42 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 73 V 7.58 3.46 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 0.81 0.00 0.00 0.98 0.00 0.00 74 K 8.08 4.18 0.00 1.76 1.87 0.00 1.82 0.00 0.00 1.71 0.00 0.00 3.05 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.44 1.47 7.81 75 N 7.75 4.75 0.00 2.29 2.27 0.00 0.00 7.03 7.18 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 76 G 7.87 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 77 I 7.36 4.74 1.72 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 0.45 0.83 0.00 0.00 78 Q 8.96 4.91 0.00 2.21 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.99 0.00 0.00 0.00 0.00 0.00 2.34 2.46 0.00 79 T 8.74 4.64 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 1.24 0.00 0.00 80 G 8.89 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 81 A 10.12 3.56 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 G 9.10 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 0.00 0.00 0.00 83 V 7.60 4.67 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 0.54 0.00 0.00 0.89 0.00 0.00 84 V 8.83 4.25 2.44 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 0.94 0.00 0.00 0.98 0.00 0.00 85 D 8.62 4.85 0.00 2.75 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 86 R 8.93 3.99 0.00 2.02 2.05 0.00 3.43 0.00 0.00 3.27 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.83 0.00 87 D 7.99 4.74 0.00 2.75 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 88 Y 7.99 4.32 0.00 2.83 2.93 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 89 T 7.80 4.15 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 90 G 5.46 3.39 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 0.00 91 E 8.32 4.12 0.00 1.93 1.90 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 2.32 2.30 0.00 92 V 8.53 4.04 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 0.88 0.00 0.00 0.39 0.00 0.00 93 K 8.67 4.85 0.00 1.64 1.67 0.00 1.80 0.00 0.00 1.65 0.00 0.00 2.92 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.37 1.35 7.81 94 V 8.49 4.26 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 0.95 0.00 0.00 0.99 0.00 0.00 95 V 8.30 4.39 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 0.44 0.00 0.00 0.87 0.00 0.00 96 L 8.64 5.18 0.00 1.57 1.51 1.05 0.82 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 97 F 9.21 5.15 0.00 2.90 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 98 N 9.19 5.06 0.00 2.76 2.87 0.00 0.00 7.04 7.77 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 99 H 9.24 5.02 0.00 3.03 3.28 0.00 5.69 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 S 8.50 4.65 0.00 3.90 4.09 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 0.00 101 Q 8.55 4.39 0.00 2.07 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.71 0.00 0.00 0.00 0.00 0.00 2.33 2.32 0.00 102 R 7.75 4.74 0.00 1.71 1.85 0.00 3.21 0.00 0.00 3.24 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.58 0.00 103 D 8.99 4.74 0.00 2.59 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 F 9.26 5.03 0.00 2.98 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 0.00 105 A 8.33 4.61 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 I 8.39 4.29 1.90 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.07 0.85 0.00 0.00 107 K 9.02 5.01 0.00 1.62 1.67 0.00 1.83 0.00 0.00 1.53 0.00 0.00 2.78 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.29 1.46 7.81 108 K 8.83 3.93 0.00 1.69 1.77 0.00 1.78 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.49 1.49 7.81 109 G 9.31 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 D 8.16 4.74 0.00 2.70 2.60 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.39 4.52 0.00 1.51 1.60 0.00 3.08 0.00 0.00 2.84 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.80 0.00 112 V 8.40 4.49 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 0.73 0.00 0.00 1.00 0.00 0.00 113 A 7.32 4.56 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 0.00 114 Q 8.86 4.89 0.00 2.03 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.85 6.84 0.00 0.00 0.00 0.00 0.00 2.37 2.27 0.00 115 L 9.22 4.87 0.00 1.68 1.67 0.80 -0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 116 I 8.62 4.66 1.80 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 1.19 0.67 0.92 0.00 0.00 117 L 8.50 4.50 0.00 1.53 1.60 0.95 0.80 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 0.00 118 E 8.31 4.18 0.00 1.24 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 2.16 2.03 0.00 119 K 8.67 4.87 0.00 1.67 1.77 0.00 1.72 0.00 0.00 1.77 0.00 0.00 2.97 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.46 1.45 7.81 120 I 8.46 4.75 1.94 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.68 1.19 0.00 0.00 121 V 8.40 4.10 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 0.95 0.00 0.00 122 D 8.73 5.04 0.00 2.78 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 0.00 123 D 7.72 4.84 0.00 2.75 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 0.00 124 A 8.11 4.10 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 0.00 125 Q 8.36 4.35 0.00 2.02 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.81 0.00 0.00 0.00 0.00 0.00 2.29 2.37 0.00 126 I 8.24 4.14 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 1.30 0.67 0.91 0.00 0.00 127 V 8.16 4.31 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 0.80 0.00 0.00 0.93 0.00 0.00 128 V 8.36 3.96 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 0.86 0.00 0.00 0.93 0.00 0.00 129 V 7.91 4.62 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 0.81 0.00 0.00 0.93 0.00 0.00 130 D 8.70 4.50 0.00 2.66 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 0.00 131 S 7.44 4.61 0.00 3.78 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 0.00 132 L 8.43 4.07 0.00 1.68 1.71 0.92 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 133 E 7.92 4.14 0.00 2.15 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 2.20 2.22 0.00