NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 D 4.6190 8.3649 120.5285 54.1753 42.2780 175.9873 5 C 4.3744 8.5423 119.2537 56.3929 40.7321 171.7880 6 D 4.8926 8.3596 121.6752 52.4201 43.1927 175.5718 7 F 4.4878 8.7538 122.4770 60.3858 39.5131 175.3159 8 G 3.3884 8.4050 115.5271 44.5390 0.0000 173.1496 9 W 4.6943 7.7176 118.4473 55.3105 31.3398 175.8819 10 S 5.0864 9.3893 118.6104 56.1607 65.2516 171.9591 11 P 5.2078 0.0000 0.0000 62.9480 32.4657 175.3666 12 Y 4.2283 9.2239 122.7565 57.8930 42.2388 174.5397 13 D 4.0623 8.9996 127.8937 55.5279 38.2258 174.3593 14 Q 3.8721 8.0454 114.4978 56.0960 27.2201 173.0862 15 H 5.0832 8.3960 114.6152 54.0433 33.2352 171.6886 16 C 5.8529 9.0385 116.5420 55.7031 39.3943 173.2142 17 Y 5.7379 9.7165 119.3149 56.6633 42.2013 174.2716 18 Q 4.3088 8.8824 122.4289 54.3014 32.8506 173.1428 19 A 4.5706 7.9570 127.6874 50.7865 20.4586 176.1915 20 F 4.3152 8.2789 121.9439 55.4358 40.8780 176.7292 21 N 4.3463 8.6053 119.8598 53.8855 38.0675 175.2025 22 E 3.8178 8.1134 118.4274 57.2567 29.7226 176.2211 23 Q 4.6154 8.6424 123.3473 55.3700 29.5437 175.5385 24 K 4.9206 9.2890 123.0628 54.4353 37.1803 176.1552 25 T 5.0198 8.3937 111.9772 60.9910 70.0273 175.1046 26 W 2.9417 8.4854 131.6756 60.4521 30.4230 177.6597 27 D 4.3819 8.1799 118.0296 57.7306 40.2536 178.7930 28 E 3.8745 8.0831 118.5429 58.8875 29.2900 179.3241 29 A 2.8146 7.6661 121.1671 54.6607 18.3765 179.0545 30 E 3.4377 7.3914 117.9818 59.3297 29.3016 179.1251 31 K 3.8158 7.5696 116.9676 59.4419 32.4091 178.6908 32 F 4.0526 8.2184 120.9625 61.4271 39.2734 176.4675 33 C 4.3643 8.3516 116.2416 60.2492 34.2017 176.4089 34 R 3.8035 8.3155 120.4496 58.0303 29.3317 177.8925 35 A 4.3143 7.1987 117.8167 51.3378 19.3052 176.6715 36 Q 4.4681 7.5917 118.3881 55.5974 31.4352 175.4488 37 E 3.8604 8.2759 121.2748 58.1321 28.2595 174.8530 38 N 4.6356 8.5934 123.3515 53.8945 37.4022 175.9593 39 G 4.0131 8.2181 108.9586 46.4548 0.0000 173.7397 40 A 4.4881 7.8176 128.2111 51.5557 21.5720 174.9474 41 H 4.8658 8.7457 114.4565 53.7279 33.7472 173.5158 42 L 4.6200 8.9705 119.7978 54.9145 42.3104 177.6948 43 A 4.3140 9.2175 125.2923 52.6435 19.2493 177.3330 44 S 4.7529 8.7690 116.8475 57.0989 64.8664 173.9650 45 I 4.7721 8.2168 121.7190 60.2765 39.0955 175.1112 46 E 4.7866 9.4365 124.7093 55.7045 30.5540 176.4658 47 S 4.6704 7.6151 112.6699 56.5137 66.4599 175.8210 48 N 4.5040 8.7048 120.4247 56.6049 38.2527 177.9276 49 G 3.8365 8.0561 107.9479 47.2584 0.0000 175.3096 50 E 3.5345 8.5423 121.6174 58.6432 29.6625 178.5737 51 A 4.1004 8.5675 121.3342 55.5350 18.4948 179.3849 52 D 4.3267 8.4658 117.6601 57.3841 40.8412 178.9023 53 F 4.0915 7.9088 121.2280 61.1884 39.2447 177.4037 54 V 3.4048 7.9381 118.0677 65.8443 31.2202 177.6875 55 S 4.1173 8.0572 112.9580 61.2797 62.3157 176.0807 56 W 4.2284 8.1283 130.7528 60.3134 30.2366 177.3695 57 L 3.2619 7.4330 119.3537 58.1673 41.7200 178.7764 58 I 3.5166 7.6638 119.8754 64.2863 36.7764 178.6372 59 S 4.1785 7.9790 113.9133 60.9630 62.7712 175.5355 60 Q 4.4378 7.3143 118.7615 54.9124 29.1758 175.9723 61 K 4.1332 7.4666 121.4975 54.7876 31.4422 177.1263 62 D 4.3221 8.3440 125.3956 57.0125 41.0190 179.0524 63 E 4.0836 7.9602 117.2338 58.5588 29.8426 177.2522 64 L 4.3954 7.8677 118.5016 54.4557 41.6636 178.3875 65 A 3.9990 7.5211 123.6648 54.8809 18.2668 178.9447 66 D 4.6625 7.8889 112.2674 53.2335 40.1536 175.8572 67 E 4.3325 7.9007 122.2835 55.9703 30.3999 175.4307 68 D 4.7395 8.7163 123.9692 53.8610 41.8941 175.3939 69 Y 5.1133 7.9742 115.5447 56.1322 42.3144 174.9968 70 V 4.5711 8.8087 121.7273 60.8577 35.3014 174.7226 71 W 5.2973 9.3144 128.5365 56.9340 30.4444 175.3392 72 I 5.1363 9.0001 116.3935 58.6586 41.0507 175.7341 73 G 4.2274 9.1559 109.2082 45.8501 0.0000 173.2478 74 L 4.2292 7.8052 123.5910 54.4253 43.1858 175.8593 75 R 4.3911 8.1662 125.4220 54.3101 33.0202 174.0680 76 A 4.1179 8.6566 129.4160 52.1463 18.4109 177.4812 77 Q 4.1022 8.6459 120.6988 56.8951 29.7707 176.1507 78 N 4.3172 7.9940 116.6854 53.5098 39.2178 174.9610 79 K 4.0886 8.5692 124.8677 58.9557 32.5553 177.5457 80 E 4.1697 8.3909 118.3738 56.1050 29.8028 177.3109 81 Q 4.1544 8.4444 120.2941 58.0626 29.2232 176.4585 82 Q 4.5170 7.5293 113.9412 55.0864 31.3241 173.9803 83 C 4.4015 8.5060 116.3482 59.6794 28.5155 173.8447 84 S 4.4571 8.2063 117.8857 57.2908 62.3335 174.3899 85 S 4.3576 8.4044 120.3552 58.8080 63.7137 173.6658 86 E 5.1601 7.5691 120.0161 54.0374 32.6540 175.7004 87 W 4.4350 8.9115 122.8850 56.2395 29.7664 177.7221 88 S 4.2082 8.9474 115.1837 61.2746 62.3965 174.9189 89 D 4.5613 8.2531 118.4146 53.5261 39.4222 176.9821 90 G 4.0594 8.5651 110.1569 45.3533 0.0000 174.3463 91 S 4.6411 8.4128 115.0283 58.0672 64.4487 174.1533 92 S 4.8947 8.6397 116.0957 58.1646 64.3067 173.4536 93 V 3.9515 8.2358 122.1996 62.7924 31.3843 173.9520 94 S 4.5600 9.1521 120.6808 59.2984 65.2925 172.7778 95 Y 4.2784 7.9477 122.6590 58.1425 39.3576 175.7899 96 E 4.2902 7.5646 122.0656 55.2396 32.1140 174.7045 97 N 4.6185 8.1499 119.9401 51.7489 38.6783 173.4151 98 L 4.6386 7.6948 120.5063 53.9371 42.6065 178.5190 99 I 3.6307 7.5885 122.7512 64.3485 36.9956 176.9024 100 D 4.7929 7.9912 116.1220 53.5570 41.0557 175.2386 101 L 4.6907 7.4756 121.0414 53.4263 43.9762 175.3376 102 H 4.7848 8.5554 122.5302 54.4445 30.0366 175.0048 103 T 4.2733 8.2459 117.5496 61.8862 68.2519 173.5059 104 K 4.8011 7.9616 122.7639 53.1877 32.3044 175.9696 105 K 4.5430 7.8689 117.3115 55.8665 34.2616 176.1680 106 C 4.8706 7.9708 117.0463 54.9485 39.4190 172.9550 107 G 4.7265 8.8939 108.8920 44.8589 0.0000 172.5306 108 A 5.5542 9.4055 124.5054 50.1980 23.2983 174.9522 109 L 5.0587 9.2113 119.3268 53.5385 44.4093 175.5658 110 E 4.5098 8.3445 121.2243 54.1186 32.9201 176.2042 111 K 2.4800 8.1327 128.2639 58.9958 32.3852 178.8047 112 L 3.9409 7.4465 117.0432 57.3284 41.8196 177.9895 113 T 4.3242 7.4330 107.3299 61.1492 68.9604 174.9820 114 G 3.6642 8.1762 108.4129 46.5997 0.0000 174.2673 115 F 4.0183 7.5099 115.4321 58.8197 37.1732 175.9492 116 R 4.5156 7.6244 116.5124 57.8704 31.9303 175.9894 117 K 4.0676 7.8153 115.9670 55.9968 32.7005 176.6175 118 W 5.1046 8.3087 122.8887 56.6901 30.1741 176.1573 119 V 4.8074 9.0758 116.9297 59.4890 35.2786 174.6252 120 N 5.2751 8.8772 121.4022 53.0119 38.7823 173.2432 121 Y 4.4275 9.0179 121.5668 56.6333 43.7264 173.0170 122 Y 4.6244 6.7652 118.4415 56.7260 38.2446 177.5533 123 C 3.9869 9.0309 123.5144 59.8315 40.4401 175.1538 124 E 4.4781 8.1098 115.9903 56.2910 29.6072 176.2565 125 Q 4.3184 8.4682 119.7213 56.0292 29.5258 174.6928 126 M 5.0953 8.5197 121.1282 54.5623 33.2500 175.1566 127 H 5.1460 9.6521 120.0422 53.8857 34.1946 173.0027 128 A 4.9830 9.1304 123.1477 52.9151 19.7551 176.1025 129 F 5.4695 8.1048 112.1815 56.3015 41.8981 173.2803 130 V 4.8840 8.7332 118.7729 61.4855 34.4651 173.7371 131 C 5.6521 9.4607 124.9358 55.6296 38.4276 172.5978 132 K 5.3460 9.3478 122.6541 54.7510 35.4524 174.9823 133 L 5.0548 8.9913 126.1251 54.1038 44.7098 174.7806 134 L 4.6755 8.2731 119.8748 52.7545 42.6835 175.3327 135 P 4.2330 0.0000 0.0000 62.9315 31.4899 176.0699 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 D 8.36 4.62 0.00 2.69 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 5 C 8.54 4.37 0.00 3.17 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 6 D 8.36 4.89 0.00 2.67 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 7 F 8.75 4.49 0.00 2.99 3.11 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 8 G 8.41 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 9 W 7.72 4.69 0.00 3.39 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 10 S 9.39 5.09 0.00 3.90 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 11 P 0.00 5.21 0.00 2.15 2.14 0.00 3.94 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 2.12 2.06 0.00 12 Y 9.22 4.23 0.00 1.43 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 0.00 0.00 0.00 13 D 9.00 4.06 0.00 2.45 2.48 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 14 Q 8.05 3.87 0.00 2.18 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.33 6.79 0.00 0.00 0.00 0.00 0.00 2.18 2.31 0.00 15 H 8.40 5.08 0.00 3.03 3.00 0.00 5.55 0.00 0.00 0.00 0.00 6.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 C 9.04 5.85 0.00 2.70 3.18 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 17 Y 9.72 5.74 0.00 3.20 3.03 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 18 Q 8.88 4.31 0.00 0.93 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.88 0.00 0.00 0.00 0.00 0.00 1.16 1.38 0.00 19 A 7.96 4.57 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 F 8.28 4.32 0.00 1.51 2.26 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 21 N 8.61 4.35 0.00 2.73 2.79 0.00 0.00 6.16 7.66 0.00 0.00 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 E 8.11 3.82 0.00 1.90 1.95 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 2.30 2.31 0.00 23 Q 8.64 4.62 0.00 1.97 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.87 6.81 0.00 0.00 0.00 0.00 0.00 2.60 2.54 0.00 24 K 9.29 4.92 0.00 1.50 1.52 0.00 1.16 0.00 0.00 1.45 0.00 0.00 2.77 0.00 0.00 2.38 0.00 0.00 0.00 0.00 1.31 1.58 7.81 25 T 8.39 5.02 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 1.31 0.00 0.00 26 W 8.49 2.94 0.00 1.78 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 27 D 8.18 4.38 0.00 2.77 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 28 E 8.08 3.87 0.00 1.90 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 2.28 2.44 0.00 29 A 7.67 2.81 0.57 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 30 E 7.39 3.44 0.00 1.16 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 2.06 2.20 0.00 31 K 7.57 3.82 0.00 1.83 1.80 0.00 1.72 0.00 0.00 1.73 0.00 0.00 2.95 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.41 1.44 7.81 32 F 8.22 4.05 0.00 2.97 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 33 C 8.35 4.36 0.00 3.14 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 34 R 8.32 3.80 0.00 1.85 1.87 0.00 3.22 0.00 0.00 3.05 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.55 0.00 35 A 7.20 4.31 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 36 Q 7.59 4.47 0.00 2.35 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 5.73 0.00 0.00 0.00 0.00 0.00 2.22 2.53 0.00 37 E 8.28 3.86 0.00 1.78 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 2.11 1.47 0.00 38 N 8.59 4.64 0.00 2.75 2.81 0.00 0.00 6.16 7.00 0.00 0.00 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 G 8.22 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 40 A 7.82 4.49 1.41 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 41 H 8.75 4.87 0.00 3.09 3.15 0.00 5.63 0.00 0.00 0.00 0.00 6.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 L 8.97 4.62 0.00 1.50 1.62 -0.13 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 43 A 9.22 4.31 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 S 8.77 4.75 0.00 4.04 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 45 I 8.22 4.77 2.35 0.00 0.00 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 1.56 1.26 1.22 0.00 0.00 46 E 9.44 4.79 0.00 2.10 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 0.00 2.33 2.32 0.00 47 S 7.62 4.67 0.00 4.08 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 48 N 8.70 4.50 0.00 2.78 2.93 0.00 0.00 6.71 7.59 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 49 G 8.06 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 0.00 0.00 0.00 50 E 8.54 3.53 0.00 2.29 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.39 0.00 51 A 8.57 4.10 1.46 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 0.00 0.00 52 D 8.47 4.33 0.00 2.82 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 53 F 7.91 4.09 0.00 2.31 2.54 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 54 V 7.94 3.40 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 1.07 0.00 0.00 0.99 0.00 0.00 55 S 8.06 4.12 0.00 4.12 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 56 W 8.13 4.23 0.00 3.26 3.11 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 57 L 7.43 3.26 0.00 0.94 1.53 0.57 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 58 I 7.66 3.52 1.63 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.63 -0.21 0.00 0.00 59 S 7.98 4.18 0.00 4.05 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 Q 7.31 4.44 0.00 1.62 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 7.02 0.00 0.00 0.00 0.00 0.00 1.92 1.76 0.00 61 K 7.47 4.13 0.00 1.74 1.56 0.00 1.43 0.00 0.00 1.41 0.00 0.00 2.70 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.14 1.07 7.81 62 D 8.34 4.32 0.00 2.64 2.67 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 63 E 7.96 4.08 0.00 1.83 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 2.23 2.32 0.00 64 L 7.87 4.40 0.00 1.68 1.51 0.66 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 65 A 7.52 4.00 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 66 D 7.89 4.66 0.00 2.80 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 67 E 7.90 4.33 0.00 1.94 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 0.00 2.27 2.38 0.00 68 D 8.72 4.74 0.00 2.37 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 69 Y 7.97 5.11 0.00 1.93 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 V 8.81 4.57 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 0.85 0.00 0.00 0.56 0.00 0.00 71 W 9.31 5.30 0.00 3.49 3.11 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 72 I 9.00 5.14 2.13 0.00 0.00 0.58 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 1.04 1.07 0.00 0.00 73 G 9.16 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 0.00 0.00 0.00 0.00 74 L 7.81 4.23 0.00 1.57 1.46 0.69 0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 75 R 8.17 4.39 0.00 1.05 1.49 0.00 2.54 0.00 0.00 2.25 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 1.25 0.00 76 A 8.66 4.12 1.10 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 0.00 0.00 77 Q 8.65 4.10 0.00 2.01 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.84 0.00 0.00 0.00 0.00 0.00 2.26 2.24 0.00 78 N 7.99 4.32 0.00 2.63 2.68 0.00 0.00 7.02 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 K 8.57 4.09 0.00 1.75 1.82 0.00 1.78 0.00 0.00 1.68 0.00 0.00 2.95 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.41 1.43 7.81 80 E 8.39 4.17 0.00 1.98 1.91 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 2.40 2.37 0.00 81 Q 8.44 4.15 0.00 1.98 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.72 0.00 0.00 0.00 0.00 0.00 2.31 2.24 0.00 82 Q 7.53 4.52 0.00 1.99 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 7.16 0.00 0.00 0.00 0.00 0.00 2.09 2.32 0.00 83 C 8.51 4.40 0.00 2.92 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 84 S 8.21 4.46 0.00 3.80 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 S 8.40 4.36 0.00 3.96 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 86 E 7.57 5.16 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 2.22 2.29 0.00 87 W 8.91 4.43 0.00 3.56 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 88 S 8.95 4.21 0.00 4.04 4.11 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 89 D 8.25 4.56 0.00 2.82 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 90 G 8.57 4.06 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 0.00 91 S 8.41 4.64 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 92 S 8.64 4.89 0.00 3.95 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 93 V 8.24 3.95 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 0.66 0.00 0.00 0.23 0.00 0.00 94 S 9.15 4.56 0.00 3.90 3.82 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 95 Y 7.95 4.28 0.00 3.03 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 E 7.56 4.29 0.00 1.89 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 2.24 2.12 0.00 97 N 8.15 4.62 0.00 2.58 2.73 0.00 0.00 6.93 7.78 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 98 L 7.69 4.64 0.00 1.65 1.56 0.88 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 99 I 7.59 3.63 1.96 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 1.28 0.43 0.89 0.00 0.00 100 D 7.99 4.79 0.00 2.63 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 0.00 101 L 7.48 4.69 0.00 1.52 1.50 0.95 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 102 H 8.56 4.78 0.00 3.15 3.28 0.00 5.75 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 T 8.25 4.27 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 1.18 0.00 0.00 104 K 7.96 4.80 0.00 1.55 1.53 0.00 1.46 0.00 0.00 0.61 0.00 0.00 2.80 0.00 0.00 2.86 0.00 0.00 0.00 0.00 0.30 0.97 7.81 105 K 7.87 4.54 0.00 1.53 1.58 0.00 1.53 0.00 0.00 1.72 0.00 0.00 2.74 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.32 1.33 7.81 106 C 7.97 4.87 0.00 2.72 2.26 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 0.00 107 G 8.89 4.73 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 0.00 0.00 0.00 108 A 9.41 5.55 1.07 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 0.00 109 L 9.21 5.06 0.00 1.83 1.93 1.12 1.27 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 0.00 110 E 8.34 4.51 0.00 1.69 1.59 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 1.96 1.67 0.00 111 K 8.13 2.48 0.00 1.36 1.35 0.00 1.92 0.00 0.00 1.53 0.00 0.00 2.89 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.18 1.16 7.81 112 L 7.45 3.94 0.00 1.46 1.61 0.84 0.67 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 0.00 113 T 7.43 4.32 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 1.16 0.00 0.00 114 G 8.18 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 7.51 4.02 0.00 3.18 3.04 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 0.00 116 R 7.62 4.52 0.00 1.81 1.88 0.00 3.31 0.00 0.00 3.21 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.60 0.00 117 K 7.82 4.07 0.00 1.76 1.71 0.00 1.75 0.00 0.00 1.64 0.00 0.00 2.86 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.33 1.40 7.81 118 W 8.31 5.10 0.00 3.39 3.04 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 0.00 119 V 9.08 4.81 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 0.88 0.00 0.00 1.10 0.00 0.00 120 N 8.88 5.28 0.00 2.88 2.85 0.00 0.00 5.81 7.55 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 0.00 121 Y 9.02 4.43 0.00 2.80 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 0.00 122 Y 6.77 4.62 0.00 2.75 2.70 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 0.00 123 C 9.03 3.99 0.00 2.91 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 0.00 124 E 8.11 4.48 0.00 1.98 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.28 0.00 125 Q 8.47 4.32 0.00 2.65 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.79 0.00 0.00 0.00 0.00 0.00 2.39 2.46 0.00 126 M 8.52 5.10 0.00 1.97 2.05 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 2.62 2.73 0.00 127 H 9.65 5.15 0.00 2.53 3.15 0.00 5.63 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 A 9.13 4.98 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 0.00 129 F 8.10 5.47 0.00 3.36 3.38 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 0.00 130 V 8.73 4.88 2.24 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 1.23 0.00 0.00 0.89 0.00 0.00 131 C 9.46 5.65 0.00 3.46 3.42 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 0.00 132 K 9.35 5.35 0.00 1.78 1.63 0.00 1.71 0.00 0.00 1.73 0.00 0.00 2.63 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.17 0.69 7.81 133 L 8.99 5.05 0.00 1.52 1.54 0.46 -0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.45 0.00 0.00 0.00 0.00 0.00 0.00 134 L 8.27 4.68 0.00 1.49 1.56 0.88 0.84 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 0.00 135 P 0.00 4.23 0.00 2.19 1.91 0.00 3.68 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.89 0.00