NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4243 8.2893 120.3487 54.9087 33.4266 175.0362 2 R 3.8417 8.4569 121.7845 55.2529 30.1642 174.4262 3 L 4.4684 9.1230 124.1071 54.2515 45.2331 178.5273 4 N 3.8244 8.9338 118.9043 55.8481 37.5904 174.6970 5 T 3.3549 8.7266 115.2065 63.6611 65.5059 174.1184 6 L 4.1007 7.0227 118.9901 54.3978 42.2501 177.5347 7 S 5.4598 7.3759 124.7801 58.6674 62.4624 173.9015 8 P 4.7008 0.0000 0.0000 62.0946 36.2818 174.9655 9 A 5.2349 8.6448 126.5977 52.3353 18.3491 177.4231 10 E 4.7138 7.3877 113.2044 55.2214 33.6234 175.3003 11 G 4.0447 8.2905 110.1829 43.9750 0.0000 174.1044 12 S 4.2263 8.4594 117.5887 58.1543 63.2470 173.8917 13 K 3.8252 8.5139 120.3124 58.1121 32.3870 180.7594 14 K 4.4808 8.3523 118.1650 60.7855 35.0800 177.9229 15 A 3.8889 7.8473 124.4875 52.3396 15.2682 177.7124 16 G 4.0044 8.3137 109.4722 50.1546 0.0000 174.8679 17 K 4.5531 7.9977 121.5243 54.9354 35.9364 177.5164 18 R 4.4265 8.6706 122.2103 54.3408 30.0465 173.0173 19 L 4.3655 7.8385 124.2969 50.9270 44.7391 179.5031 20 G 4.1554 8.3697 113.0783 47.2483 0.0000 175.9565 21 R 3.9953 9.1122 118.7565 58.4725 30.6320 178.0464 22 G 4.0657 8.2172 105.9885 48.2881 0.0000 173.7152 23 I 3.9487 7.8640 115.8708 59.9314 36.8953 180.1771 24 G 3.9808 9.5645 120.7076 46.1731 0.0000 174.9122 25 S 3.3609 9.3727 115.0555 58.9791 62.1197 172.3197 26 G 4.0355 9.0410 102.8147 43.5994 0.0000 169.5689 27 L 3.4525 7.5592 127.4078 54.1046 42.9538 173.6463 28 G 3.9138 8.4657 114.4851 44.1132 0.0000 173.2776 29 K 4.1373 8.3642 124.4505 56.0146 32.9797 176.2210 30 T 4.0902 8.1738 113.6461 61.2294 69.9914 173.4131 31 G 3.2435 7.8568 113.1676 44.7099 0.0000 172.1948 32 G 4.1667 7.6998 108.6677 45.8256 0.0000 172.2428 33 R 3.7972 9.5559 115.9941 57.1567 31.1548 177.9659 34 G 2.9909 7.0496 104.4890 45.2207 0.0000 174.0041 35 H 4.7624 8.3415 123.0830 53.4376 30.2587 174.8130 36 K 4.4494 8.5351 129.9763 58.4933 32.8540 175.5198 37 G 4.2418 9.0301 104.9847 45.1056 0.0000 173.5627 38 Q 2.7346 8.5030 114.9833 57.6437 29.2796 173.3488 39 K 3.8433 8.4966 117.0005 55.7031 30.8170 174.3389 40 S 4.2710 8.3654 113.3288 59.4093 62.1464 174.0247 41 R 4.4983 8.3960 118.3714 56.1386 29.8654 176.8740 42 S 4.5243 7.4879 110.7685 56.4838 62.9185 173.9693 43 G 3.9507 8.1706 107.4945 46.2027 0.0000 173.2520 44 G 3.9533 7.3376 105.1700 45.4123 0.0000 174.9020 45 G 4.8910 8.8210 124.0462 47.2571 0.0000 173.4302 46 V 3.4903 6.8213 120.7081 64.8408 31.5069 175.9088 47 R 4.2894 7.8110 119.3964 55.0289 29.7447 174.3568 48 R 4.6183 8.5592 126.6165 54.1932 32.5503 171.3672 49 G 3.8209 8.4105 106.7609 45.8873 0.0000 173.8853 50 F 3.6971 8.6391 119.8973 57.6513 39.9495 176.5620 51 E 3.8052 7.7484 124.8558 60.4414 30.7582 177.3346 52 G 3.0728 7.4368 108.5520 43.9500 0.0000 175.2101 53 G 3.8373 8.5121 104.7521 45.3208 0.0000 174.3784 54 Q 2.8775 8.5771 127.9632 56.8681 28.8539 173.5659 55 M 4.6616 8.4276 115.4444 57.8107 33.9423 175.4148 56 P 4.4977 0.0000 0.0000 63.2673 32.0714 176.2920 57 L 4.0388 7.5125 118.8906 55.9018 38.7780 175.9852 58 Y 3.8355 7.3689 122.2336 59.3383 35.4207 170.8401 59 R 4.7219 7.9164 114.4820 55.8465 32.5692 175.2655 60 R 4.7174 7.7400 114.9923 57.3439 37.7400 176.0149 61 L 3.9987 7.3553 116.3760 57.3675 42.1349 175.2672 62 P 4.4934 0.0000 0.0000 62.3911 31.9043 174.4953 63 K 4.5593 8.0188 119.7803 54.4002 34.9280 176.2016 64 F 4.8312 8.3864 120.2024 58.0801 41.7395 173.8310 65 G 4.2164 8.8340 119.1026 46.1018 0.0000 176.1397 66 F 4.9315 9.3213 120.2696 56.9176 42.3591 172.7056 67 T 3.8019 8.7920 118.3307 61.5587 68.7643 173.5201 68 S 4.0597 8.1139 118.4635 58.5748 63.4256 174.2210 69 R 4.2507 7.8760 117.8364 55.0203 30.6341 176.7953 70 K 3.9465 8.7589 120.1990 59.5578 32.2624 177.7556 71 A 4.1513 7.8764 119.7024 52.1960 20.0483 176.4889 72 A 4.5602 8.2993 125.6551 52.0090 17.8083 180.9293 73 I 4.6339 8.3588 117.6373 60.9827 40.5030 175.0288 74 T 3.8277 8.4917 113.4725 61.4180 68.8282 173.8072 75 A 3.8660 8.8834 128.7963 52.5451 18.5659 176.7459 76 E 4.2494 8.7261 123.8076 56.2936 31.0330 175.6126 77 I 4.3344 8.3028 110.7062 65.5211 38.2372 174.0477 78 R 3.8653 6.7169 118.0059 54.8129 31.0152 178.0625 79 L 4.1032 8.6198 122.3541 57.6575 42.2128 179.5516 80 S 4.1060 8.2415 112.5566 61.4916 62.6603 174.7852 81 D 4.5053 7.4732 116.9381 57.1290 40.9515 178.6469 82 L 3.8193 7.6065 116.0511 58.0000 41.6450 177.4327 83 A 4.6034 8.1619 126.3049 52.0645 19.3002 178.5982 84 K 4.5036 7.7247 121.2300 57.0182 34.9606 177.3424 85 V 3.8563 7.8671 117.8578 63.7741 32.0773 176.3318 86 E 4.5364 7.6359 117.0928 54.5427 32.9250 174.4049 87 G 3.7181 8.7997 115.8876 45.3524 0.0000 173.1453 88 G 3.6945 7.9151 115.3815 45.4952 0.0000 173.3612 89 V 4.1781 7.8191 126.1142 60.0736 31.6373 177.4793 90 V 3.9659 7.9410 129.7148 61.2040 30.2283 177.7610 91 D 4.7268 7.9892 126.3436 56.3024 38.3598 179.4566 92 L 3.3515 6.1380 119.4806 57.3123 42.5556 177.6377 93 N 4.7662 8.6426 115.8293 54.4074 39.8619 175.7412 94 T 3.8197 7.5203 107.1747 63.5982 68.9417 174.4174 95 L 4.5375 7.4469 122.8283 53.4209 43.2493 177.3607 96 K 4.1575 7.9259 118.3190 56.2861 32.7043 176.3909 97 A 4.5441 8.5447 123.4774 51.2530 22.2204 177.9758 98 A 3.6037 7.4910 117.3802 53.9414 18.1371 177.1051 99 N 4.7595 8.9242 112.0501 57.1179 39.5277 176.3727 100 I 4.6672 7.1745 118.9320 59.9984 38.9539 175.2350 101 I 4.6783 8.3456 130.3512 60.6075 38.3003 176.0201 102 G 4.1666 7.9128 105.8876 44.9146 0.0000 174.0975 103 I 3.9810 8.2619 114.3197 61.6893 37.1727 177.1153 104 Q 4.5681 5.7400 119.1603 55.8037 30.3679 177.7389 105 I 4.4618 8.1507 120.2646 61.5948 37.1071 174.3248 106 E 4.4335 7.6011 119.8130 55.6799 31.9894 178.1467 107 F 4.2579 8.6129 125.6604 58.8995 39.2325 172.6268 108 A 4.1918 8.6744 124.9838 48.5761 26.0387 180.7887 109 K 4.2221 9.4840 120.8486 55.1253 30.8062 175.4411 110 V 5.1906 8.5834 106.4428 61.6025 37.7180 175.2354 111 I 2.9360 7.4735 110.1649 61.7887 38.2406 171.9147 112 L 4.6189 8.3107 118.0505 53.3022 42.9253 174.2279 113 A 4.4250 8.4811 124.9252 50.2237 21.8180 177.5551 114 G 3.9934 8.3370 105.8623 45.4898 0.0000 174.2144 115 E 3.6054 8.4856 121.2873 55.9851 28.2808 172.9889 116 V 3.4436 8.7256 116.8850 60.6901 31.4117 171.0175 117 T 4.4266 8.3829 120.2163 62.1503 69.6862 172.9487 118 T 4.0450 7.9918 122.5317 59.7407 68.1475 172.4431 119 P 4.1473 0.0000 0.0000 63.3302 30.1209 176.0208 120 V 4.0376 7.7367 117.5042 61.7673 30.2095 177.4434 121 T 4.1800 7.4754 111.7853 62.1527 67.0152 174.4589 122 V 4.6774 8.3793 127.9711 61.7246 35.0847 173.9613 123 R 4.6146 8.7324 121.1115 55.5166 32.5006 174.6662 124 G 3.6199 8.5545 110.1115 45.6515 0.0000 174.2989 125 L 4.0018 8.0123 120.8728 56.2583 42.4677 179.1247 126 R 2.9431 9.1526 120.7865 57.3670 32.5242 173.9483 127 V 3.1828 7.7703 115.5013 61.3720 31.5185 174.1276 128 T 4.2463 8.1315 114.0398 61.3647 70.7335 174.8792 129 K 4.1268 8.5911 120.3279 59.6948 32.0991 179.5147 130 G 3.7397 7.9563 106.4053 47.1765 0.0000 175.0222 131 A 4.1339 8.0872 123.4361 55.2818 18.5293 179.4973 132 R 3.9001 7.7452 116.7798 59.2665 30.0668 178.2843 133 A 4.7845 8.2803 121.2506 54.6027 18.0497 178.9587 134 A 4.0045 8.2560 119.7788 55.4845 18.4809 179.4997 135 I 4.3194 7.3075 116.5726 61.8723 37.6860 177.6250 136 E 4.2038 8.2087 119.5695 57.8170 29.5719 177.5638 137 A 4.8581 7.0836 121.7470 51.7230 20.3802 176.6040 138 A 4.2994 6.5297 131.6855 53.1691 25.1086 181.0633 139 G 3.9214 7.5924 112.2222 48.6720 0.0000 171.2780 140 G 3.8325 8.5550 105.2247 46.6878 0.0000 176.1636 141 K 3.6616 9.1908 118.9348 54.8724 30.7133 173.5399 142 I 3.1087 8.8743 119.7271 60.7008 39.5879 173.5012 143 E 4.5863 8.5723 120.9897 54.4079 31.3091 175.6732 144 E 4.0939 8.7066 121.6278 56.5706 29.6382 176.4421 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 4.42 0.00 1.97 2.03 0.00 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.60 0.00 2 R 8.46 3.84 0.00 2.04 1.92 0.00 3.07 0.00 0.00 3.19 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.68 0.00 3 L 9.12 4.47 0.00 1.62 1.59 0.92 1.05 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 4 N 8.93 3.82 0.00 2.98 2.80 0.00 0.00 6.69 7.05 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 5 T 8.73 3.35 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 1.27 0.00 0.00 6 L 7.02 4.10 0.00 1.76 1.60 0.92 0.94 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 7 S 7.38 5.46 0.00 3.96 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 8 P 0.00 4.70 0.00 2.11 1.62 0.00 3.92 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 1.82 1.89 0.00 9 A 8.64 5.23 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 10 E 7.39 4.71 0.00 1.93 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.29 0.00 11 G 8.29 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 12 S 8.46 4.23 0.00 3.87 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 13 K 8.51 3.83 0.00 1.78 1.69 0.00 1.71 0.00 0.00 1.87 0.00 0.00 2.96 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.53 1.38 7.81 14 K 8.35 4.48 0.00 2.00 2.00 0.00 1.41 0.00 0.00 1.82 0.00 0.00 3.00 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.48 1.56 7.81 15 A 7.85 3.89 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 G 8.31 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 0.00 0.00 0.00 0.00 17 K 8.00 4.55 0.00 1.60 1.12 0.00 1.63 0.00 0.00 1.63 0.00 0.00 3.05 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.42 1.45 7.81 18 R 8.67 4.43 0.00 1.74 1.80 0.00 3.29 0.00 0.00 3.22 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.66 0.00 19 L 7.84 4.37 0.00 1.68 1.45 0.92 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 20 G 8.37 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 21 R 9.11 4.00 0.00 1.64 1.99 0.00 3.36 0.00 0.00 3.23 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.71 0.00 22 G 8.22 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 23 I 7.86 3.95 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 1.35 0.96 0.91 0.00 0.00 24 G 9.56 3.98 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 25 S 9.37 3.36 0.00 3.98 3.07 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 26 G 9.04 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 27 L 7.56 3.45 0.00 1.75 1.66 0.92 0.99 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 28 G 8.47 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 0.00 0.00 0.00 29 K 8.36 4.14 0.00 1.71 1.72 0.00 1.66 0.00 0.00 1.75 0.00 0.00 3.14 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.42 1.49 7.81 30 T 8.17 4.09 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 31 G 7.86 3.24 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 32 G 7.70 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 0.00 0.00 0.00 0.00 33 R 9.56 3.80 0.00 1.79 1.89 0.00 3.22 0.00 0.00 3.23 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.66 0.00 34 G 7.05 2.99 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 35 H 8.34 4.76 0.00 3.28 3.34 0.00 5.47 0.00 0.00 0.00 0.00 6.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 K 8.54 4.45 0.00 1.80 1.52 0.00 1.60 0.00 0.00 1.67 0.00 0.00 3.10 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.40 1.43 7.81 37 G 9.03 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 38 Q 8.50 2.73 0.00 2.24 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.57 5.88 0.00 0.00 0.00 0.00 0.00 2.24 2.35 0.00 39 K 8.50 3.84 0.00 1.94 1.94 0.00 1.79 0.00 0.00 1.63 0.00 0.00 2.97 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.33 1.36 7.81 40 S 8.37 4.27 0.00 3.83 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 0.00 41 R 8.40 4.50 0.00 1.83 1.93 0.00 3.37 0.00 0.00 3.15 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.54 0.00 42 S 7.49 4.52 0.00 3.79 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 43 G 8.17 3.95 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 0.00 0.00 0.00 44 G 7.34 3.95 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 0.00 0.00 0.00 45 G 8.82 4.89 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 46 V 6.82 3.49 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 0.76 0.00 0.00 0.98 0.00 0.00 47 R 7.81 4.29 0.00 1.81 1.85 0.00 3.25 0.00 0.00 3.15 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.61 0.00 48 R 8.56 4.62 0.00 1.75 1.80 0.00 3.34 0.00 0.00 3.46 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.67 0.00 49 G 8.41 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 0.00 0.00 0.00 50 F 8.64 3.70 0.00 3.07 3.10 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 51 E 7.75 3.81 0.00 2.06 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 2.35 2.32 0.00 52 G 7.44 3.07 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 53 G 8.51 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 54 Q 8.58 2.88 0.00 2.09 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.78 0.00 0.00 0.00 0.00 0.00 2.24 2.34 0.00 55 M 8.43 4.66 0.00 1.83 1.85 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.52 0.00 56 P 0.00 4.50 0.00 2.13 1.99 0.00 3.60 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.05 0.00 57 L 7.51 4.04 0.00 1.59 1.60 0.73 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 58 Y 7.37 3.84 0.00 3.21 3.05 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 59 R 7.92 4.72 0.00 2.04 1.92 0.00 3.44 0.00 0.00 3.27 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.62 0.00 60 R 7.74 4.72 0.00 1.71 1.88 0.00 3.27 0.00 0.00 3.15 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.64 0.00 61 L 7.36 4.00 0.00 1.53 1.63 0.87 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 62 P 0.00 4.49 0.00 2.09 2.06 0.00 3.72 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.43 0.00 63 K 8.02 4.56 0.00 1.68 1.70 0.00 1.70 0.00 0.00 1.73 0.00 0.00 3.12 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.36 1.56 7.81 64 F 8.39 4.83 0.00 3.16 2.98 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 65 G 8.83 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 66 F 9.32 4.93 0.00 2.70 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 67 T 8.79 3.80 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 1.17 0.00 0.00 68 S 8.11 4.06 0.00 3.75 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 R 7.88 4.25 0.00 2.02 1.86 0.00 3.01 0.00 0.00 3.18 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.97 0.00 70 K 8.76 3.95 0.00 1.77 1.92 0.00 1.78 0.00 0.00 1.69 0.00 0.00 3.03 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.45 1.41 7.81 71 A 7.88 4.15 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 72 A 8.30 4.56 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 I 8.36 4.63 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 1.46 0.58 0.90 0.00 0.00 74 T 8.49 3.83 4.25 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 1.11 0.00 0.00 75 A 8.88 3.87 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 76 E 8.73 4.25 0.00 1.93 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.36 0.00 77 I 8.30 4.33 1.93 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 1.58 0.56 0.92 0.00 0.00 78 R 6.72 3.87 0.00 1.93 1.85 0.00 3.13 0.00 0.00 3.34 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.72 0.00 79 L 8.62 4.10 0.00 1.71 1.72 0.92 0.73 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 80 S 8.24 4.11 0.00 3.83 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 81 D 7.47 4.51 0.00 3.09 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 L 7.61 3.82 0.00 1.81 1.52 0.97 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 83 A 8.16 4.60 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 84 K 7.72 4.50 0.00 1.69 1.72 0.00 2.00 0.00 0.00 1.76 0.00 0.00 3.05 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.30 1.33 7.81 85 V 7.87 3.86 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 0.84 0.00 0.00 0.95 0.00 0.00 86 E 7.64 4.54 0.00 2.05 1.76 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 2.16 2.24 0.00 87 G 8.80 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 0.00 0.00 0.00 88 G 7.92 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 V 7.82 4.18 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 0.79 0.00 0.00 0.92 0.00 0.00 90 V 7.94 3.97 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 0.76 0.00 0.00 0.93 0.00 0.00 91 D 7.99 4.73 0.00 2.84 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 92 L 6.14 3.35 0.00 1.67 1.76 0.92 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 93 N 8.64 4.77 0.00 2.60 2.81 0.00 0.00 6.96 5.43 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 94 T 7.52 3.82 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 95 L 7.45 4.54 0.00 1.63 1.72 0.91 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 96 K 7.93 4.16 0.00 1.85 1.74 0.00 1.57 0.00 0.00 1.70 0.00 0.00 3.11 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.44 1.49 7.81 97 A 8.54 4.54 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 98 A 7.49 3.60 1.08 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 0.00 0.00 99 N 8.92 4.76 0.00 2.70 2.86 0.00 0.00 6.53 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 0.00 100 I 7.17 4.67 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 1.41 0.44 0.91 0.00 0.00 101 I 8.35 4.68 1.87 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 1.23 0.77 0.91 0.00 0.00 102 G 7.91 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 0.00 0.00 0.00 0.00 103 I 8.26 3.98 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.94 0.91 0.00 0.00 104 Q 5.74 4.57 0.00 2.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 7.41 0.00 0.00 0.00 0.00 0.00 2.28 2.33 0.00 105 I 8.15 4.46 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 1.41 0.85 0.88 0.00 0.00 106 E 7.60 4.43 0.00 2.00 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 2.34 2.38 0.00 107 F 8.61 4.26 0.00 2.95 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 A 8.67 4.19 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 0.00 109 K 9.48 4.22 0.00 2.00 2.04 0.00 1.95 0.00 0.00 1.91 0.00 0.00 2.94 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.43 1.73 7.81 110 V 8.58 5.19 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 0.72 0.00 0.00 0.95 0.00 0.00 111 I 7.47 2.94 1.88 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 1.43 0.44 0.93 0.00 0.00 112 L 8.31 4.62 0.00 1.63 1.61 0.97 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 113 A 8.48 4.42 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 G 8.34 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 0.00 115 E 8.49 3.61 0.00 2.10 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 2.17 2.38 0.00 116 V 8.73 3.44 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.93 0.00 0.00 117 T 8.38 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 0.00 118 T 7.99 4.04 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 1.28 0.00 0.00 119 P 0.00 4.15 0.00 2.15 2.06 0.00 3.72 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 2.04 0.00 120 V 7.74 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 0.78 0.00 0.00 1.01 0.00 0.00 121 T 7.48 4.18 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 0.00 122 V 8.38 4.68 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 1.00 0.00 0.00 0.98 0.00 0.00 123 R 8.73 4.61 0.00 2.01 2.15 0.00 2.98 0.00 0.00 3.33 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.60 0.00 124 G 8.55 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 0.00 125 L 8.01 4.00 0.00 1.80 1.54 0.89 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 126 R 9.15 2.94 0.00 2.24 2.56 0.00 3.62 0.00 0.00 3.46 7.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.87 0.00 127 V 7.77 3.18 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 0.82 0.00 0.00 0.95 0.00 0.00 128 T 8.13 4.25 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 1.24 0.00 0.00 129 K 8.59 4.13 0.00 1.75 1.87 0.00 1.76 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.45 1.52 7.81 130 G 7.96 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 0.00 0.00 0.00 131 A 8.09 4.13 1.40 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 0.00 0.00 132 R 7.75 3.90 0.00 1.91 1.97 0.00 3.15 0.00 0.00 3.17 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 2.04 0.00 133 A 8.28 4.78 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 0.00 134 A 8.26 4.00 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 0.00 135 I 7.31 4.32 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 1.67 1.18 0.94 0.00 0.00 136 E 8.21 4.20 0.00 2.27 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 2.33 2.30 0.00 137 A 7.08 4.86 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 0.00 138 A 6.53 4.30 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 G 7.59 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 0.00 0.00 0.00 140 G 8.55 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 0.00 0.00 0.00 141 K 9.19 3.66 0.00 1.90 1.64 0.00 1.91 0.00 0.00 1.75 0.00 0.00 3.04 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.34 1.34 7.81 142 I 8.87 3.11 1.89 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 1.51 0.66 0.91 0.00 0.00 143 E 8.57 4.59 0.00 2.04 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 2.12 2.20 0.00 144 E 8.71 4.09 0.00 1.98 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 2.30 2.25 0.00