NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 D 4.5517 8.3493 120.5294 53.8490 41.9310 175.2699 2 Q 4.1246 8.5186 122.9163 56.1743 29.2363 169.3116 3 V 4.2936 8.5484 110.0648 61.0637 36.1081 175.2844 4 D 5.0752 8.5951 113.9334 53.8664 40.1732 175.7143 5 V 4.2121 7.5456 112.0132 60.4210 33.1665 178.8364 6 K 4.4016 8.3537 124.7569 56.7068 30.5993 176.3480 7 D 5.4609 8.1560 124.0210 51.6916 41.3979 177.2419 8 C 4.8277 7.9462 114.5596 55.9467 40.6865 175.0811 9 A 4.8113 7.4247 123.3795 51.5944 19.1718 179.1229 10 N 5.1961 8.3076 121.5138 54.5939 41.8606 174.7626 11 N 4.1364 8.3456 112.4583 54.6414 37.6018 173.8785 12 E 4.6418 7.6416 112.5217 55.1988 31.7179 176.6898 13 I 3.9968 7.6485 118.3057 61.1441 37.6243 175.6066 14 K 4.2236 8.2146 121.1673 57.1186 33.3109 176.5188 15 K 4.2516 7.2858 114.7778 55.6334 34.9801 174.2298 16 V 4.6880 8.5872 127.7939 60.5656 33.6887 174.2898 17 M 4.8514 8.2177 124.7251 54.7781 36.8961 173.9752 18 V 4.3512 8.0691 117.6366 62.4325 34.2807 174.4312 19 D 4.5323 8.6670 128.0573 55.0851 38.5799 171.3657 20 G 3.9613 8.2478 117.7207 43.7553 0.0000 172.0643 21 C 5.7703 9.3354 132.1793 56.3216 42.1338 170.1667 22 H 4.5460 7.8847 123.9423 55.4610 27.9750 174.5013 23 G 4.2884 8.4813 112.0961 44.5834 0.0000 171.4617 24 S 3.8448 8.1755 117.0117 58.9292 61.9487 174.9329 25 D 4.6213 8.0863 126.4167 53.1011 39.7578 176.0550 26 P 4.7302 0.0000 0.0000 62.0256 29.3875 173.8599 27 C 4.5845 7.5820 126.1875 57.0769 38.1510 171.3561 28 I 4.7922 8.4855 126.5427 60.2021 38.7260 175.1295 29 I 4.8301 8.3022 126.1086 59.8389 40.9671 173.8999 30 H 5.2148 8.5198 119.5850 54.1990 31.5511 174.0824 31 R 4.3905 8.4203 116.3303 55.5979 32.2894 177.1562 32 G 4.0760 9.2119 106.3229 45.5259 0.0000 173.5531 33 K 4.5787 7.3757 117.7160 53.4378 35.9544 174.5661 34 P 4.7390 0.0000 0.0000 62.3716 31.3384 176.9492 35 F 4.9257 7.9583 130.4406 57.1534 38.7216 178.4853 36 T 4.4159 7.6798 118.7570 62.3974 66.5333 174.7696 37 L 4.0640 7.3165 125.4682 56.0367 41.2176 176.9856 38 E 4.4660 7.4632 116.8052 56.6744 33.2855 174.1780 39 A 5.2415 7.8794 135.0000 53.1617 19.8999 176.4224 40 L 4.1698 7.6975 123.3864 53.5754 44.0342 176.0209 41 F 4.4954 6.5338 111.6867 56.7710 40.1381 172.4837 42 D 4.6005 8.1214 122.6445 52.3865 41.8552 175.2160 43 A 4.3672 8.6417 129.7989 53.2089 18.4562 176.9953 44 N 5.1910 8.8230 118.3663 52.3801 39.4327 175.4854 45 Q 4.5967 7.7171 124.0848 56.5071 28.5051 177.5937 46 N 5.1956 8.3267 104.9386 52.0789 40.7301 173.5911 47 T 4.4801 7.6560 113.5975 60.2134 70.2905 174.3193 48 K 4.0959 8.8260 129.3522 59.3623 33.0833 177.0738 49 T 4.6365 7.1488 109.4016 62.9258 71.1772 173.5643 50 A 4.4522 7.4322 122.5486 52.6020 21.3702 175.9221 51 K 5.2693 8.0593 119.6876 56.7227 35.5941 175.2947 52 I 4.2737 8.0977 117.0728 61.0333 40.4522 175.2682 53 E 4.7727 8.0624 125.7676 55.0694 30.1034 175.1825 54 I 4.0737 7.6299 119.3760 61.4923 39.2342 178.2755 55 K 4.2844 8.6663 123.3878 55.9506 35.3120 173.5564 56 A 4.9490 8.2633 127.1571 49.7543 21.8253 174.8603 57 S 4.8753 8.6739 117.6787 56.3824 65.6407 173.0501 58 L 4.7608 8.5745 126.1208 52.9220 45.0474 175.8039 59 D 4.2854 8.5044 123.3623 57.4929 41.3378 177.7415 60 G 4.0985 7.8453 105.5449 45.0715 0.0000 174.3939 61 L 4.4988 7.5239 122.4055 53.9071 43.2522 174.7386 62 E 4.9150 7.8810 124.2519 54.5370 27.1122 176.2941 63 I 3.8734 7.5434 122.5636 62.1244 38.5724 175.7993 64 D 4.3444 8.0489 119.5524 53.9290 44.5557 177.0354 65 V 4.4092 7.3503 119.7238 61.2243 31.4860 173.6484 66 P 4.4738 0.0000 0.0000 62.8615 32.0740 176.2997 67 G 3.6973 7.4799 108.0160 45.8026 0.0000 175.9425 68 I 3.9228 8.3374 122.2666 64.2902 37.5009 177.0110 69 D 4.8594 8.2894 118.5401 53.0349 41.1017 175.2065 70 T 4.5505 8.3353 106.2823 61.5211 70.8758 173.2583 71 N 5.2831 9.1594 120.9346 55.8094 41.8618 174.1577 72 A 4.3723 8.2151 115.5190 53.2141 17.5546 178.7495 73 C 4.8910 8.0220 118.4327 59.7186 44.4304 175.4274 74 H 4.0748 8.3184 116.5998 57.9930 29.5168 175.2355 75 F 4.5109 8.0853 115.6730 58.1730 40.7273 174.9153 76 V 4.1533 7.3270 118.1712 60.1908 34.0059 173.9962 77 K 4.3041 7.5703 119.2128 56.8822 29.4420 178.6440 78 C 3.9281 7.9578 120.2344 59.0303 40.6370 173.5412 79 P 5.0910 0.0000 0.0000 62.1470 30.2184 175.4749 80 L 4.2396 8.3193 124.9361 53.4940 42.6600 180.7325 81 V 3.2132 7.5437 118.3066 61.8434 32.5382 172.9114 82 K 5.4069 7.8017 114.7848 56.4095 32.6978 176.5970 83 G 4.2604 7.5951 102.9865 45.8318 0.0000 172.4167 84 Q 4.6226 7.9345 118.0202 54.7983 32.3783 172.2813 85 Q 5.1597 8.8321 126.5216 54.1200 30.9350 173.7352 86 Y 4.8487 7.8149 121.8057 56.4130 41.9708 173.4634 87 D 3.9519 8.6496 119.3606 50.6807 40.1685 176.0010 88 I 4.0816 7.2585 126.8907 63.0346 38.2256 174.3887 89 K 4.2993 7.4216 118.3137 57.7648 34.8444 174.9987 90 Y 4.7342 7.3625 113.2648 56.9910 40.0862 174.0984 91 T 4.3728 7.6870 113.0661 61.6692 69.7557 174.3825 92 W 4.3628 8.3676 127.2189 56.9555 32.6358 172.5012 93 N 4.8208 8.8207 125.6977 53.4067 38.7420 173.9846 94 V 4.1778 8.4795 127.6350 62.0535 31.8879 172.6175 95 P 4.3334 0.0000 0.0000 63.9189 31.5518 177.6611 96 K 4.1767 8.2809 113.3025 56.9373 35.6926 178.2953 97 I 3.1333 8.4619 113.7509 60.6669 35.1427 173.8249 98 A 3.6100 7.6001 123.9316 51.0287 18.2075 174.9391 99 P 4.4069 0.0000 0.0000 63.1158 32.2716 172.8574 100 K 4.3015 8.4036 124.6441 55.1917 32.2470 174.7852 101 S 4.8503 8.1200 116.1980 56.0118 64.6264 174.3683 102 E 3.8831 8.7648 125.4168 59.0327 29.4206 177.0897 103 N 4.2574 7.3384 115.2491 53.6245 42.5822 173.0164 104 V 4.8176 7.4878 120.5299 62.6206 35.1067 173.2641 105 V 4.1377 7.8594 118.2234 62.4418 34.7987 170.7621 106 V 4.6655 7.6397 127.7522 61.1595 34.5294 174.2204 107 T 4.7371 7.8374 119.3991 63.4765 73.0876 172.0736 108 V 4.5790 7.5763 121.5518 63.0788 36.2168 171.3082 109 K 4.6566 7.5601 121.9483 55.8177 35.4671 172.6164 110 L 4.9447 8.0585 129.7756 53.3042 44.6258 174.8506 111 I 4.8512 7.7589 126.3727 59.3343 40.2222 175.3010 112 G 4.2824 9.0581 119.7537 45.9107 0.0000 173.2885 113 D 4.7663 9.2549 117.7312 53.8000 43.5336 173.7962 114 N 5.0173 8.2392 113.4852 52.8153 41.7335 175.4495 115 G 3.9419 7.0824 106.1093 46.2614 0.0000 173.1222 116 V 4.5025 8.2500 124.9127 59.6846 32.1183 175.5764 117 L 3.9299 8.7318 126.5037 57.4344 41.8850 177.0650 118 A 4.7675 6.8352 116.9046 51.5659 22.9762 174.6748 119 C 5.3321 8.0878 114.6257 56.8448 47.5281 172.9448 120 A 4.8410 7.6302 119.7699 51.4544 23.1069 175.5721 121 I 4.8315 8.0134 122.6645 59.6953 41.6630 174.6233 122 A 4.8271 8.3961 129.0829 49.2949 18.6096 173.7180 123 T 3.5866 8.2306 115.3684 64.7161 68.9075 171.7519 124 H 3.9351 8.7554 128.2965 55.3432 28.4181 175.1676 125 G 4.4334 8.2067 105.3980 46.0180 0.0000 172.6478 126 K 4.7718 8.4322 126.1354 54.2440 35.1690 176.2173 127 I 3.8620 8.2388 124.8968 61.7958 38.3348 172.7084 128 R 4.4290 7.8160 127.8971 53.8767 29.2438 174.1824 129 D 3.8995 7.5677 123.5795 55.0751 41.3275 176.0895 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 D 8.35 4.55 0.00 2.63 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 2 Q 8.52 4.12 0.00 2.25 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.72 6.65 0.00 0.00 0.00 0.00 0.00 2.33 2.44 0.00 3 V 8.55 4.29 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 0.82 0.00 0.00 0.99 0.00 0.00 4 D 8.60 5.08 0.00 2.66 2.59 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 0.00 0.00 0.00 5 V 7.55 4.21 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 0.83 0.00 0.00 0.96 0.00 0.00 6 K 8.35 4.40 0.00 1.85 1.77 0.00 1.66 0.00 0.00 1.70 0.00 0.00 2.86 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.46 1.39 7.81 7 D 8.16 5.46 0.00 2.68 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 8 C 7.95 4.83 0.00 2.88 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 9 A 7.42 4.81 1.17 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 10 N 8.31 5.20 0.00 2.88 2.85 0.00 0.00 6.65 6.91 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 11 N 8.35 4.14 0.00 2.77 2.83 0.00 0.00 7.02 7.65 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 12 E 7.64 4.64 0.00 2.03 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.37 0.00 13 I 7.65 4.00 1.91 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.13 0.99 0.00 0.00 14 K 8.21 4.22 0.00 1.70 1.83 0.00 1.74 0.00 0.00 1.56 0.00 0.00 2.97 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.35 1.32 7.81 15 K 7.29 4.25 0.00 1.75 1.60 0.00 1.64 0.00 0.00 1.86 0.00 0.00 2.84 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.29 1.31 7.81 16 V 8.59 4.69 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 0.91 0.00 0.00 1.01 0.00 0.00 17 M 8.22 4.85 0.00 1.98 1.98 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 2.59 2.59 0.00 18 V 8.07 4.35 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.56 0.00 0.00 1.00 0.00 0.00 19 D 8.67 4.53 0.00 2.84 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 G 8.25 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 21 C 9.34 5.77 0.00 1.90 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 22 H 7.88 4.55 0.00 3.65 3.55 0.00 5.64 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 G 8.48 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 0.00 0.00 0.00 0.00 24 S 8.18 3.84 0.00 4.12 3.87 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 25 D 8.09 4.62 0.00 2.73 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 26 P 0.00 4.73 0.00 2.17 2.11 0.00 3.35 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.87 0.00 27 C 7.58 4.58 0.00 3.20 3.20 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 0.00 28 I 8.49 4.79 1.83 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 1.45 1.04 0.89 0.00 0.00 29 I 8.30 4.83 1.45 0.00 0.00 0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.80 -0.15 0.00 0.00 30 H 8.52 5.21 0.00 2.91 3.15 0.00 5.69 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 R 8.42 4.39 0.00 1.99 2.18 0.00 3.10 0.00 0.00 3.42 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.60 0.00 32 G 9.21 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 0.00 0.00 0.00 33 K 7.38 4.58 0.00 1.61 1.65 0.00 1.68 0.00 0.00 1.74 0.00 0.00 2.84 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.37 1.35 7.81 34 P 0.00 4.74 0.00 2.27 2.25 0.00 3.39 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.96 0.00 35 F 7.96 4.93 0.00 2.18 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 T 7.68 4.42 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 1.31 0.00 0.00 37 L 7.32 4.06 0.00 1.56 1.10 1.09 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 38 E 7.46 4.47 0.00 1.90 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.48 0.00 39 A 7.88 5.24 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 40 L 7.70 4.17 0.00 1.78 1.37 0.77 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 41 F 6.53 4.50 0.00 3.18 3.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 D 8.12 4.60 0.00 2.70 2.62 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 43 A 8.64 4.37 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 N 8.82 5.19 0.00 2.82 2.91 0.00 0.00 6.32 7.44 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 45 Q 7.72 4.60 0.00 2.27 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 7.12 0.00 0.00 0.00 0.00 0.00 2.46 2.52 0.00 46 N 8.33 5.20 0.00 2.70 2.77 0.00 0.00 6.57 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 47 T 7.66 4.48 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 1.32 0.00 0.00 48 K 8.83 4.10 0.00 1.98 2.07 0.00 1.55 0.00 0.00 1.87 0.00 0.00 2.95 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.50 1.44 7.81 49 T 7.15 4.64 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 50 A 7.43 4.45 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 51 K 8.06 5.27 0.00 1.70 1.74 0.00 1.75 0.00 0.00 1.64 0.00 0.00 2.90 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.53 1.70 7.81 52 I 8.10 4.27 1.86 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 1.19 0.48 0.88 0.00 0.00 53 E 8.06 4.77 0.00 1.92 1.80 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 2.20 2.27 0.00 54 I 7.63 4.07 1.71 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 1.56 0.45 0.11 0.00 0.00 55 K 8.67 4.28 0.00 1.63 1.65 0.00 1.58 0.00 0.00 1.61 0.00 0.00 2.78 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.33 1.32 7.81 56 A 8.26 4.95 1.15 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 57 S 8.67 4.88 0.00 3.83 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 58 L 8.57 4.76 0.00 1.50 1.45 1.07 1.37 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 59 D 8.50 4.29 0.00 2.70 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 60 G 7.85 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 0.00 0.00 0.00 61 L 7.52 4.50 0.00 1.33 1.06 0.76 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 62 E 7.88 4.91 0.00 1.88 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 2.31 2.33 0.00 63 I 7.54 3.87 1.88 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.39 0.84 0.00 0.00 64 D 8.05 4.34 0.00 2.63 2.51 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.35 4.41 2.19 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 0.70 0.00 0.00 0.75 0.00 0.00 66 P 0.00 4.47 0.00 2.23 2.14 0.00 3.84 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 2.01 1.97 0.00 67 G 7.48 3.70 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 0.00 0.00 0.00 68 I 8.34 3.92 2.44 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.06 1.08 0.00 0.00 69 D 8.29 4.86 0.00 2.97 3.20 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 0.00 70 T 8.34 4.55 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 71 N 9.16 5.28 0.00 2.80 2.89 0.00 0.00 7.40 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 72 A 8.22 4.37 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 73 C 8.02 4.89 0.00 3.06 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 74 H 8.32 4.07 0.00 3.08 3.13 0.00 5.76 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 F 8.09 4.51 0.00 3.11 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 76 V 7.33 4.15 1.65 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 0.87 0.00 0.00 -0.32 0.00 0.00 77 K 7.57 4.30 0.00 1.54 1.74 0.00 1.66 0.00 0.00 1.64 0.00 0.00 2.74 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.20 1.38 7.81 78 C 7.96 3.93 0.00 3.10 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 79 P 0.00 5.09 0.00 2.18 2.14 0.00 3.27 0.00 0.00 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.93 0.00 80 L 8.32 4.24 0.00 2.00 1.81 1.51 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 81 V 7.54 3.21 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 1.03 0.00 0.00 0.99 0.00 0.00 82 K 7.80 5.41 0.00 1.90 2.20 0.00 1.45 0.00 0.00 2.39 0.00 0.00 3.04 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.35 1.39 7.81 83 G 7.60 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 84 Q 7.93 4.62 0.00 2.18 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.81 0.00 0.00 0.00 0.00 0.00 2.37 2.47 0.00 85 Q 8.83 5.16 0.00 2.23 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.49 0.00 0.00 0.00 0.00 0.00 2.15 2.22 0.00 86 Y 7.81 4.85 0.00 2.92 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 87 D 8.65 3.95 0.00 2.57 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 88 I 7.26 4.08 2.23 0.00 0.00 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 1.57 0.71 1.14 0.00 0.00 89 K 7.42 4.30 0.00 1.78 1.69 0.00 1.80 0.00 0.00 1.81 0.00 0.00 3.17 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.18 1.13 7.81 90 Y 7.36 4.73 0.00 3.08 2.90 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 91 T 7.69 4.37 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 1.22 0.00 0.00 92 W 8.37 4.36 0.00 3.69 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 93 N 8.82 4.82 0.00 2.81 2.78 0.00 0.00 7.11 7.74 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 94 V 8.48 4.18 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 0.91 0.00 0.00 1.21 0.00 0.00 95 P 0.00 4.33 0.00 2.31 2.10 0.00 3.86 0.00 0.00 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.05 0.00 96 K 8.28 4.18 0.00 1.78 1.83 0.00 1.85 0.00 0.00 1.84 0.00 0.00 2.89 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.44 1.39 7.81 97 I 8.46 3.13 1.94 0.00 0.00 1.00 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 0.47 1.03 0.00 0.00 98 A 7.60 3.61 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 99 P 0.00 4.41 0.00 2.18 2.04 0.00 3.93 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 1.98 1.98 0.00 100 K 8.40 4.30 0.00 1.91 1.83 0.00 1.78 0.00 0.00 2.33 0.00 0.00 2.91 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.32 1.29 7.81 101 S 8.12 4.85 0.00 3.88 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 0.00 102 E 8.76 3.88 0.00 2.19 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.36 0.00 103 N 7.34 4.26 0.00 2.63 2.68 0.00 0.00 6.94 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 V 7.49 4.82 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.97 0.00 0.00 105 V 7.86 4.14 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 0.75 0.00 0.00 0.91 0.00 0.00 106 V 7.64 4.67 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 1.12 0.00 0.00 1.14 0.00 0.00 107 T 7.84 4.74 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 1.19 0.00 0.00 108 V 7.58 4.58 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 1.04 0.00 0.00 0.91 0.00 0.00 109 K 7.56 4.66 0.00 1.81 1.57 0.00 1.69 0.00 0.00 1.71 0.00 0.00 2.84 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.35 1.20 7.81 110 L 8.06 4.94 0.00 1.72 1.34 1.12 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 111 I 7.76 4.85 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 1.20 1.47 0.95 0.00 0.00 112 G 9.06 4.28 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 0.00 113 D 9.25 4.77 0.00 2.57 2.59 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 0.00 0.00 0.00 114 N 8.24 5.02 0.00 2.71 2.80 0.00 0.00 6.88 7.82 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 0.00 115 G 7.08 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 0.00 0.00 0.00 116 V 8.25 4.50 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 0.73 0.00 0.00 1.00 0.00 0.00 117 L 8.73 3.93 0.00 1.53 1.59 1.04 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 118 A 6.84 4.77 0.30 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 0.00 119 C 8.09 5.33 0.00 2.93 2.90 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 0.00 120 A 7.63 4.84 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 0.00 121 I 8.01 4.83 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 1.15 0.82 0.91 0.00 0.00 122 A 8.40 4.83 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 0.00 123 T 8.23 3.59 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 1.23 0.00 0.00 124 H 8.76 3.94 0.00 3.28 3.29 0.00 5.93 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 G 8.21 4.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 K 8.43 4.77 0.00 1.65 1.65 0.00 1.63 0.00 0.00 1.79 0.00 0.00 2.85 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.40 1.42 7.81 127 I 8.24 3.86 1.85 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 1.20 0.32 0.87 0.00 0.00 128 R 7.82 4.43 0.00 1.89 1.90 0.00 3.42 0.00 0.00 3.10 7.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.42 0.00 129 D 7.57 3.90 0.00 2.52 2.39 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