NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 G 3.8491 8.3544 109.7209 44.9830 0.0000 174.0755 4 D 4.2650 8.2904 121.9908 52.8900 43.1823 175.7775 5 K 3.9568 9.3173 127.9219 59.6427 32.8784 179.0568 6 K 4.4428 8.0298 119.7090 58.6680 32.0276 179.2744 7 V 3.6941 8.3643 118.7712 66.1955 31.4667 178.1040 8 I 3.7236 7.8642 119.3479 64.5180 36.8823 178.3433 9 Q 3.9774 8.1973 118.7945 59.3001 28.4740 178.6957 10 H 4.1346 8.6324 117.3982 58.9107 28.7214 177.7926 11 L 4.0061 8.4365 120.9880 58.0883 41.4796 179.4871 12 N 4.3383 8.7573 116.6104 55.9747 38.4035 177.4672 13 K 3.9495 8.2092 121.4071 59.4848 32.2543 178.9972 14 I 3.7279 8.0318 120.3277 64.1261 36.9298 177.9376 15 L 4.0309 8.2131 121.5493 58.3047 41.8470 179.2715 16 G 3.6386 8.2204 105.4440 48.0109 0.0000 175.2801 17 N 4.3659 8.2752 118.8052 56.0951 38.4880 177.3941 18 E 3.9733 8.3286 120.0587 59.3403 29.4155 179.2008 19 L 3.9716 8.2116 119.3806 57.8914 41.5731 179.7758 20 I 3.6360 7.5791 118.9332 64.2674 36.9839 178.2662 21 A 3.2166 7.7912 121.5232 54.8560 18.1233 179.4645 22 I 3.6251 7.9193 118.6124 64.9564 37.2805 178.4791 23 N 4.3967 7.7774 117.0094 56.1347 38.3693 177.4702 24 Q 3.8429 8.1699 121.3095 59.4505 29.1379 177.9411 25 Y 4.8579 7.9701 119.4327 60.5993 37.9138 178.1143 26 F 3.9981 8.4870 121.8072 61.0870 39.4018 177.0546 27 L 4.0248 8.2372 120.1172 58.4796 41.8334 178.6416 28 H 3.8350 8.2268 116.2188 58.5544 28.4399 177.7831 29 S 4.3154 8.2548 115.1026 61.6930 62.2407 176.5741 30 R 3.8328 7.8908 120.3873 58.9455 29.6997 179.0983 31 M 3.4962 7.9705 119.2468 57.8915 31.8537 178.5965 32 W 4.4832 7.9005 119.3419 59.8774 29.1395 178.3281 33 N 4.3423 8.4550 116.4948 56.4964 37.8223 176.7178 34 D 4.3444 7.9686 118.2422 57.1955 41.2671 177.6849 35 W 4.9297 7.9056 116.2755 56.3492 29.0406 176.7982 36 G 3.9732 8.3958 107.9933 46.5193 0.0000 174.4679 37 L 4.8793 8.2550 121.7893 53.0676 40.3757 177.5652 38 K 4.0064 8.4037 121.8392 59.2079 32.4056 179.0503 39 R 3.8756 7.9819 119.2359 59.2515 29.9584 178.4842 40 L 3.8192 7.8106 118.5289 57.5386 41.4498 179.5439 41 G 3.7521 8.2931 105.5526 47.8667 0.0000 175.6274 42 A 3.9822 8.3119 123.9497 54.9813 18.3240 179.2479 43 H 3.9746 8.2590 116.8140 59.4365 29.8532 177.1740 44 E 3.9597 8.5400 121.2573 59.3275 29.4066 178.0491 45 Y 4.0009 8.2612 119.8593 61.0210 38.7350 177.9360 46 H 4.0442 8.0478 117.0274 58.6860 28.7663 177.5428 47 E 3.7829 8.2509 120.7050 59.2985 29.1499 179.2119 48 S 4.2776 8.1647 113.0201 61.7014 62.4898 176.2369 49 I 3.5719 7.6260 122.3645 64.5068 36.7899 178.0264 50 D 4.2729 8.1841 119.6519 57.5671 40.5772 178.8703 51 E 4.1706 8.2738 118.9306 59.6456 29.3987 179.2402 52 M 4.0262 8.3004 118.9886 58.3799 32.0759 179.0100 53 K 3.9716 7.9581 118.6116 59.6007 32.1277 179.0605 54 H 4.2376 8.0811 116.3361 58.9139 28.5768 177.5605 55 A 3.9841 8.2767 122.6761 55.2914 18.2031 179.0878 56 D 4.2689 8.2840 116.4920 57.5195 41.2542 178.7743 57 K 4.0273 8.0059 118.4781 59.1991 31.9641 179.2115 58 L 3.9678 8.1491 119.4794 58.0698 41.6479 179.5449 59 I 3.7088 8.0247 119.7738 64.6532 37.0242 178.3840 60 E 4.0279 8.2762 119.2673 59.2623 29.1652 179.4912 61 R 3.9798 8.0649 118.7764 59.4455 30.2056 178.2958 62 I 3.7203 8.0388 120.0244 64.7561 37.1387 178.3957 63 L 4.0566 8.0471 119.4430 57.6747 41.2021 179.3190 64 F 4.2749 8.2624 119.8597 61.1909 39.4143 176.4300 65 L 3.9258 8.0065 115.3471 54.3000 41.3737 176.6174 66 E 3.6611 7.9832 117.4871 57.4297 27.1275 174.7401 67 G 3.9219 8.2073 108.2792 44.2173 0.0000 173.7080 68 L 4.5609 8.0221 118.9406 52.0789 42.5601 175.1760 69 P 4.4102 0.0000 0.0000 62.2690 31.8683 175.8246 70 N 4.6358 9.4109 122.7240 52.6411 38.3087 174.2696 71 L 4.5883 8.2911 124.3876 54.5470 42.5817 177.4536 72 Q 4.0580 8.4528 121.4845 58.0874 29.3252 175.6275 73 D 4.5262 8.1667 118.0520 53.0555 41.1079 175.3721 74 L 4.4555 8.2934 127.1452 52.7676 42.9571 176.5834 75 G 3.7986 8.3199 116.3730 44.9571 0.0000 171.1134 76 K 4.1496 8.3398 120.8217 55.3747 32.5282 177.0089 77 L 3.9991 8.4341 127.0318 54.7085 42.0655 176.8815 78 L 4.3957 8.8123 124.7111 53.3982 41.0247 175.5823 79 I 4.3312 8.0710 124.7683 59.3627 38.1421 176.6672 80 G 3.9861 8.6515 114.6414 45.1532 0.0000 172.5934 81 E 4.6422 8.8482 117.8399 56.2863 31.1018 176.1085 82 N 5.1632 7.7085 115.5177 50.3680 42.0125 175.1777 83 T 4.4127 8.5590 116.0785 67.1926 68.6686 176.4460 84 Q 4.0046 8.2251 120.8252 59.3903 29.0374 178.2109 85 E 4.0143 8.8565 119.6610 59.6016 29.4854 179.0706 86 M 3.9405 8.4027 119.0535 58.5428 31.9872 178.9136 87 L 4.2046 8.2820 119.0044 57.8804 41.8188 179.3766 88 Q 4.0411 8.1762 119.4400 59.2895 28.9569 177.9969 89 C 4.2769 8.6579 118.3976 62.7258 28.1365 175.8059 90 D 4.6368 8.4317 120.7964 57.2401 40.3691 178.5065 91 L 3.9820 8.0339 120.8709 58.2532 42.2467 178.6393 92 N 4.3170 8.2842 116.4196 56.3107 38.4867 177.0368 93 L 3.9968 7.9849 121.5598 58.4277 42.1480 178.9962 94 E 4.1124 8.4749 118.3958 59.2189 29.3256 179.2872 95 L 4.0077 8.2898 119.5714 57.5491 41.6274 179.4469 96 K 3.9550 8.0676 119.0028 59.3930 32.1324 178.7262 97 A 4.0079 8.1930 121.1776 55.5324 18.3099 179.5655 98 T 3.8377 8.2504 111.7626 64.8071 67.3846 176.4589 99 K 3.9108 7.9072 121.4036 59.7685 32.2026 178.5289 100 D 4.4169 8.2579 119.0719 57.3209 40.6779 178.8886 101 L 3.9959 8.1603 119.6376 57.8380 41.5429 179.7627 102 R 3.9483 8.0780 118.0262 59.2531 30.0154 178.9779 103 E 3.9252 8.2201 118.1678 59.3494 29.4844 179.1543 104 A 3.6278 8.2286 121.0353 55.1925 18.3978 179.8474 105 I 3.6802 7.8087 118.2635 64.2341 37.2322 178.4377 106 V 3.5755 7.9771 119.5700 66.6359 31.2678 177.6524 107 H 4.1551 8.0976 117.4846 59.3697 29.6689 176.9069 108 C 3.9695 8.0790 118.6174 62.5923 27.8677 175.5858 109 E 3.8386 8.1468 120.7893 59.4197 29.0387 178.4393 110 Q 3.9164 7.5893 117.8500 59.1383 29.1093 178.1509 111 V 3.8462 7.1639 109.6377 60.5472 31.8159 175.6001 112 H 2.8688 7.5832 114.6362 57.0958 26.6836 176.1973 113 D 4.5368 7.6485 120.2457 53.2787 38.5190 175.2853 114 Y 4.3396 7.4518 121.3215 60.3011 38.3676 177.7481 115 V 3.7076 7.8428 119.2561 65.8600 31.7141 178.0931 116 S 4.1008 8.6637 115.1454 61.5928 62.7070 176.2629 117 R 3.8837 8.0878 121.4901 59.8488 29.6939 177.9386 118 D 4.3452 7.9788 117.0859 57.2227 41.2555 177.8668 119 L 3.9773 7.9693 120.9431 58.2076 42.0848 179.0173 120 L 4.0188 8.1313 119.1145 57.5198 41.5362 179.3214 121 K 3.9685 8.5594 120.1506 59.6011 32.1109 178.6203 122 D 4.3797 8.1342 119.1902 57.4342 40.6674 178.7608 123 I 3.5213 7.7253 120.3372 64.2496 36.9985 178.2671 124 L 3.9820 7.9198 121.2323 57.9518 41.9048 178.6810 125 E 3.9178 8.3475 119.4623 59.2575 29.6045 178.6299 126 S 4.3116 8.0894 113.2438 61.6546 62.4564 176.0992 127 E 4.1427 8.6767 121.6211 59.3580 29.1946 179.1655 128 E 4.0649 8.5087 118.9723 59.3246 29.5046 179.1405 129 E 4.0372 8.3463 118.7892 59.6425 29.5110 178.8018 130 H 4.3556 8.3561 118.2763 59.4807 29.9153 177.4245 131 I 3.7316 7.9605 121.6069 64.2380 36.9109 177.6730 132 D 4.3617 8.2512 118.9822 57.7274 41.0020 177.9026 133 Y 4.1308 8.2018 119.7274 60.7295 38.8253 178.0673 134 L 3.7816 8.2140 119.9324 57.7491 41.7020 179.1996 135 E 3.9431 8.5684 118.9633 59.7090 29.3670 179.6497 136 T 3.8004 7.8178 115.6957 66.7212 68.5356 176.8434 137 Q 3.8357 7.7402 119.9516 58.7382 28.5490 178.7526 138 L 3.8783 7.8573 120.1629 57.6751 41.6535 179.6364 139 G 3.6644 8.2155 105.8679 47.9729 0.0000 175.6111 140 L 4.1119 7.6983 120.9471 57.2449 41.5763 179.3592 141 I 3.5417 7.4326 119.9523 64.5080 36.7424 178.4164 142 Q 3.9712 7.5699 117.4765 58.8500 28.6064 178.5536 143 K 4.2076 7.8225 118.3356 57.9935 32.3889 178.1314 144 V 4.1962 8.1440 109.8464 60.2535 33.2229 176.5904 145 G 4.1521 7.8897 106.2860 45.8383 0.0000 174.5556 146 L 3.9689 8.4366 122.0046 58.0771 42.1751 179.3683 147 E 3.9785 8.1418 118.0101 59.5357 29.4355 178.9811 148 N 4.3482 8.1168 116.0400 56.2504 38.4617 176.4359 149 Y 3.9730 7.9917 120.0835 60.9523 39.1865 178.1315 150 L 4.0745 8.3455 119.9118 57.6963 41.8004 179.2899 151 Q 3.9201 8.1227 119.5137 59.3207 28.8683 178.3112 152 S 4.2823 8.2319 114.0253 60.2735 63.0166 174.5153 153 H 4.6024 7.5960 118.4595 55.6459 29.2853 176.2193 154 M 4.2095 7.9425 121.5121 57.5532 31.9432 176.1100 155 H 5.1172 7.5566 113.8452 53.6365 31.0098 174.5022 156 E 4.1333 8.7191 121.4754 56.8003 29.2654 176.8761 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 3 G 8.35 3.85 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 0.00 0.00 0.00 0.00 0.00 0.00 4 D 8.29 4.26 0.00 2.85 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 5 K 9.32 3.96 0.00 1.94 1.77 0.00 1.89 0.00 0.00 1.82 0.00 0.00 2.87 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.50 1.10 7.81 6 K 8.03 4.44 0.00 1.91 1.58 0.00 2.01 0.00 0.00 1.70 0.00 0.00 2.88 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.41 1.43 7.81 7 V 8.36 3.69 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 1.01 0.00 0.00 0.94 0.00 0.00 8 I 7.86 3.72 2.00 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 1.52 0.50 0.91 0.00 0.00 9 Q 8.20 3.98 0.00 2.19 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.80 0.00 0.00 0.00 0.00 0.00 2.34 2.46 0.00 10 H 8.63 4.13 0.00 3.31 3.35 0.00 5.62 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 11 L 8.44 4.01 0.00 1.78 1.74 0.96 0.75 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 12 N 8.76 4.34 0.00 2.81 2.86 0.00 0.00 6.71 7.67 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 13 K 8.21 3.95 0.00 1.90 1.98 0.00 1.62 0.00 0.00 1.67 0.00 0.00 3.12 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.47 7.81 14 I 8.03 3.73 2.01 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 1.72 0.70 0.92 0.00 0.00 15 L 8.21 4.03 0.00 1.75 1.86 0.92 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 16 G 8.22 3.64 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 0.00 0.00 0.00 17 N 8.28 4.37 0.00 2.94 2.88 0.00 0.00 7.05 6.94 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 18 E 8.33 3.97 0.00 2.12 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 0.00 2.54 2.53 0.00 19 L 8.21 3.97 0.00 1.76 1.69 0.90 0.77 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 20 I 7.58 3.64 1.93 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.80 0.83 0.00 0.00 21 A 7.79 3.22 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 22 I 7.92 3.63 1.97 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.87 0.87 0.00 0.00 23 N 7.78 4.40 0.00 2.71 2.82 0.00 0.00 6.76 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 Q 8.17 3.84 0.00 2.02 1.86 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 2.24 0.00 25 Y 7.97 4.86 0.00 3.08 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 26 F 8.49 4.00 0.00 3.30 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 27 L 8.24 4.02 0.00 1.83 1.66 0.88 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 28 H 8.23 3.84 0.00 3.43 2.68 0.00 5.69 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 S 8.25 4.32 0.00 3.94 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 30 R 7.89 3.83 0.00 1.97 1.88 0.00 2.93 0.00 0.00 2.56 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.64 0.00 31 M 7.97 3.50 0.00 0.83 1.38 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.19 0.00 32 W 7.90 4.48 0.00 3.69 3.33 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 33 N 8.46 4.34 0.00 2.86 2.84 0.00 0.00 6.65 8.49 0.00 0.00 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 D 7.97 4.34 0.00 2.56 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 35 W 7.91 4.93 0.00 3.75 3.15 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 36 G 8.40 3.97 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 0.00 37 L 8.26 4.88 0.00 1.91 1.61 1.30 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 38 K 8.40 4.01 0.00 1.91 1.86 0.00 1.69 0.00 0.00 1.58 0.00 0.00 2.92 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.49 1.57 7.81 39 R 7.98 3.88 0.00 2.04 1.93 0.00 3.14 0.00 0.00 2.87 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.63 0.00 40 L 7.81 3.82 0.00 1.28 0.13 0.36 0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 41 G 8.29 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 0.00 0.00 0.00 42 A 8.31 3.98 1.39 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 43 H 8.26 3.97 0.00 3.27 3.28 0.00 5.79 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 E 8.54 3.96 0.00 2.61 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 2.74 2.65 0.00 45 Y 8.26 4.00 0.00 2.98 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 46 H 8.05 4.04 0.00 3.32 3.22 0.00 5.88 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 E 8.25 3.78 0.00 1.80 1.55 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 0.00 2.21 2.16 0.00 48 S 8.16 4.28 0.00 4.10 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 49 I 7.63 3.57 1.82 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 0.91 0.14 0.84 0.00 0.00 50 D 8.18 4.27 0.00 2.83 2.66 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 51 E 8.27 4.17 0.00 2.20 2.15 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 2.74 2.74 0.00 52 M 8.30 4.03 0.00 2.02 2.21 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 2.87 2.55 0.00 53 K 7.96 3.97 0.00 1.84 1.81 0.00 1.61 0.00 0.00 1.61 0.00 0.00 2.93 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.43 1.62 7.81 54 H 8.08 4.24 0.00 3.38 3.35 0.00 5.65 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 A 8.28 3.98 1.39 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 56 D 8.28 4.27 0.00 2.80 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 57 K 8.01 4.03 0.00 2.07 1.86 0.00 1.76 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.47 1.62 7.81 58 L 8.15 3.97 0.00 1.86 1.74 0.94 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 59 I 8.02 3.71 2.03 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 1.53 0.95 0.92 0.00 0.00 60 E 8.28 4.03 0.00 2.04 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 0.00 2.34 2.51 0.00 61 R 8.06 3.98 0.00 2.07 2.13 0.00 3.30 0.00 0.00 3.21 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.80 0.00 62 I 8.04 3.72 2.04 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 1.54 0.54 0.94 0.00 0.00 63 L 8.05 4.06 0.00 2.09 1.77 0.98 0.83 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 64 F 8.26 4.27 0.00 2.95 3.25 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 65 L 8.01 3.93 0.00 1.76 1.62 0.97 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 66 E 7.98 3.66 0.00 2.02 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 0.00 2.18 2.18 0.00 67 G 8.21 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 68 L 8.02 4.56 0.00 1.62 1.61 0.91 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 69 P 0.00 4.41 0.00 2.04 1.99 0.00 3.66 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.07 0.00 70 N 9.41 4.64 0.00 2.61 2.82 0.00 0.00 7.10 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 71 L 8.29 4.59 0.00 1.62 1.63 0.91 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 72 Q 8.45 4.06 0.00 1.97 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.71 6.82 0.00 0.00 0.00 0.00 0.00 2.33 2.35 0.00 73 D 8.17 4.53 0.00 2.69 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 74 L 8.29 4.46 0.00 1.53 1.54 0.88 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 75 G 8.32 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 K 8.34 4.15 0.00 1.72 1.73 0.00 1.78 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.40 1.45 7.81 77 L 8.43 4.00 0.00 1.63 1.56 0.92 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 78 L 8.81 4.40 0.00 1.66 1.67 1.01 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 79 I 8.07 4.33 1.88 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 1.33 0.79 0.91 0.00 0.00 80 G 8.65 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 81 E 8.85 4.64 0.00 2.11 2.05 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 2.30 2.25 0.00 82 N 7.71 5.16 0.00 2.89 2.83 0.00 0.00 6.28 7.22 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 83 T 8.56 4.41 4.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 84 Q 8.23 4.00 0.00 2.10 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.91 0.00 0.00 0.00 0.00 0.00 2.42 2.44 0.00 85 E 8.86 4.01 0.00 2.26 2.02 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 2.35 2.60 0.00 86 M 8.40 3.94 0.00 1.42 2.28 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 1.98 0.00 87 L 8.28 4.20 0.00 1.90 1.75 0.83 0.68 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 88 Q 8.18 4.04 0.00 2.29 2.25 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 2.37 2.47 0.00 89 C 8.66 4.28 0.00 3.25 3.22 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 90 D 8.43 4.64 0.00 3.00 2.85 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 0.00 0.00 0.00 91 L 8.03 3.98 0.00 1.91 1.87 0.93 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 92 N 8.28 4.32 0.00 2.98 2.89 0.00 0.00 6.71 6.16 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 93 L 7.98 4.00 0.00 1.97 1.99 0.91 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 94 E 8.47 4.11 0.00 2.21 2.05 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 2.66 2.51 0.00 95 L 8.29 4.01 0.00 1.85 1.74 0.94 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 96 K 8.07 3.96 0.00 1.91 1.96 0.00 1.54 0.00 0.00 1.66 0.00 0.00 3.05 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.44 1.51 7.81 97 A 8.19 4.01 1.43 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 98 T 8.25 3.84 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 99 K 7.91 3.91 0.00 1.86 1.99 0.00 1.70 0.00 0.00 1.66 0.00 0.00 2.94 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.55 1.50 7.81 100 D 8.26 4.42 0.00 2.90 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 0.00 101 L 8.16 4.00 0.00 1.94 1.72 0.92 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 102 R 8.08 3.95 0.00 1.88 1.98 0.00 3.14 0.00 0.00 3.18 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.91 0.00 103 E 8.22 3.93 0.00 2.19 2.02 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 2.34 2.53 0.00 104 A 8.23 3.63 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 0.00 105 I 7.81 3.68 2.00 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 0.96 0.93 0.00 0.00 106 V 7.98 3.58 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 1.00 0.00 0.00 0.97 0.00 0.00 107 H 8.10 4.16 0.00 3.28 3.19 0.00 5.84 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 C 8.08 3.97 0.00 3.12 3.12 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 0.00 109 E 8.15 3.84 0.00 2.14 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.46 0.00 110 Q 7.59 3.92 0.00 2.08 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.83 0.00 0.00 0.00 0.00 0.00 2.30 2.37 0.00 111 V 7.16 3.85 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 0.67 0.00 0.00 0.78 0.00 0.00 112 H 7.58 2.87 0.00 3.11 3.13 0.00 5.66 0.00 0.00 0.00 0.00 7.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 D 7.65 4.54 0.00 2.55 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 0.00 0.00 0.00 0.00 114 Y 7.45 4.34 0.00 3.10 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 0.00 115 V 7.84 3.71 2.15 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 1.08 0.00 0.00 0.99 0.00 0.00 116 S 8.66 4.10 0.00 4.22 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 0.00 117 R 8.09 3.88 0.00 1.92 2.23 0.00 3.23 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.71 0.00 118 D 7.98 4.35 0.00 3.11 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 0.00 119 L 7.97 3.98 0.00 1.79 1.81 0.94 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 120 L 8.13 4.02 0.00 1.90 1.70 0.93 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 121 K 8.56 3.97 0.00 1.87 1.97 0.00 1.65 0.00 0.00 1.66 0.00 0.00 2.93 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.45 1.50 7.81 122 D 8.13 4.38 0.00 2.93 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 0.00 123 I 7.73 3.52 1.97 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 1.17 0.80 0.83 0.00 0.00 124 L 7.92 3.98 0.00 1.78 1.85 0.94 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 125 E 8.35 3.92 0.00 2.10 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 0.00 2.33 2.33 0.00 126 S 8.09 4.31 0.00 4.12 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 0.00 127 E 8.68 4.14 0.00 2.04 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 2.60 2.53 0.00 128 E 8.51 4.06 0.00 2.23 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.52 0.00 129 E 8.35 4.04 0.00 2.23 2.05 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 2.37 2.35 0.00 130 H 8.36 4.36 0.00 3.26 3.52 0.00 5.61 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 0.00 131 I 7.96 3.73 2.04 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 1.44 0.55 0.93 0.00 0.00 132 D 8.25 4.36 0.00 2.95 2.97 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 0.00 133 Y 8.20 4.13 0.00 3.14 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 0.00 134 L 8.21 3.78 0.00 2.07 1.67 1.09 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 135 E 8.57 3.94 0.00 2.00 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 2.32 2.57 0.00 136 T 7.82 3.80 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 1.17 0.00 0.00 137 Q 7.74 3.84 0.00 1.83 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.80 0.00 0.00 0.00 0.00 0.00 1.39 1.85 0.00 138 L 7.86 3.88 0.00 1.82 1.62 0.82 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 139 G 8.22 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 0.00 140 L 7.70 4.11 0.00 1.90 1.86 1.01 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 141 I 7.43 3.54 1.78 0.00 0.00 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.27 0.83 0.00 0.00 142 Q 7.57 3.97 0.00 2.12 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 7.00 0.00 0.00 0.00 0.00 0.00 2.53 2.50 0.00 143 K 7.82 4.21 0.00 1.75 1.86 0.00 1.65 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.45 1.73 7.81 144 V 8.14 4.20 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 0.72 0.00 0.00 1.12 0.00 0.00 145 G 7.89 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 0.00 146 L 8.44 3.97 0.00 1.76 1.68 0.96 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 147 E 8.14 3.98 0.00 2.06 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.40 0.00 148 N 8.12 4.35 0.00 3.09 2.88 0.00 0.00 6.73 7.48 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 0.00 149 Y 7.99 3.97 0.00 3.00 3.17 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 0.00 150 L 8.35 4.07 0.00 1.87 1.73 0.95 1.29 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 0.00 151 Q 8.12 3.92 0.00 2.18 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.84 0.00 0.00 0.00 0.00 0.00 2.30 2.36 0.00 152 S 8.23 4.28 0.00 3.77 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 0.00 153 H 7.60 4.60 0.00 2.94 3.05 0.00 5.81 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 M 7.94 4.21 0.00 1.92 1.94 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 2.44 0.00 155 H 7.56 5.12 0.00 3.09 3.16 0.00 5.72 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 156 E 8.72 4.13 0.00 1.95 1.86 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 2.31 2.30 0.00