NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.1635 8.1727 122.0486 56.2787 34.1152 174.0133 2 V 4.5705 8.1594 127.0325 60.7271 32.3486 174.5406 3 F 4.4943 10.0636 129.0801 57.5738 40.2118 174.9305 4 E 4.3139 9.0932 120.9937 55.5863 31.0841 176.9097 5 R 3.3838 9.0116 121.0148 60.7052 29.9431 179.5382 6 C 4.3504 8.0346 115.3098 59.7089 36.3826 175.7023 7 E 3.8869 8.1365 120.7595 59.1855 29.2673 178.5226 8 L 3.5655 7.9795 120.1634 57.7933 42.0674 178.5061 9 A 3.9422 7.8279 120.7737 55.5581 18.2216 179.9451 10 R 3.9415 8.0067 116.3118 59.3879 29.9525 179.4444 11 T 3.8428 7.7469 115.6913 66.7064 68.4801 176.7389 12 L 3.8694 8.1748 121.2935 57.3572 41.5613 179.5289 13 K 3.9209 7.9284 119.7351 59.6802 31.9977 179.2142 14 R 3.9931 8.0269 117.0661 58.7421 30.0047 178.0743 15 L 4.3588 7.3458 116.5178 54.4019 41.7976 177.2164 16 G 3.9006 7.9148 107.1174 46.5326 0.0000 174.8840 17 M 3.9683 7.9247 120.8850 56.4150 32.2912 175.6673 18 D 4.4236 8.0227 117.7460 55.8969 40.8718 175.6754 19 G 3.9519 9.2165 115.5543 45.4039 0.0000 171.1899 20 Y 4.1237 8.3548 122.3693 58.4258 38.9366 176.3200 21 G 3.7293 8.8077 115.4435 46.6104 0.0000 174.1652 22 G 3.7950 8.1536 105.6195 45.3298 0.0000 174.1077 23 I 4.0692 7.5248 121.9598 59.2961 37.9235 175.9814 24 S 4.6173 8.3166 120.8018 57.9375 64.9417 174.8565 25 L 4.2324 8.4260 123.2988 58.4561 41.7706 179.1130 26 A 4.1452 8.1951 120.2353 55.3962 18.2933 179.2298 27 N 4.4304 8.0931 114.8141 56.3968 38.6274 177.7368 28 W 4.3304 7.9664 120.2137 59.9571 28.9848 178.5854 29 M 4.1553 8.5106 118.9855 58.5899 31.4300 177.9701 30 C 3.2574 8.2038 118.7626 59.0008 43.9458 175.4075 31 L 3.9761 8.1930 121.7981 58.2292 41.7332 178.7715 32 A 4.2532 8.2641 122.0783 54.3785 18.2810 179.4088 33 K 2.9333 8.3113 118.2732 59.4276 32.0619 179.1638 34 W 4.1452 7.7213 117.3115 59.1366 29.0323 178.4036 35 E 4.3428 8.4094 118.8174 58.6595 28.9548 177.7457 36 S 4.5150 8.0310 109.5824 56.6494 64.5393 174.6789 37 G 3.2954 8.2408 108.8741 46.8566 0.0000 173.5093 38 Y 3.6898 7.7525 113.8906 58.5613 34.9056 168.1716 39 N 5.2856 7.6777 118.8822 52.0191 40.1132 175.5903 40 T 4.0577 9.0766 117.7195 63.5153 69.9505 175.8379 41 R 4.6314 8.0181 117.5707 55.7997 30.4421 176.4520 42 A 4.3897 7.8136 122.5107 52.8750 19.3753 177.5061 43 T 5.0608 8.2768 110.4229 60.3307 72.5312 173.0219 44 N 4.8663 8.6877 121.6389 52.5536 42.3952 172.3855 45 Y 4.7284 8.7621 127.8631 56.9264 40.9831 173.8112 46 N 4.7828 8.4119 124.5221 51.2555 39.2060 175.4154 47 A 3.7094 8.3584 128.0543 54.8227 18.9972 179.0139 48 G 3.7496 8.1457 104.1969 48.2725 0.0000 173.9597 49 D 4.7499 7.6768 115.5352 51.9022 39.8553 175.7940 50 R 3.9080 8.0131 116.2926 56.7631 28.2705 175.9296 51 S 4.9281 7.5673 111.9573 57.1821 66.3623 172.6759 52 T 5.0891 8.9221 115.7801 61.9815 72.8956 172.9112 53 D 5.3576 9.0346 125.5372 53.2631 43.1072 175.0234 54 Y 4.8843 9.3299 121.2243 57.4983 41.3761 177.2427 55 G 4.4152 9.0053 112.0353 46.2830 0.0000 173.3809 56 I 4.0512 8.1210 116.3627 62.8952 37.9784 177.9265 57 F 4.9132 7.9540 115.6708 56.3273 39.8357 175.3461 58 Q 3.4818 8.0329 119.1656 57.0760 26.7083 174.2634 59 I 4.3455 8.1060 118.9853 61.1247 39.2067 176.9093 60 N 5.3672 9.1705 125.9815 53.3584 39.7097 175.8579 61 S 4.5482 9.1887 120.9019 61.1038 63.3959 175.5350 62 R 3.7565 8.9156 122.2961 58.6828 30.2889 177.8445 63 Y 4.3374 7.8603 114.5685 57.6782 40.6332 176.8574 64 W 4.9159 8.1691 118.8940 57.6050 31.1869 174.0054 65 C 5.5895 8.1727 111.6769 53.8170 46.0060 172.8715 66 N 5.0396 8.9938 119.2250 52.0655 40.0110 174.7584 67 D 4.8383 8.7101 123.6721 52.1502 40.4147 176.8528 68 G 3.9503 8.5604 107.3277 46.2659 0.0000 174.3944 69 K 4.5184 8.2424 116.1881 56.3740 33.3413 175.7864 70 T 4.5835 7.7597 117.1362 61.2968 69.3894 172.2078 71 P 4.1354 0.0000 0.0000 64.1763 31.6297 176.2929 72 G 3.9028 8.7512 110.5868 46.3509 0.0000 173.0886 73 A 4.3420 7.4015 120.1950 51.2489 19.8690 177.5285 74 V 4.3469 8.2846 112.4767 59.4603 35.5350 176.3525 75 N 4.9699 8.0296 116.6428 52.3548 37.9793 174.7297 76 A 4.0033 8.9305 125.1194 54.6135 19.1044 178.4818 77 C 4.5696 8.3474 111.5042 57.3278 41.1638 173.0456 78 H 4.0259 7.8575 116.4243 56.7259 26.3215 173.9952 79 L 4.8556 8.2657 117.5880 52.8578 46.3405 176.6245 80 S 4.6572 8.3210 115.0271 57.8590 63.2904 175.9968 81 C 4.0011 8.7002 124.3763 59.8400 39.7523 176.3454 82 S 3.8479 7.7515 114.3664 61.3978 61.6171 176.0643 83 A 4.0040 7.9355 122.5441 54.4537 17.8938 178.5222 84 L 4.4779 7.9813 116.2289 54.9957 41.6942 177.5883 85 L 5.0177 7.6650 118.2698 54.5029 42.2201 176.6328 86 Q 4.3345 7.7972 117.7323 55.4173 29.5000 176.0432 87 D 4.4032 8.6134 120.8171 57.1381 41.1369 176.6699 88 N 4.6035 8.0194 118.1629 53.1216 39.2728 174.6302 89 I 4.2350 8.4591 118.8485 61.0321 37.9715 177.0268 90 A 3.9331 8.4013 124.9141 56.0336 18.1856 180.1474 91 D 4.2842 8.0850 116.4606 57.3787 40.8717 178.7058 92 A 4.0967 7.9648 120.9249 55.1301 18.4148 179.7295 93 V 3.3629 8.1623 116.8501 66.0190 31.7221 178.1681 94 A 3.8233 8.0808 120.6411 55.1841 18.1150 178.8447 95 C 4.2368 8.3975 116.9129 59.6618 37.9313 175.6172 96 A 3.9157 8.2518 122.8180 54.9734 17.5749 179.8045 97 K 3.6650 7.6110 116.4187 59.4663 32.2138 179.1964 98 R 4.0673 7.7124 118.7121 59.2945 30.0977 178.6903 99 V 2.4165 7.5836 118.1257 65.6861 31.3482 178.1279 100 V 3.8668 7.6895 110.1465 63.0194 31.2799 177.8141 101 R 4.3026 7.5419 116.8070 56.6122 30.5220 176.2601 102 D 4.7602 7.5611 119.7624 52.4219 41.9486 175.3161 103 P 4.2087 0.0000 0.0000 66.3852 30.9680 177.6720 104 Q 4.0578 8.1310 117.0692 56.0151 30.1829 176.9576 105 G 4.0681 7.9191 106.9695 46.7515 0.0000 175.8743 106 I 3.5618 7.8041 119.6098 63.5406 37.9765 178.0936 107 R 4.2258 7.2094 117.9600 57.9214 30.0316 177.4384 108 A 4.0475 7.7795 121.1485 54.4873 18.5586 177.6534 109 W 4.5887 8.1295 116.8851 55.6087 29.2022 177.3362 110 V 3.7303 8.7327 124.2070 66.0690 30.8598 177.6070 111 A 4.0556 8.2791 120.0220 54.6603 18.1243 179.3028 112 W 3.9965 8.4844 127.2655 60.7226 30.6003 178.4418 113 R 3.7572 8.2703 116.4597 59.2791 29.6188 178.4054 114 N 4.3926 8.0691 115.3548 55.5533 38.7256 176.8081 115 R 4.1395 7.7918 115.3140 55.7704 31.3996 175.5550 116 C 4.5212 7.7465 116.1001 57.7776 42.7684 174.5029 117 Q 3.2199 6.5601 119.5191 57.0320 28.7678 175.1688 118 N 4.1632 8.5543 121.1282 54.3878 36.2945 173.9043 119 R 4.4886 7.2901 114.5744 54.1149 33.0980 175.9120 120 D 4.5616 8.4182 119.1779 54.0828 40.2149 176.5655 121 V 4.5163 8.1252 118.8042 61.2920 32.1458 177.5814 122 R 4.0424 7.9174 120.1293 59.4458 29.8586 178.5226 123 Q 3.9766 8.1564 116.8451 59.6949 27.9736 178.4914 124 Y 4.2931 7.8574 117.4196 59.8380 38.3278 176.8185 125 V 4.4028 7.7663 110.9848 60.6619 33.2670 175.5013 126 Q 4.1981 7.5415 120.1043 57.2850 28.7148 177.0073 127 G 3.9522 8.9468 110.5669 45.9787 0.0000 174.4254 128 C 4.4411 8.0711 115.7227 56.6154 40.5840 174.0083 129 G 3.8772 8.0886 107.2509 46.7095 0.0000 174.2203 130 V 3.9984 7.8806 118.0947 61.0686 31.9633 175.8988 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 K 8.17 4.16 0.00 2.00 1.61 0.00 1.26 0.00 0.00 0.90 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.87 1.13 7.81 2 V 8.16 4.57 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 0.90 0.00 0.00 0.94 0.00 0.00 3 F 10.06 4.49 0.00 2.81 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 4 E 9.09 4.31 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 2.39 0.00 5 R 9.01 3.38 0.00 2.00 1.94 0.00 3.41 0.00 0.00 3.48 7.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.85 0.00 6 C 8.03 4.35 0.00 3.01 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 7 E 8.14 3.89 0.00 2.06 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 2.58 2.41 0.00 8 L 7.98 3.57 0.00 1.39 1.38 -0.16 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 9 A 7.83 3.94 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 10 R 8.01 3.94 0.00 1.89 1.99 0.00 3.14 0.00 0.00 3.28 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.81 0.00 11 T 7.75 3.84 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 1.21 0.00 0.00 12 L 8.17 3.87 0.00 1.70 1.57 0.90 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 13 K 7.93 3.92 0.00 1.97 1.94 0.00 1.65 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.44 1.50 7.81 14 R 8.03 3.99 0.00 2.01 1.97 0.00 3.21 0.00 0.00 3.33 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.67 0.00 15 L 7.35 4.36 0.00 1.57 1.58 0.88 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 16 G 7.91 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 0.00 0.00 0.00 17 M 7.92 3.97 0.00 1.36 1.98 0.00 0.00 0.00 0.00 0.00 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.23 0.00 18 D 8.02 4.42 0.00 2.68 2.68 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 19 G 9.22 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 20 Y 8.35 4.12 0.00 3.42 3.21 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 21 G 8.81 3.73 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 22 G 8.15 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.52 4.07 1.70 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 0.87 0.54 -0.32 0.00 0.00 24 S 8.32 4.62 0.00 4.11 4.03 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 25 L 8.43 4.23 0.00 2.13 1.81 0.99 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 26 A 8.20 4.15 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 27 N 8.09 4.43 0.00 2.75 2.78 0.00 0.00 7.01 8.61 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 28 W 7.97 4.33 0.00 3.48 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 29 M 8.51 4.16 0.00 2.15 2.35 0.00 0.00 0.00 0.00 0.00 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.93 0.00 30 C 8.20 3.26 0.00 2.58 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 31 L 8.19 3.98 0.00 1.89 1.90 0.64 -0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 32 A 8.26 4.25 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 0.00 0.00 33 K 8.31 2.93 0.00 1.64 1.70 0.00 0.69 0.00 0.00 0.94 0.00 0.00 2.67 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.15 0.44 7.81 34 W 7.72 4.15 0.00 3.46 3.30 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 35 E 8.41 4.34 0.00 2.04 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 0.00 2.62 2.47 0.00 36 S 8.03 4.52 0.00 4.06 4.14 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 37 G 8.24 3.30 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 0.00 38 Y 7.75 3.69 0.00 3.28 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 39 N 7.68 5.29 0.00 2.83 2.86 0.00 0.00 7.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 T 9.08 4.06 4.44 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 1.50 0.00 0.00 41 R 8.02 4.63 0.00 1.89 2.07 0.00 3.08 0.00 0.00 3.25 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.82 0.00 42 A 7.81 4.39 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.28 5.06 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 1.30 0.00 0.00 44 N 8.69 4.87 0.00 2.92 2.73 0.00 0.00 6.93 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 45 Y 8.76 4.73 0.00 2.99 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 46 N 8.41 4.78 0.00 2.60 2.59 0.00 0.00 6.63 7.52 0.00 0.00 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 A 8.36 3.71 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 G 8.15 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 49 D 7.68 4.75 0.00 2.71 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 50 R 8.01 3.91 0.00 2.03 2.18 0.00 3.13 0.00 0.00 3.20 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.52 0.00 51 S 7.57 4.93 0.00 3.95 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 52 T 8.92 5.09 4.13 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 0.62 0.00 0.00 53 D 9.03 5.36 0.00 2.68 2.81 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 0.00 0.00 0.00 54 Y 9.33 4.88 0.00 2.91 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 55 G 9.01 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 0.00 0.00 0.00 0.00 56 I 8.12 4.05 1.67 0.00 0.00 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.95 0.04 0.00 0.00 57 F 7.95 4.91 0.00 3.22 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 Q 8.03 3.48 0.00 2.50 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.69 6.84 0.00 0.00 0.00 0.00 0.00 2.54 2.71 0.00 59 I 8.11 4.35 2.13 0.00 0.00 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 1.28 0.96 1.13 0.00 0.00 60 N 9.17 5.37 0.00 3.09 3.05 0.00 0.00 6.97 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 61 S 9.19 4.55 0.00 4.08 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 0.00 62 R 8.92 3.76 0.00 1.62 1.46 0.00 2.69 0.00 0.00 2.84 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.01 0.00 63 Y 7.86 4.34 0.00 1.67 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 W 8.17 4.92 0.00 3.53 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 65 C 8.17 5.59 0.00 3.09 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 66 N 8.99 5.04 0.00 2.84 2.70 0.00 0.00 7.06 8.92 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 67 D 8.71 4.84 0.00 2.85 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 68 G 8.56 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 69 K 8.24 4.52 0.00 1.89 1.87 0.00 1.59 0.00 0.00 1.74 0.00 0.00 2.99 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.56 1.46 7.81 70 T 7.76 4.58 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 71 P 0.00 4.14 0.00 2.01 2.01 0.00 3.82 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.11 0.00 72 G 8.75 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 0.00 0.00 0.00 73 A 7.40 4.34 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 74 V 8.28 4.35 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 0.61 0.00 0.00 0.85 0.00 0.00 75 N 8.03 4.97 0.00 2.74 2.55 0.00 0.00 6.79 8.24 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 76 A 8.93 4.00 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 C 8.35 4.57 0.00 3.36 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 78 H 7.86 4.03 0.00 3.31 3.37 0.00 5.79 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 79 L 8.27 4.86 0.00 1.69 1.50 0.96 0.70 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 80 S 8.32 4.66 0.00 3.83 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 81 C 8.70 4.00 0.00 2.21 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 82 S 7.75 3.85 0.00 3.84 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 83 A 7.94 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 84 L 7.98 4.48 0.00 1.90 1.83 1.06 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 85 L 7.67 5.02 0.00 1.77 1.71 1.10 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 86 Q 7.80 4.33 0.00 2.19 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.45 7.08 0.00 0.00 0.00 0.00 0.00 2.37 2.49 0.00 87 D 8.61 4.40 0.00 2.62 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 88 N 8.02 4.60 0.00 2.69 2.75 0.00 0.00 6.95 7.94 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 89 I 8.46 4.24 1.76 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.54 0.98 0.00 0.00 90 A 8.40 3.93 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.09 4.28 0.00 2.75 2.74 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 92 A 7.96 4.10 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 93 V 8.16 3.36 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 0.71 0.00 0.00 0.89 0.00 0.00 94 A 8.08 3.82 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 0.00 0.00 0.00 0.00 0.00 95 C 8.40 4.24 0.00 3.14 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 96 A 8.25 3.92 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 K 7.61 3.66 0.00 1.57 1.29 0.00 1.30 0.00 0.00 0.98 0.00 0.00 2.38 0.00 0.00 2.53 0.00 0.00 0.00 0.00 0.30 0.82 7.81 98 R 7.71 4.07 0.00 2.01 2.13 0.00 3.29 0.00 0.00 3.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.97 0.00 99 V 7.58 2.42 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 -0.42 0.00 0.00 -0.46 0.00 0.00 100 V 7.69 3.87 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 1.31 0.00 0.00 1.38 0.00 0.00 101 R 7.54 4.30 0.00 1.98 2.04 0.00 3.26 0.00 0.00 3.32 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 2.07 0.00 102 D 7.56 4.76 0.00 3.11 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 0.00 103 P 0.00 4.21 0.00 2.15 2.22 0.00 3.77 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 2.02 0.00 104 Q 8.13 4.06 0.00 2.06 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.79 0.00 0.00 0.00 0.00 0.00 2.42 2.31 0.00 105 G 7.92 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 0.00 106 I 7.80 3.56 1.00 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.11 -0.68 0.00 0.00 107 R 7.21 4.23 0.00 2.00 2.03 0.00 3.23 0.00 0.00 3.28 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.66 0.00 108 A 7.78 4.05 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 W 8.13 4.59 0.00 3.50 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 0.00 110 V 8.73 3.73 2.18 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 1.10 0.00 0.00 0.99 0.00 0.00 111 A 8.28 4.06 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 W 8.48 4.00 0.00 3.47 3.49 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 0.00 0.00 0.00 0.00 113 R 8.27 3.76 0.00 2.09 2.01 0.00 3.56 0.00 0.00 3.40 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 2.19 0.00 114 N 8.07 4.39 0.00 2.69 2.71 0.00 0.00 6.87 7.20 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 0.00 115 R 7.79 4.14 0.00 0.67 0.69 0.00 2.78 0.00 0.00 2.85 7.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.64 0.00 116 C 7.75 4.52 0.00 1.56 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 0.00 117 Q 6.56 3.22 0.00 0.93 1.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.52 6.88 0.00 0.00 0.00 0.00 0.00 2.15 2.22 0.00 118 N 8.55 4.16 0.00 2.78 2.80 0.00 0.00 6.89 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 0.00 119 R 7.29 4.49 0.00 1.76 1.77 0.00 3.22 0.00 0.00 3.04 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.52 0.00 120 D 8.42 4.56 0.00 2.63 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 0.00 121 V 8.13 4.52 2.42 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 0.92 0.00 0.00 1.05 0.00 0.00 122 R 7.92 4.04 0.00 1.88 2.02 0.00 3.16 0.00 0.00 3.24 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.69 0.00 123 Q 8.16 3.98 0.00 2.05 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.91 0.00 0.00 0.00 0.00 0.00 2.20 1.68 0.00 124 Y 7.86 4.29 0.00 3.21 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 0.00 125 V 7.77 4.40 2.14 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 1.06 0.00 0.00 1.06 0.00 0.00 126 Q 7.54 4.20 0.00 2.18 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.72 0.00 0.00 0.00 0.00 0.00 2.52 2.46 0.00 127 G 8.95 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 0.00 128 C 8.07 4.44 0.00 3.10 3.14 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 0.00 129 G 8.09 3.88 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 0.00 130 V 7.88 4.00 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 0.81 0.00 0.00 0.96 0.00 0.00