NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.1644 8.1727 122.0509 56.3022 34.1329 174.0766 2 V 4.5193 8.1594 127.0261 60.7736 32.1444 174.5920 3 F 4.2949 9.8776 129.0028 57.5052 40.1422 175.0928 4 E 4.1749 8.8923 121.0322 55.8314 30.7985 177.1066 5 R 3.2894 8.9373 121.1570 60.6562 29.9272 179.5655 6 C 4.3385 7.9969 115.3110 59.5976 39.7026 175.5987 7 E 3.9010 8.1695 120.7750 59.3286 29.2407 178.5725 8 L 3.6555 7.9787 120.0298 57.8283 42.0560 178.6623 9 A 3.9426 7.8136 120.7474 55.3745 18.3956 179.9122 10 R 3.9041 8.1477 116.5647 59.4973 30.1997 179.4294 11 T 3.8577 7.9320 115.6097 66.7215 68.5935 176.7056 12 L 3.8781 8.2306 121.2594 57.4261 41.5680 179.3889 13 K 3.8906 7.9999 119.7155 59.6740 31.9235 178.8910 14 R 3.9713 7.6285 117.1156 58.9494 30.0733 177.5239 15 L 4.3103 7.4658 116.1011 54.4715 41.7434 177.0879 16 G 3.8585 7.7967 107.0643 46.6953 0.0000 174.9932 17 M 3.9185 7.7418 121.0794 56.5580 32.3832 175.7859 18 D 4.4028 8.0283 117.8720 55.8083 41.1836 175.7696 19 G 3.9408 9.4978 115.7223 45.5381 0.0000 171.4482 20 Y 4.1314 8.2939 122.0553 58.7442 38.9504 176.4047 21 R 3.2380 9.0116 127.0032 57.1736 27.8731 177.1895 22 G 3.8385 8.2175 103.6344 45.3914 0.0000 173.8277 23 I 4.1817 7.4609 121.8213 58.9106 38.4528 175.6838 24 S 4.5696 8.3556 120.4540 57.6897 64.0252 174.6587 25 L 4.1872 9.2984 124.5056 58.9316 41.6504 179.5638 26 A 4.1572 8.1722 119.7461 55.2659 18.1982 179.2854 27 N 4.4083 8.2725 115.1080 56.3164 38.5969 177.5840 28 W 4.3117 8.0202 119.8643 60.0652 29.0933 178.3855 29 M 4.1539 8.4673 118.6414 58.5521 31.6065 177.7587 30 C 3.1438 8.0202 118.6894 59.2934 43.8624 175.0925 31 L 3.9681 8.2494 121.7368 58.5032 41.6409 178.8486 32 A 4.1050 8.4112 120.5219 55.0133 18.3033 179.5204 33 K 2.8731 8.1218 118.1065 59.1737 32.0176 178.9908 34 W 4.3427 7.6230 116.9805 58.9470 29.2016 178.4320 35 E 4.3261 8.3918 118.8102 58.7562 29.1512 177.8848 36 S 4.5173 7.6317 107.8134 56.5895 64.9388 173.7048 37 G 3.4779 8.4573 108.8573 47.0836 0.0000 173.4637 38 Y 3.6411 7.6288 112.0549 58.6063 35.3636 168.7877 39 N 5.3225 7.7459 119.6924 51.9797 39.7805 175.3746 40 T 4.0776 8.9383 117.9011 63.6047 69.8718 175.8515 41 R 4.5518 7.9248 116.8597 55.7046 30.5902 176.4280 42 A 4.2892 7.8834 123.6800 52.8571 19.2062 177.2875 43 T 4.9911 8.4677 111.8866 59.8666 72.3887 173.2796 44 N 4.8430 8.6552 121.5905 52.1032 41.8953 172.6065 45 Y 4.4850 8.7312 128.5667 57.6551 40.5719 173.9762 46 N 4.4749 8.7227 124.8328 51.3629 38.8629 175.6229 47 A 3.6909 8.3123 127.9533 54.5716 18.9962 179.0341 48 G 3.7535 8.0532 104.5794 48.1563 0.0000 173.8428 49 D 4.6829 7.3560 114.6152 52.0775 40.4502 175.7457 50 R 3.9490 8.3371 116.4795 57.2684 28.1160 175.8674 51 S 4.9159 7.6886 112.6141 57.2062 66.2542 172.8288 52 T 5.0434 8.6789 115.9632 61.9082 72.4247 172.9278 53 D 5.3977 8.9572 125.8608 53.4980 42.9577 174.9940 54 Y 4.8100 9.2503 121.2142 57.5071 41.2122 177.1610 55 G 4.5887 9.3136 112.4061 46.4175 0.0000 173.3034 56 I 3.6115 8.3465 117.5590 63.5800 37.9749 177.6787 57 F 4.7037 7.9802 115.3930 56.3462 39.6973 175.5250 58 Q 3.5810 7.8351 118.9535 57.1487 26.5144 174.0879 59 I 4.4112 8.3122 119.0928 61.0941 39.3190 176.8443 60 N 5.3535 9.2192 125.9245 53.4158 39.7567 175.7774 61 S 4.5456 9.0620 120.6927 60.8703 63.5085 175.4517 62 R 3.7051 8.8374 122.3222 58.7069 30.2733 177.8013 63 Y 4.2487 7.7031 114.7056 57.5060 40.6206 176.8102 64 W 4.8824 8.0679 118.3214 57.4019 31.7526 173.7926 65 C 5.6382 8.2176 111.2270 53.5625 45.9296 172.9742 66 N 4.9383 9.0344 119.4546 52.2482 39.9652 174.8536 67 D 4.8729 8.8562 124.2086 52.5675 40.4657 177.0382 68 G 4.1983 8.6018 112.8074 45.8281 0.0000 174.9483 69 K 4.3254 8.0768 115.6707 56.7316 33.1631 176.2398 70 T 4.4355 7.6762 117.3095 61.6218 69.4307 172.8217 71 P 4.2454 0.0000 0.0000 63.5816 31.8727 176.3485 72 G 3.7880 8.6913 109.7967 46.4539 0.0000 173.2030 73 A 4.4463 7.7847 119.9152 50.9564 20.2310 177.6567 74 V 4.3275 8.3522 113.0253 59.2517 35.4453 176.0030 75 N 5.0125 8.0127 116.3910 52.4863 37.7024 174.8201 76 A 4.0254 8.9091 124.5782 54.7225 19.1605 178.4137 77 C 4.4602 8.3994 111.3707 57.1831 41.1304 173.0160 78 H 4.1016 7.8154 116.1837 56.6372 26.2613 174.5355 79 L 4.8187 8.2875 117.7278 52.6602 46.3607 176.8155 80 S 4.5500 8.4671 116.4016 58.1947 63.1931 175.7802 81 C 3.8786 8.7739 125.0655 60.1306 40.6574 176.4888 82 S 3.9397 7.8113 114.1118 61.3056 61.6572 176.0274 83 A 4.1125 7.8734 122.4537 54.3776 18.2377 178.5238 84 L 4.4684 7.7708 116.3094 55.0911 41.6025 177.6305 85 L 5.0280 7.5632 117.9498 54.5488 42.2444 176.6693 86 Q 4.3814 7.8663 117.6922 55.3484 29.5516 176.0021 87 D 4.4330 8.5330 119.7850 57.1217 41.1400 176.8275 88 N 4.5775 8.0808 118.2428 53.2571 39.2921 174.6556 89 I 4.2643 8.4288 118.6856 60.9860 38.0546 176.9331 90 A 3.9329 8.6265 125.3807 56.0667 18.1526 180.1169 91 D 4.3001 8.0666 116.3810 57.3024 40.9720 178.6568 92 A 4.1145 7.9807 120.9195 55.0848 18.4176 179.7756 93 V 3.3510 8.1617 116.8320 66.0692 31.6321 178.0834 94 A 3.8437 8.0059 120.5459 55.3038 18.1062 178.8132 95 C 4.2291 8.3340 116.7635 59.5447 37.9002 175.5658 96 A 3.9008 8.1588 122.7510 55.0643 17.6124 179.7643 97 K 3.7478 7.5788 116.0789 59.3815 32.1480 179.1434 98 R 4.0711 7.7200 118.6093 59.3970 29.8668 178.6181 99 V 2.2937 7.4763 117.9096 65.6757 30.8860 177.9014 100 V 3.9137 7.6564 109.5343 62.6127 31.4366 178.1208 101 R 4.1605 7.6002 117.6603 57.4466 30.4378 176.6274 102 D 4.6798 7.3123 119.2697 53.0390 41.7031 175.3241 103 P 4.2352 0.0000 0.0000 66.0952 31.5195 178.2602 104 Q 4.0266 8.2091 116.4800 56.7675 30.1265 177.5065 105 G 3.6184 7.8150 107.0997 47.1983 0.0000 176.5735 106 I 3.6813 7.7614 121.8943 63.0857 37.9164 177.7365 107 R 4.1536 7.2549 117.8278 58.2712 29.9847 177.5787 108 A 4.0289 7.5454 120.3744 54.0037 18.4900 177.4328 109 W 4.7612 7.9856 117.1941 55.1374 30.1435 177.6607 110 V 3.7694 8.7001 124.6439 64.8306 30.8546 178.0265 111 A 4.0237 8.3392 120.9615 54.6905 18.1767 179.1709 112 W 4.0036 8.2782 126.7549 60.7425 30.6053 178.3231 113 R 3.7502 8.2568 116.1727 59.4130 29.6299 178.3782 114 N 4.3580 7.9237 114.9898 55.5552 38.6748 176.7956 115 R 4.1059 7.5908 115.7926 55.7534 32.0666 175.8817 116 C 4.5596 7.1269 113.9415 57.9368 42.9193 174.2558 117 Q 3.4109 6.5181 119.5795 57.0545 28.7625 175.2788 118 N 4.1687 8.5763 120.0491 54.1818 36.3097 174.0750 119 R 4.4025 7.3050 116.2211 54.2677 32.0879 176.2503 120 D 4.5017 8.4007 119.1437 54.4827 40.1139 175.8820 121 V 4.5178 8.1946 118.8955 61.1488 32.1956 178.4913 122 R 4.0657 8.0872 122.2778 59.1807 30.4012 178.9250 123 Q 3.9644 8.1319 115.6234 59.2591 28.5290 178.3147 124 Y 4.2975 7.6999 115.3446 60.0341 38.3511 176.7096 125 V 4.3046 7.7075 111.6786 60.7127 32.5760 175.5864 126 Q 4.2211 7.6088 118.6603 57.2327 28.7257 176.7234 127 G 3.9110 8.8761 109.5593 46.2461 0.0000 174.5955 128 C 4.4171 8.1027 115.9956 56.8456 40.6068 174.3614 129 G 3.8537 8.2258 107.2215 46.4162 0.0000 174.0193 130 V 3.9985 7.8237 118.0440 61.0779 31.9781 175.8297 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 1.76 1.74 0.00 1.30 0.00 0.00 1.10 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.88 1.06 7.81 2 V 8.16 4.52 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 0.90 0.00 0.00 0.94 0.00 0.00 3 F 9.88 4.29 0.00 2.90 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 4 E 8.89 4.17 0.00 1.92 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 2.29 2.37 0.00 5 R 8.94 3.29 0.00 1.89 1.89 0.00 3.37 0.00 0.00 3.46 7.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.76 0.00 6 C 8.00 4.34 0.00 3.00 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 7 E 8.17 3.90 0.00 2.05 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.40 0.00 8 L 7.98 3.66 0.00 1.46 1.43 -0.09 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 9 A 7.81 3.94 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 10 R 8.15 3.90 0.00 1.88 1.99 0.00 3.14 0.00 0.00 3.31 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.82 0.00 11 T 7.93 3.86 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 1.20 0.00 0.00 12 L 8.23 3.88 0.00 1.57 1.58 0.95 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 13 K 8.00 3.89 0.00 1.96 1.91 0.00 1.65 0.00 0.00 1.58 0.00 0.00 2.91 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.45 1.47 7.81 14 R 7.63 3.97 0.00 1.99 2.03 0.00 3.30 0.00 0.00 3.22 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.66 0.00 15 L 7.47 4.31 0.00 1.69 1.56 0.84 0.76 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 16 G 7.80 3.86 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 0.00 0.00 0.00 0.00 0.00 0.00 17 M 7.74 3.92 0.00 1.27 1.95 0.00 0.00 0.00 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.23 0.00 18 D 8.03 4.40 0.00 2.68 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 19 G 9.50 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 20 Y 8.29 4.13 0.00 3.35 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 21 R 9.01 3.24 0.00 1.88 1.83 0.00 3.20 0.00 0.00 3.01 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.59 1.45 0.00 22 G 8.22 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 23 I 7.46 4.18 1.83 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.71 -0.23 0.00 0.00 24 S 8.36 4.57 0.00 4.07 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 9.30 4.19 0.00 2.07 1.84 0.99 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 26 A 8.17 4.16 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 27 N 8.27 4.41 0.00 2.84 2.78 0.00 0.00 6.94 7.69 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 28 W 8.02 4.31 0.00 3.59 3.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 M 8.47 4.15 0.00 2.17 2.36 0.00 0.00 0.00 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.91 0.00 30 C 8.02 3.14 0.00 2.52 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 31 L 8.25 3.97 0.00 1.84 1.88 0.58 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 32 A 8.41 4.10 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 33 K 8.12 2.87 0.00 1.63 1.44 0.00 0.61 0.00 0.00 0.61 0.00 0.00 2.30 0.00 0.00 2.62 0.00 0.00 0.00 0.00 0.54 1.34 7.81 34 W 7.62 4.34 0.00 3.36 3.23 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 35 E 8.39 4.33 0.00 1.99 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.36 0.00 36 S 7.63 4.52 0.00 4.03 4.02 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 37 G 8.46 3.48 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 0.00 0.00 0.00 38 Y 7.63 3.64 0.00 3.25 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 39 N 7.75 5.32 0.00 2.77 2.79 0.00 0.00 7.00 7.83 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 40 T 8.94 4.08 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 1.48 0.00 0.00 41 R 7.92 4.55 0.00 1.87 2.08 0.00 3.09 0.00 0.00 3.24 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.59 0.00 42 A 7.88 4.29 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 43 T 8.47 4.99 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 1.21 0.00 0.00 44 N 8.66 4.84 0.00 2.89 2.76 0.00 0.00 6.91 7.62 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 45 Y 8.73 4.49 0.00 3.01 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 46 N 8.72 4.47 0.00 2.63 2.61 0.00 0.00 6.56 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 47 A 8.31 3.69 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 48 G 8.05 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 7.36 4.68 0.00 2.70 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 50 R 8.34 3.95 0.00 2.03 2.21 0.00 3.14 0.00 0.00 3.21 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.54 0.00 51 S 7.69 4.92 0.00 3.93 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 T 8.68 5.04 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 0.63 0.00 0.00 53 D 8.96 5.40 0.00 2.72 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 54 Y 9.25 4.81 0.00 2.94 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 55 G 9.31 4.59 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 0.00 0.00 0.00 56 I 8.35 3.61 1.66 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 0.91 0.70 0.10 0.00 0.00 57 F 7.98 4.70 0.00 3.19 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 58 Q 7.84 3.58 0.00 2.52 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.64 6.84 0.00 0.00 0.00 0.00 0.00 2.51 2.69 0.00 59 I 8.31 4.41 2.14 0.00 0.00 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 1.36 1.14 1.13 0.00 0.00 60 N 9.22 5.35 0.00 3.10 3.09 0.00 0.00 6.98 7.17 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 61 S 9.06 4.55 0.00 4.07 4.37 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 62 R 8.84 3.71 0.00 1.63 1.14 0.00 2.76 0.00 0.00 2.93 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.15 0.00 63 Y 7.70 4.25 0.00 1.43 1.66 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 64 W 8.07 4.88 0.00 3.53 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 C 8.22 5.64 0.00 3.03 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 9.03 4.94 0.00 2.84 2.71 0.00 0.00 7.12 8.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 D 8.86 4.87 0.00 2.98 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 G 8.60 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 0.00 0.00 0.00 0.00 69 K 8.08 4.33 0.00 1.92 1.95 0.00 1.63 0.00 0.00 1.74 0.00 0.00 2.96 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.60 1.50 7.81 70 T 7.68 4.44 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 4.25 0.00 2.02 1.98 0.00 3.79 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 2.03 2.09 0.00 72 G 8.69 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 73 A 7.78 4.45 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 74 V 8.35 4.33 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 0.62 0.00 0.00 0.81 0.00 0.00 75 N 8.01 5.01 0.00 2.77 2.63 0.00 0.00 6.79 8.68 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 76 A 8.91 4.03 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 77 C 8.40 4.46 0.00 3.24 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 78 H 7.82 4.10 0.00 3.35 3.35 0.00 5.62 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 8.29 4.82 0.00 1.68 1.49 0.96 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 80 S 8.47 4.55 0.00 3.83 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 81 C 8.77 3.88 0.00 2.40 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 82 S 7.81 3.94 0.00 3.86 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 83 A 7.87 4.11 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 7.77 4.47 0.00 1.95 1.84 1.06 0.64 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 7.56 5.03 0.00 1.68 1.72 1.12 0.95 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 86 Q 7.87 4.38 0.00 2.25 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.41 7.10 0.00 0.00 0.00 0.00 0.00 2.38 2.56 0.00 87 D 8.53 4.43 0.00 2.65 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 88 N 8.08 4.58 0.00 2.70 2.75 0.00 0.00 6.94 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 8.43 4.26 1.78 0.00 0.00 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.56 0.95 0.00 0.00 90 A 8.63 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 8.07 4.30 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 7.98 4.11 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 93 V 8.16 3.35 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 0.71 0.00 0.00 0.90 0.00 0.00 94 A 8.01 3.84 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 95 C 8.33 4.23 0.00 3.14 3.26 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 96 A 8.16 3.90 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 K 7.58 3.75 0.00 1.58 1.36 0.00 1.27 0.00 0.00 0.83 0.00 0.00 2.30 0.00 0.00 2.47 0.00 0.00 0.00 0.00 0.30 0.81 7.81 98 R 7.72 4.07 0.00 1.95 2.12 0.00 3.27 0.00 0.00 3.19 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.96 0.00 99 V 7.48 2.29 1.84 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 -0.27 0.00 0.00 -0.47 0.00 0.00 100 V 7.66 3.91 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 1.15 0.00 0.00 1.46 0.00 0.00 101 R 7.60 4.16 0.00 2.02 2.06 0.00 3.24 0.00 0.00 3.39 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 2.15 0.00 102 D 7.31 4.68 0.00 2.97 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 0.00 103 P 0.00 4.24 0.00 2.01 2.12 0.00 3.68 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 2.02 2.12 0.00 104 Q 8.21 4.03 0.00 2.03 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.94 0.00 0.00 0.00 0.00 0.00 2.41 2.31 0.00 105 G 7.82 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 0.00 106 I 7.76 3.68 1.06 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 -0.30 -0.04 -0.56 0.00 0.00 107 R 7.25 4.15 0.00 2.00 2.01 0.00 3.22 0.00 0.00 3.27 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.56 0.00 108 A 7.55 4.03 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 W 7.99 4.76 0.00 3.53 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 8.70 3.77 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 0.90 0.00 0.00 0.98 0.00 0.00 111 A 8.34 4.02 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 8.28 4.00 0.00 3.44 3.52 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 0.00 113 R 8.26 3.75 0.00 2.04 1.99 0.00 3.34 0.00 0.00 3.32 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 2.04 0.00 114 N 7.92 4.36 0.00 2.67 2.69 0.00 0.00 6.91 7.75 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 0.00 115 R 7.59 4.11 0.00 1.23 0.67 0.00 2.21 0.00 0.00 2.33 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 1.01 0.00 116 C 7.13 4.56 0.00 1.73 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 0.00 117 Q 6.52 3.41 0.00 0.93 1.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.54 6.68 0.00 0.00 0.00 0.00 0.00 2.16 2.17 0.00 118 N 8.58 4.17 0.00 2.80 2.82 0.00 0.00 6.96 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 7.31 4.40 0.00 1.89 1.84 0.00 3.27 0.00 0.00 3.08 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.66 0.00 120 D 8.40 4.50 0.00 2.64 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 0.00 121 V 8.19 4.52 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 1.12 0.00 0.00 1.04 0.00 0.00 122 R 8.09 4.07 0.00 1.96 2.02 0.00 3.16 0.00 0.00 3.24 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.63 0.00 123 Q 8.13 3.96 0.00 2.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.08 6.91 0.00 0.00 0.00 0.00 0.00 2.16 1.48 0.00 124 Y 7.70 4.30 0.00 3.06 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 7.71 4.30 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 1.04 0.00 0.00 1.05 0.00 0.00 126 Q 7.61 4.22 0.00 2.22 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.07 0.00 0.00 0.00 0.00 0.00 2.47 2.30 0.00 127 G 8.88 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 0.00 128 C 8.10 4.42 0.00 3.11 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 8.23 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 0.00 130 V 7.82 4.00 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 0.76 0.00 0.00 0.96 0.00 0.00