NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -2 S 4.3980 8.1885 116.7926 58.7351 64.8902 175.9210 -1 A 3.8797 8.0236 121.0081 52.6147 18.3433 176.3559 0 M 4.4749 8.1695 112.7068 54.6722 32.6102 174.0543 1 A 4.0277 7.5138 123.0342 52.1669 18.8676 178.2608 2 S 4.1985 8.5501 117.9797 58.7277 62.9831 173.5949 3 N 4.6854 8.4407 121.6880 52.8276 39.1854 175.3381 4 A 4.0777 7.7301 122.7130 51.5941 19.0091 178.1387 5 V 3.5031 7.9562 121.4554 61.5283 32.0828 176.2601 6 L 4.3587 7.6181 121.2685 53.1931 43.9052 175.8633 7 Y 4.5738 8.1644 121.5380 57.8255 39.1046 175.0167 8 K 4.7028 8.2394 120.1183 56.1634 36.7281 174.5978 9 S 5.0513 8.2055 112.4997 58.0256 64.1370 174.1622 10 N 5.2416 8.5808 119.0815 51.7524 39.5010 174.8128 11 H 4.5615 8.8586 113.5374 58.8668 28.8606 175.7448 12 N 5.0318 8.0027 112.6302 52.2623 40.6871 174.2786 13 V 4.5508 9.2383 119.5410 60.9225 35.0017 174.0969 14 V 4.8671 8.4660 127.2721 61.6207 33.1609 174.0430 15 Y 4.9972 8.5256 124.8453 56.7813 42.2128 173.9291 16 S 4.5404 8.6972 112.9192 58.1715 64.0219 173.3461 17 C 4.7527 8.8758 125.1284 57.8628 31.4991 173.1357 18 K 5.0938 8.3899 123.2712 54.6773 34.8900 174.9542 19 Y 5.0567 9.4785 121.6706 56.4403 41.9892 174.1016 20 H 5.3347 9.6934 123.9041 55.0455 31.6644 173.3376 21 I 5.1748 9.0393 127.6169 59.6667 40.1818 175.1689 22 V 5.2262 9.4235 125.5424 60.2898 35.4001 173.8638 23 W 5.5107 8.0514 122.1518 55.8035 31.4536 172.7149 24 C 5.5041 8.7740 116.9604 57.3190 32.5890 171.8756 25 P 5.1850 0.0000 0.0000 61.9078 32.8023 176.0658 26 K 3.9310 8.7936 122.9617 58.1986 32.4021 176.5470 27 Y 3.6162 8.7342 120.6248 58.1878 35.5258 169.7268 28 R 3.9672 8.0218 117.3805 57.2287 29.1531 176.6173 29 R 4.1750 7.8074 114.0244 55.8017 31.2071 178.0767 30 K 4.4575 8.3599 122.1882 55.7996 30.7054 177.6201 31 V 4.0022 7.3201 110.8046 62.2785 33.2281 177.8598 32 L 4.3209 7.7456 122.2329 53.3395 39.9891 175.0059 33 V 4.6530 6.9163 114.4152 59.5824 37.3942 177.5871 34 G 3.7600 8.3642 109.8813 46.4578 0.0000 175.8598 35 A 4.0126 8.6354 122.7479 54.9646 18.2024 179.3366 36 V 2.7357 7.3857 116.2497 65.9686 31.3382 177.7880 37 E 3.8753 8.0318 118.7431 59.5305 29.6634 178.3945 38 M 4.0512 7.7283 118.2896 58.8044 32.2693 178.4473 39 R 4.0359 8.3177 118.3648 58.8889 30.1881 178.5289 40 L 4.0513 8.1188 120.2898 58.4089 42.1185 179.2890 41 K 4.0242 8.0584 118.1526 59.4271 31.9722 179.2204 42 E 4.0100 8.1931 118.5743 59.4589 29.3558 179.3436 43 I 3.7718 8.2791 120.0839 64.7243 37.2568 178.5623 44 I 3.8092 8.2136 120.7704 64.5761 36.8957 178.5535 45 Q 4.1656 8.4113 118.9775 58.9209 28.4671 178.6912 46 E 4.0061 8.3264 119.6647 59.3657 29.4603 179.4652 47 V 3.6382 8.1805 118.2540 65.9196 31.5405 177.7282 48 A 4.1359 8.6632 120.8594 55.2421 18.0698 179.3441 49 K 3.8278 8.1778 117.9316 59.9577 32.0292 178.7946 50 E 4.0344 8.2787 117.4727 58.7733 29.3919 178.3220 51 L 4.2926 7.9588 116.4928 53.3419 42.0175 176.5125 52 R 3.7437 7.3330 116.2701 57.1638 28.2455 175.8556 53 V 4.1653 7.8476 116.9349 61.2085 33.3461 174.4604 54 E 4.4295 8.5321 128.8922 54.6582 31.1035 174.9375 55 I 4.1817 8.2926 128.9729 61.1203 36.8833 176.0042 56 I 4.0299 8.8961 130.1716 63.9065 37.9564 176.6046 57 E 4.7504 7.9289 120.5832 55.3270 33.1632 174.0173 58 M 5.2383 8.3709 125.4229 54.7510 35.4343 173.6849 59 Q 4.6887 9.3801 125.3437 54.3909 33.1144 174.3711 60 T 4.6280 8.5101 113.3729 59.6489 70.1843 174.3835 61 D 4.5493 8.2889 121.1686 53.2932 41.5477 174.4615 62 K 4.1147 7.9745 127.6708 56.9778 31.0340 178.0739 63 D 5.3630 7.4284 115.0558 52.5553 39.9128 174.8760 64 H 4.6425 7.0642 111.4108 55.8525 31.6710 172.3842 65 I 4.8211 7.5164 119.1641 59.5163 41.6051 173.2043 66 H 5.3386 9.2880 125.6033 54.1153 31.4075 173.3661 67 I 5.0395 8.6972 122.9439 59.3752 41.6908 174.4319 68 L 5.2359 9.4184 127.2961 53.5101 44.4048 174.7276 69 A 5.1512 9.1995 128.6307 50.0182 22.5828 174.3708 70 D 5.2356 8.9268 121.3840 52.9699 42.5146 175.2726 71 I 4.9375 8.7162 126.6977 59.0571 41.2802 175.3049 72 D 3.4621 8.5549 124.8667 53.0444 41.4972 175.5105 73 P 4.3553 0.0000 0.0000 66.0875 31.3078 178.4659 74 S 4.2404 8.3757 114.8474 61.1136 62.7379 176.0250 75 F 4.4427 8.0527 122.5423 59.5524 39.7265 175.8373 76 G 3.7574 7.9709 107.6542 45.8188 0.0000 174.5544 77 V 3.4775 8.2266 125.1771 65.1620 31.1016 178.3725 78 M 3.9537 7.7730 118.7548 57.9867 31.7771 178.6140 79 K 3.8226 7.7106 118.6677 59.1157 32.0893 179.1266 80 F 4.3032 8.0976 120.3700 61.4696 39.5071 176.8782 81 I 3.1515 7.7867 119.3591 64.2115 36.8555 178.2952 82 K 3.6765 8.1689 120.5620 59.7121 31.8946 179.0174 83 T 3.8096 7.7186 115.7043 66.2870 68.4525 176.8018 84 A 3.8550 7.9332 122.9305 55.0302 18.3178 179.8431 85 K 3.4478 7.7013 117.3203 59.3356 32.1587 179.7271 86 G 3.6681 7.9526 105.9979 47.9868 0.0000 175.6185 87 R 3.9633 8.3842 121.9584 59.0516 30.0830 178.6072 88 S 4.2591 8.2469 114.1956 61.5758 62.7743 176.4210 89 S 3.9351 8.5739 116.8069 61.0782 62.0973 175.6738 90 R 3.8815 7.8867 120.9326 59.7596 29.7176 178.5036 91 I 3.7135 7.9434 119.0426 64.5733 37.1491 178.5621 92 L 4.2606 8.3078 120.0302 57.9259 41.2073 179.6437 93 R 4.0290 8.0991 116.7912 58.3840 30.0997 178.3681 94 Q 4.1976 7.5507 117.4122 58.3694 29.1019 177.5210 95 E 4.2310 8.4149 118.6700 56.8524 30.2835 176.5659 96 F 4.5690 8.2412 117.3901 54.4802 40.3741 174.6204 97 N 4.2905 8.7927 125.2457 56.9996 38.6543 175.8887 98 H 4.3187 8.3119 115.8710 58.4870 28.4088 177.2919 99 L 4.0224 7.7035 120.7138 56.6502 41.4848 178.5995 100 K 4.1491 7.7393 118.9256 59.1004 32.5607 178.2276 101 T 4.1341 7.8600 109.0628 63.9761 69.1039 176.0938 102 K 4.4048 7.7188 117.7976 55.3818 32.9364 176.4778 103 L 4.9388 7.1379 118.8700 52.0442 45.5004 174.7901 104 P 4.4181 0.0000 0.0000 65.6377 31.5524 176.2540 105 T 4.5848 7.1491 105.9868 59.9611 71.7960 173.3088 106 L 3.7210 8.3217 123.8637 56.7648 42.2818 176.5874 107 W 5.1646 7.5007 116.0816 55.1490 31.6325 174.3732 108 T 4.4610 7.7462 110.7110 60.4513 70.1133 174.2267 109 N 4.6270 8.5450 117.1121 52.8976 37.5690 174.2039 110 S 4.7985 7.5314 113.3522 56.9920 65.9028 172.1941 111 C 4.9186 7.9624 113.1535 57.7322 31.9294 172.6316 112 F 4.8802 9.4561 122.7213 56.5422 41.3337 174.2443 113 I 5.0264 7.6084 125.6751 59.5563 40.5825 174.6975 114 S 4.5800 9.1771 121.6579 56.5517 65.3700 173.4042 115 T 4.5728 8.6461 117.7382 61.7737 69.6237 174.1187 116 V 4.5253 8.3516 121.8769 60.5136 34.8406 174.0925 117 G 4.1829 8.3634 109.9674 43.7175 0.0000 172.6740 118 G 3.5308 8.6953 107.0790 47.6808 0.0000 174.0855 119 A 4.5961 7.5404 121.1628 49.5560 21.1459 174.6523 120 P 4.5639 0.0000 0.0000 61.7896 32.8346 176.9697 121 L 3.8985 8.7262 121.3738 58.8681 41.7644 179.0451 122 N 4.3220 8.1608 116.0335 56.4893 38.8771 176.9249 123 V 3.5881 7.7554 119.7059 65.9414 31.6715 178.2056 124 V 3.6460 7.7418 117.5634 65.8114 31.3867 177.6401 125 K 3.9572 8.4480 119.7700 59.8082 31.9809 178.8671 126 Q 4.0214 8.2335 118.3169 58.8674 28.3775 177.8570 127 Y 4.0966 8.0243 119.9677 60.8499 39.1214 178.1115 128 I 3.7839 8.0682 120.6934 64.3471 37.0278 178.0013 129 E 4.0079 8.1517 119.0750 58.6133 28.2454 177.3579 130 N 4.8624 8.0813 115.9711 53.1230 39.4925 177.1676 131 Q 3.9930 7.6200 122.3254 58.3900 29.1260 177.0746 132 Q 4.1979 7.3028 118.1122 55.8850 28.9175 175.2309 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 -2 S 8.19 4.40 0.00 3.89 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 -1 A 8.02 3.88 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 0 M 8.17 4.47 0.00 2.09 2.12 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.48 0.00 1 A 7.51 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 2 S 8.55 4.20 0.00 3.81 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 N 8.44 4.69 0.00 2.70 2.78 0.00 0.00 6.94 7.35 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 4 A 7.73 4.08 1.19 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 0.00 0.00 5 V 7.96 3.50 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 0.55 0.00 0.00 -0.12 0.00 0.00 6 L 7.62 4.36 0.00 1.46 1.49 0.87 0.80 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 7 Y 8.16 4.57 0.00 2.83 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 8 K 8.24 4.70 0.00 1.57 1.70 0.00 1.45 0.00 0.00 1.67 0.00 0.00 2.78 0.00 0.00 2.86 0.00 0.00 0.00 0.00 0.82 0.21 7.81 9 S 8.21 5.05 0.00 3.95 3.78 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 10 N 8.58 5.24 0.00 3.02 3.29 0.00 0.00 7.30 8.06 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 11 H 8.86 4.56 0.00 3.22 3.41 0.00 5.64 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 12 N 8.00 5.03 0.00 2.77 2.83 0.00 0.00 6.70 7.56 0.00 0.00 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 V 9.24 4.55 2.30 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 1.06 0.00 0.00 1.00 0.00 0.00 14 V 8.47 4.87 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 0.72 0.00 0.00 0.89 0.00 0.00 15 Y 8.53 5.00 0.00 3.16 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 16 S 8.70 4.54 0.00 3.56 3.76 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 17 C 8.88 4.75 0.00 3.27 2.77 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.39 5.09 0.00 1.79 1.65 0.00 1.54 0.00 0.00 1.78 0.00 0.00 2.79 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.40 1.37 7.81 19 Y 9.48 5.06 0.00 2.93 2.87 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 20 H 9.69 5.33 0.00 3.25 3.46 0.00 5.55 0.00 0.00 0.00 0.00 6.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 I 9.04 5.17 2.08 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 1.09 1.29 0.00 0.00 22 V 9.42 5.23 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 1.06 0.00 0.00 0.79 0.00 0.00 23 W 8.05 5.51 0.00 3.14 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 24 C 8.77 5.50 0.00 3.00 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 25 P 0.00 5.19 0.00 2.25 1.88 0.00 3.87 0.00 0.00 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.41 0.00 26 K 8.79 3.93 0.00 1.61 1.37 0.00 1.31 0.00 0.00 1.37 0.00 0.00 2.65 0.00 0.00 2.47 0.00 0.00 0.00 0.00 0.69 0.21 7.81 27 Y 8.73 3.62 0.00 3.20 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 28 R 8.02 3.97 0.00 2.00 2.03 0.00 3.29 0.00 0.00 3.26 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.64 0.00 29 R 7.81 4.17 0.00 1.92 1.89 0.00 3.30 0.00 0.00 3.28 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.96 0.00 30 K 8.36 4.46 0.00 1.76 1.79 0.00 1.75 0.00 0.00 1.72 0.00 0.00 2.98 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.47 1.49 7.81 31 V 7.32 4.00 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 0.71 0.00 0.00 0.89 0.00 0.00 32 L 7.75 4.32 0.00 1.71 1.66 1.15 0.86 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 33 V 6.92 4.65 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 0.74 0.00 0.00 0.90 0.00 0.00 34 G 8.36 3.76 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 0.00 35 A 8.64 4.01 1.54 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 0.00 0.00 36 V 7.39 2.74 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 0.79 0.00 0.00 -0.01 0.00 0.00 37 E 8.03 3.88 0.00 2.12 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.30 0.00 38 M 7.73 4.05 0.00 2.23 2.07 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.75 0.00 39 R 8.32 4.04 0.00 1.99 2.13 0.00 3.64 0.00 0.00 3.20 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 2.16 0.00 40 L 8.12 4.05 0.00 1.96 1.97 1.38 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 41 K 8.06 4.02 0.00 1.90 1.88 0.00 1.74 0.00 0.00 1.66 0.00 0.00 2.94 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.47 1.67 7.81 42 E 8.19 4.01 0.00 2.29 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 2.49 0.00 43 I 8.28 3.77 2.14 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.94 1.00 0.00 0.00 44 I 8.21 3.81 1.99 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.80 1.14 0.00 0.00 45 Q 8.41 4.17 0.00 2.40 2.20 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 2.59 2.59 0.00 46 E 8.33 4.01 0.00 2.26 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 0.00 2.37 2.57 0.00 47 V 8.18 3.64 2.36 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 1.17 0.00 0.00 1.03 0.00 0.00 48 A 8.66 4.14 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 49 K 8.18 3.83 0.00 1.97 2.02 0.00 1.66 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.45 1.50 7.81 50 E 8.28 4.03 0.00 2.21 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 0.00 2.37 2.55 0.00 51 L 7.96 4.29 0.00 1.82 1.54 1.09 1.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 0.00 0.00 0.00 0.00 0.00 0.00 52 R 7.33 3.74 0.00 1.68 1.90 0.00 3.04 0.00 0.00 3.10 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.41 0.00 53 V 7.85 4.17 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 -0.09 0.00 0.00 0.76 0.00 0.00 54 E 8.53 4.43 0.00 2.07 1.78 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 2.20 2.25 0.00 55 I 8.29 4.18 1.89 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.00 0.95 0.00 0.00 56 I 8.90 4.03 1.93 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 1.09 0.55 0.89 0.00 0.00 57 E 7.93 4.75 0.00 2.04 1.72 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 2.26 2.35 0.00 58 M 8.37 5.24 0.00 2.03 1.90 0.00 0.00 0.00 0.00 0.00 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.55 0.00 59 Q 9.38 4.69 0.00 1.91 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.51 0.00 0.00 0.00 0.00 0.00 2.24 2.40 0.00 60 T 8.51 4.63 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 1.16 0.00 0.00 61 D 8.29 4.55 0.00 2.53 2.22 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 62 K 7.97 4.11 0.00 2.04 1.92 0.00 1.66 0.00 0.00 1.87 0.00 0.00 2.95 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.41 1.40 7.81 63 D 7.43 5.36 0.00 2.93 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 H 7.06 4.64 0.00 3.29 3.38 0.00 5.21 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 I 7.52 4.82 1.55 0.00 0.00 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 1.38 -0.45 0.00 0.00 66 H 9.29 5.34 0.00 3.00 3.20 0.00 5.61 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 I 8.70 5.04 1.95 0.00 0.00 0.77 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 0.55 1.09 0.00 0.00 68 L 9.42 5.24 0.00 1.69 1.61 0.99 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 69 A 9.20 5.15 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 D 8.93 5.24 0.00 2.75 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 71 I 8.72 4.94 1.99 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.82 1.02 0.00 0.00 72 D 8.55 3.46 0.00 2.53 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 73 P 0.00 4.36 0.00 2.26 2.20 0.00 2.61 0.00 0.00 3.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 2.01 0.00 74 S 8.38 4.24 0.00 3.96 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 75 F 8.05 4.44 0.00 2.91 3.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 G 7.97 3.76 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 0.00 77 V 8.23 3.48 0.69 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 0.54 0.00 0.00 0.55 0.00 0.00 78 M 7.77 3.95 0.00 1.92 2.02 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.47 0.00 79 K 7.71 3.82 0.00 1.08 1.30 0.00 0.98 0.00 0.00 1.12 0.00 0.00 2.71 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.18 1.08 7.81 80 F 8.10 4.30 0.00 3.30 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 81 I 7.79 3.15 1.69 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 1.50 0.65 0.48 0.00 0.00 82 K 8.17 3.68 0.00 1.60 1.84 0.00 1.52 0.00 0.00 1.56 0.00 0.00 2.86 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.32 1.37 7.81 83 T 7.72 3.81 4.31 0.00 0.00 0.00 0.00 0.00 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 84 A 7.93 3.85 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 85 K 7.70 3.45 0.00 1.19 1.14 0.00 0.61 0.00 0.00 0.65 0.00 0.00 2.23 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.30 0.21 7.81 86 G 7.95 3.67 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 0.00 0.00 0.00 87 R 8.38 3.96 0.00 1.88 2.04 0.00 3.15 0.00 0.00 3.26 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.66 0.00 88 S 8.25 4.26 0.00 4.43 4.39 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 89 S 8.57 3.94 0.00 4.13 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 90 R 7.89 3.88 0.00 2.01 2.07 0.00 3.20 0.00 0.00 3.17 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.75 0.00 91 I 7.94 3.71 1.94 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.69 0.97 0.00 0.00 92 L 8.31 4.26 0.00 1.76 1.75 1.00 1.24 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 93 R 8.10 4.03 0.00 1.94 1.96 0.00 3.08 0.00 0.00 3.25 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.57 0.00 94 Q 7.55 4.20 0.00 2.17 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 7.00 0.00 0.00 0.00 0.00 0.00 2.36 2.56 0.00 95 E 8.41 4.23 0.00 1.76 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 2.23 2.53 0.00 96 F 8.24 4.57 0.00 3.16 2.86 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 97 N 8.79 4.29 0.00 2.75 2.86 0.00 0.00 6.85 7.89 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 98 H 8.31 4.32 0.00 3.40 3.58 0.00 5.51 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 L 7.70 4.02 0.00 1.69 1.63 0.78 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 100 K 7.74 4.15 0.00 1.86 1.96 0.00 1.65 0.00 0.00 1.74 0.00 0.00 3.41 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.39 1.54 7.81 101 T 7.86 4.13 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 102 K 7.72 4.40 0.00 1.90 1.92 0.00 1.70 0.00 0.00 1.73 0.00 0.00 3.04 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.44 1.49 7.81 103 L 7.14 4.94 0.00 1.70 1.67 0.84 1.20 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 0.00 104 P 0.00 4.42 0.00 2.18 2.24 0.00 3.87 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 2.07 0.00 105 T 7.15 4.58 4.18 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 0.00 0.00 0.00 1.17 0.00 0.00 106 L 8.32 3.72 0.00 1.34 0.97 0.46 0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 107 W 7.50 5.16 0.00 3.17 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 0.00 108 T 7.75 4.46 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 109 N 8.55 4.63 0.00 2.82 2.93 0.00 0.00 5.73 7.64 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 0.00 110 S 7.53 4.80 0.00 3.99 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 0.00 111 C 7.96 4.92 0.00 3.23 2.88 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 0.00 112 F 9.46 4.88 0.00 3.15 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 I 7.61 5.03 1.79 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 1.26 0.76 1.02 0.00 0.00 114 S 9.18 4.58 0.00 3.68 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 T 8.65 4.57 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 116 V 8.35 4.53 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 0.64 0.00 0.00 0.91 0.00 0.00 117 G 8.36 4.18 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 G 8.70 3.53 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 0.00 119 A 7.54 4.60 1.19 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 0.00 0.00 120 P 0.00 4.56 0.00 2.23 2.17 0.00 3.71 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 1.94 0.00 121 L 8.73 3.90 0.00 1.78 1.74 0.93 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 122 N 8.16 4.32 0.00 2.81 2.81 0.00 0.00 6.81 7.71 0.00 0.00 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 V 7.76 3.59 2.22 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 0.92 0.00 0.00 0.93 0.00 0.00 124 V 7.74 3.65 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 1.03 0.00 0.00 0.98 0.00 0.00 125 K 8.45 3.96 0.00 1.96 1.96 0.00 1.70 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.46 1.50 7.81 126 Q 8.23 4.02 0.00 2.21 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.57 0.00 0.00 0.00 0.00 0.00 2.40 2.56 0.00 127 Y 8.02 4.10 0.00 3.05 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 0.00 128 I 8.07 3.78 2.01 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 1.82 1.23 0.91 0.00 0.00 129 E 8.15 4.01 0.00 2.10 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 0.00 2.31 2.35 0.00 130 N 8.08 4.86 0.00 2.81 2.73 0.00 0.00 6.92 7.97 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 0.00 131 Q 7.62 3.99 0.00 1.95 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.87 6.76 0.00 0.00 0.00 0.00 0.00 2.46 2.40 0.00 132 Q 7.30 4.20 0.00 1.96 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.98 6.55 0.00 0.00 0.00 0.00 0.00 2.28 2.23 0.00