NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 R 4.4916 8.2393 119.7049 55.9194 32.3424 173.5935 2 Q 4.1766 7.3021 124.9462 55.1928 30.1462 172.7273 3 E 4.9113 8.4547 115.8782 53.1257 33.3713 174.5019 4 P 4.4764 0.0000 0.0000 62.2031 31.8278 174.4245 5 P 4.6062 0.0000 0.0000 63.1050 32.3700 175.5830 6 K 4.4420 8.0442 117.6542 55.3766 36.3630 175.2793 7 I 4.1131 8.2029 123.5899 61.6732 36.1660 174.4761 8 H 5.0306 7.7679 119.9321 53.9992 34.2724 172.3778 9 L 4.5632 7.9938 120.6038 55.1944 41.6252 175.9252 10 D 4.9138 8.3089 120.0463 53.7307 44.1192 174.2224 11 C 4.8428 7.3544 120.0734 60.6935 35.5901 174.0196 12 P 4.2482 0.0000 0.0000 63.5217 31.4728 176.0754 13 G 3.8100 6.9902 107.3454 46.8367 0.0000 174.7576 14 R 4.3453 7.5213 117.0409 53.9807 31.3896 173.8001 15 I 4.0585 8.1775 126.5558 59.8952 38.1140 176.1824 16 P 4.6874 0.0000 0.0000 62.5178 29.8475 178.8264 17 D 4.9685 7.6932 120.3645 54.6977 37.8732 175.4047 18 T 4.5556 7.8715 119.2323 62.8109 72.1453 172.6497 19 I 3.9853 8.2538 128.0258 59.4141 39.1535 174.6050 20 V 4.9391 8.0623 128.8438 61.2174 34.5315 174.5769 21 V 4.3950 8.2767 124.0853 59.6914 35.1828 174.8475 22 V 4.1452 8.1993 120.6283 62.7581 30.4827 177.4036 23 A 3.4458 8.8004 118.4479 53.8792 15.8612 176.9174 24 G 3.6854 8.7469 111.8650 46.8729 0.0000 170.4261 25 N 5.0759 7.3945 113.8892 50.9132 44.2704 175.4728 26 K 4.2163 8.6156 119.9511 56.4055 32.5223 176.2928 27 L 4.6874 8.4738 127.8991 53.0212 44.8618 175.0368 28 R 4.8375 8.3399 124.4908 54.3498 33.1172 173.8657 29 L 4.7553 8.3878 127.3114 53.2803 45.2429 174.5379 30 D 5.3234 8.8088 125.1974 52.6175 44.1344 175.7763 31 V 4.6165 8.6608 116.2270 59.0420 35.7272 173.1628 32 P 4.7981 0.0000 0.0000 62.9010 32.3242 175.3485 33 I 4.8597 7.6923 121.1027 58.6593 41.5058 175.6152 34 S 4.4525 9.0097 123.2448 60.2656 64.1483 172.9457 35 G 4.1796 9.9962 107.4711 45.8479 0.0000 172.0855 36 D 4.6469 8.0882 119.6573 52.1502 44.2949 173.2853 37 P 4.2818 0.0000 0.0000 64.9896 31.9627 175.7965 38 A 4.9804 7.9351 121.1737 47.9474 20.8893 174.7057 39 P 4.9573 0.0000 0.0000 61.5797 33.9967 175.8158 40 T 4.4669 8.1942 113.3706 62.0519 69.3736 172.4107 41 V 4.0948 7.9456 123.7318 60.2780 32.1788 175.3353 42 I 4.0359 8.6226 128.9375 60.0691 38.5138 175.5102 43 W 4.6793 8.7190 128.0151 56.4132 28.9922 175.7429 44 Q 4.6239 8.9073 126.9347 54.6805 30.9227 174.0456 45 K 4.4479 8.5070 123.1296 54.4641 35.0156 175.0414 46 A 4.6406 8.7560 126.5915 50.4405 22.0233 176.7248 47 I 4.0082 8.6666 121.8889 60.4334 38.7226 175.5932 48 T 3.4087 7.5530 109.8129 62.7370 66.5052 170.9944 49 Q 4.1198 7.0123 119.6118 55.3615 30.5521 176.8448 50 G 4.4887 7.3070 118.3559 46.0572 0.0000 170.9356 51 N 4.5404 8.3813 126.6803 53.5012 41.3571 173.2231 52 K 3.4817 8.7066 117.3444 56.7889 32.0478 174.7019 53 A 4.1096 8.5134 119.6563 51.6830 18.5941 175.3168 54 P 4.5363 0.0000 0.0000 62.9996 32.1805 175.4453 55 A 4.5824 7.9124 119.3703 51.4442 21.8761 176.5903 56 R 4.5333 8.1398 120.6449 53.8290 29.7593 173.6877 57 P 4.5198 0.0000 0.0000 61.5954 33.4606 176.0380 58 A 4.3510 8.2216 120.9006 50.7328 19.5221 176.1583 59 P 4.4663 0.0000 0.0000 62.7584 30.7267 176.1540 60 D 4.7375 8.0323 126.3270 52.1591 41.1282 175.8788 61 A 3.8741 7.8543 121.9088 51.5909 18.3344 175.3822 62 P 4.6109 0.0000 0.0000 61.8438 31.7742 176.3002 63 E 4.0441 8.6390 123.7765 56.6975 29.9380 176.3833 64 D 4.5280 8.1037 121.5009 54.6949 44.8349 174.5900 65 T 4.1276 8.7201 108.5759 62.4261 70.2992 174.4346 66 G 3.8121 8.2349 108.5994 45.7811 0.0000 172.9303 67 D 4.7590 7.4695 112.8886 54.1744 42.5348 176.1883 68 S 4.2702 8.3920 114.4507 60.3969 62.8792 173.6447 69 D 4.8479 7.6873 118.4993 53.8072 42.9441 173.3017 70 E 4.6581 8.2290 117.5158 56.6323 32.8372 174.9554 71 W 4.6685 8.2483 126.3363 56.5293 29.1639 177.5051 72 V 3.3524 7.6370 120.3740 63.0360 32.2507 177.4052 73 F 3.2450 6.7559 119.9375 59.2195 39.9973 178.2779 74 D 3.9172 7.9616 122.4263 52.5627 41.3283 175.1541 75 K 4.1469 8.0402 119.8932 54.7806 33.1677 176.7229 76 K 4.0085 8.4608 127.1403 56.9814 31.2907 175.8396 77 L 4.1757 8.2841 127.0634 56.8949 42.1335 177.8833 78 L 4.2525 7.5513 120.6898 54.4934 39.6967 175.5903 79 C 4.2310 7.5917 120.3482 61.1017 29.1473 173.7853 80 E 4.3221 7.7057 126.5656 56.1304 29.2950 177.4323 81 T 4.2885 8.0474 123.7236 63.2282 70.1042 174.0499 82 E 4.2669 8.8187 120.5591 59.8118 29.9382 178.1310 83 G 4.1287 7.6581 107.2778 44.3169 0.0000 173.1756 84 R 4.6041 8.1713 118.5883 56.7063 32.1280 175.2667 85 V 4.6853 7.5310 117.0900 59.7718 35.6023 173.5623 86 R 4.6749 8.5328 123.0237 54.7024 32.5459 174.1293 87 V 4.4220 8.4528 126.6297 61.0814 33.5683 174.1260 88 E 4.8528 8.6603 127.4878 54.7870 33.7334 173.9885 89 T 4.7760 8.4496 121.2360 62.2632 69.8405 175.3785 90 T 4.2311 8.5445 117.6770 60.9240 70.0668 174.2736 91 K 4.1309 8.7136 119.6233 59.5331 31.9223 177.6018 92 D 5.2361 7.5565 118.2755 53.3389 41.7302 174.6672 93 R 4.7102 7.6486 111.9476 55.8624 32.5248 172.7944 94 S 5.2343 8.2503 114.0572 56.7902 65.9629 173.1592 95 I 5.0649 8.5909 122.5082 59.7253 40.7019 174.2073 96 F 4.8296 9.0244 130.0183 56.5679 40.6132 173.2758 97 T 5.2607 8.7743 119.7757 59.2860 69.5993 172.5681 98 V 4.6546 7.9534 128.6803 59.0502 34.6577 175.8819 99 E 5.1263 7.0232 122.0130 54.4217 29.1643 176.2016 100 G 4.0512 7.4488 101.8674 46.5125 0.0000 175.2601 101 A 4.2089 8.0700 124.8196 51.8604 16.3653 178.6749 102 E 4.4394 7.9567 122.1583 54.8377 33.3902 175.8122 103 K 4.0841 8.6668 118.8725 60.4342 31.6577 178.6474 104 E 4.1453 8.1842 117.4809 59.0809 29.4446 178.1525 105 D 4.8214 8.3414 119.7876 54.6738 41.8149 176.6423 106 E 4.2094 7.1612 118.6978 56.7743 31.1706 176.5181 107 G 4.2792 6.6798 110.8388 44.1645 0.0000 176.5897 108 V 4.9710 8.3443 123.8936 61.3662 34.9670 171.9300 109 Y 5.1569 9.2300 121.3255 56.8182 43.2245 174.8607 110 T 4.7541 9.6570 118.2771 61.9130 72.0503 173.4695 111 V 4.3379 8.4687 126.8898 61.1422 33.3226 175.0569 112 T 4.8313 8.7086 118.6829 60.3380 70.0824 172.7073 113 V 4.6167 8.5119 122.2543 59.7253 33.9531 174.9609 114 K 4.9026 8.3948 124.9559 55.3510 36.7425 174.1942 115 N 5.0957 8.4570 120.0257 52.1207 43.5715 173.6798 116 P 4.4458 0.0000 0.0000 64.4500 31.6201 177.0426 117 V 4.1492 6.9838 117.4989 64.2982 33.5668 175.4519 118 G 4.1684 7.2492 107.2157 46.7119 0.0000 172.0792 119 E 5.2422 8.5550 118.5005 55.9265 32.0853 174.6778 120 D 4.8837 9.2584 121.1250 53.2013 45.7504 173.0694 121 Q 5.0970 8.1665 120.5349 55.0229 32.8074 173.1788 122 V 4.4570 8.2239 119.7390 61.1050 35.0386 171.1299 123 N 5.4188 8.8403 118.9057 51.1961 39.6109 173.6846 124 L 5.7322 9.7541 124.2308 53.0626 45.0639 175.0659 125 T 4.8853 8.6758 123.3464 62.7350 70.0415 174.2436 126 V 5.4000 7.6648 124.9546 59.3824 34.9873 175.3898 127 K 4.4380 8.0537 119.5804 56.7245 35.2856 173.9107 128 V 4.5199 8.5165 128.5741 61.9138 32.3380 175.3846 129 I 4.3428 9.3981 130.0139 60.1590 39.6112 175.8440 130 D 4.4842 8.3917 121.9390 54.4898 41.2826 175.8055 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 R 8.24 4.49 0.00 1.81 1.99 0.00 3.14 0.00 0.00 3.22 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.62 0.00 2 Q 7.30 4.18 0.00 2.34 1.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.33 6.83 0.00 0.00 0.00 0.00 0.00 2.21 2.43 0.00 3 E 8.45 4.91 0.00 1.83 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 2.19 2.25 0.00 4 P 0.00 4.48 0.00 2.05 2.05 0.00 3.75 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.95 0.00 5 P 0.00 4.61 0.00 2.06 2.06 0.00 3.80 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.16 0.00 6 K 8.04 4.44 0.00 1.66 1.68 0.00 1.63 0.00 0.00 1.81 0.00 0.00 2.80 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.56 1.36 7.81 7 I 8.20 4.11 1.87 0.00 0.00 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 1.52 0.90 0.90 0.00 0.00 8 H 7.77 5.03 0.00 3.18 3.10 0.00 5.80 0.00 0.00 0.00 0.00 6.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 L 7.99 4.56 0.00 1.68 1.45 0.79 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 10 D 8.31 4.91 0.00 2.60 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 11 C 7.35 4.84 0.00 2.97 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 12 P 0.00 4.25 0.00 2.16 2.17 0.00 3.86 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.95 0.00 13 G 6.99 3.81 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 0.00 0.00 0.00 14 R 7.52 4.35 0.00 1.85 1.83 0.00 3.24 0.00 0.00 3.23 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.61 0.00 15 I 8.18 4.06 1.90 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 1.60 0.61 1.05 0.00 0.00 16 P 0.00 4.69 0.00 2.20 2.12 0.00 3.82 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.97 0.00 17 D 7.69 4.97 0.00 3.13 3.13 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 0.00 18 T 7.87 4.56 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 1.27 0.00 0.00 19 I 8.25 3.99 1.45 0.00 0.00 0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.50 0.70 0.00 0.00 20 V 8.06 4.94 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 0.98 0.00 0.00 0.88 0.00 0.00 21 V 8.28 4.40 1.92 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 0.56 0.00 0.00 0.91 0.00 0.00 22 V 8.20 4.15 2.20 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 1.11 0.00 0.00 0.90 0.00 0.00 23 A 8.80 3.45 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 24 G 8.75 3.69 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 0.00 0.00 0.00 25 N 7.39 5.08 0.00 2.62 2.60 0.00 0.00 6.98 7.05 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 26 K 8.62 4.22 0.00 1.60 1.74 0.00 1.68 0.00 0.00 1.61 0.00 0.00 2.67 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.41 1.40 7.81 27 L 8.47 4.69 0.00 1.69 1.50 0.77 0.27 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 28 R 8.34 4.84 0.00 1.73 1.68 0.00 3.26 0.00 0.00 3.12 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.69 0.00 29 L 8.39 4.76 0.00 1.44 1.44 1.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 30 D 8.81 5.32 0.00 2.55 2.56 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 0.00 0.00 0.00 0.00 31 V 8.66 4.62 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 1.17 0.00 0.00 1.35 0.00 0.00 32 P 0.00 4.80 0.00 2.08 2.06 0.00 3.74 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.01 0.00 33 I 7.69 4.86 1.85 0.00 0.00 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 1.08 1.44 0.93 0.00 0.00 34 S 9.01 4.45 0.00 3.94 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 35 G 10.00 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 36 D 8.09 4.65 0.00 2.61 2.49 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 37 P 0.00 4.28 0.00 2.22 2.15 0.00 3.77 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.95 0.00 38 A 7.94 4.98 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 P 0.00 4.96 0.00 2.14 2.08 0.00 3.30 0.00 0.00 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 2.17 0.00 40 T 8.19 4.47 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 41 V 7.95 4.09 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 0.00 0.00 0.19 0.00 0.00 42 I 8.62 4.04 1.77 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.48 0.86 0.00 0.00 43 W 8.72 4.68 0.00 2.97 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 44 Q 8.91 4.62 0.00 2.18 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.71 0.00 0.00 0.00 0.00 0.00 2.29 2.29 0.00 45 K 8.51 4.45 0.00 1.68 1.51 0.00 1.70 0.00 0.00 1.63 0.00 0.00 2.75 0.00 0.00 2.98 0.00 0.00 0.00 0.00 0.99 0.49 7.81 46 A 8.76 4.64 1.14 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 0.00 0.00 47 I 8.67 4.01 1.83 0.00 0.00 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 1.38 1.05 0.95 0.00 0.00 48 T 7.55 3.41 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 1.20 0.00 0.00 49 Q 7.01 4.12 0.00 2.05 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 7.27 0.00 0.00 0.00 0.00 0.00 2.30 2.34 0.00 50 G 7.31 4.49 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 0.00 0.00 0.00 51 N 8.38 4.54 0.00 2.61 2.67 0.00 0.00 7.23 6.67 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 52 K 8.71 3.48 0.00 1.85 1.77 0.00 1.73 0.00 0.00 1.70 0.00 0.00 2.87 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.32 1.46 7.81 53 A 8.51 4.11 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 P 0.00 4.54 0.00 2.19 2.08 0.00 3.80 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.96 0.00 55 A 7.91 4.58 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 56 R 8.14 4.53 0.00 1.74 1.82 0.00 3.24 0.00 0.00 3.28 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.57 0.00 57 P 0.00 4.52 0.00 2.22 2.09 0.00 3.84 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.96 0.00 58 A 8.22 4.35 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 59 P 0.00 4.47 0.00 2.19 2.13 0.00 3.71 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 1.99 1.98 0.00 60 D 8.03 4.74 0.00 2.61 2.61 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 0.00 0.00 0.00 0.00 61 A 7.85 3.87 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 P 0.00 4.61 0.00 2.19 2.10 0.00 3.78 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.99 0.00 63 E 8.64 4.04 0.00 1.98 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 0.00 2.32 2.34 0.00 64 D 8.10 4.53 0.00 2.61 2.57 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.72 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 1.22 0.00 0.00 66 G 8.23 3.81 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 0.00 0.00 0.00 67 D 7.47 4.76 0.00 2.58 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 68 S 8.39 4.27 0.00 3.89 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 69 D 7.69 4.85 0.00 2.72 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 E 8.23 4.66 0.00 1.96 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 0.00 2.28 2.29 0.00 71 W 8.25 4.67 0.00 3.46 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 72 V 7.64 3.35 1.95 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 0.80 0.00 0.00 0.92 0.00 0.00 73 F 6.76 3.25 0.00 2.66 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 74 D 7.96 3.92 0.00 2.56 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 0.00 0.00 0.00 75 K 8.04 4.15 0.00 1.61 1.65 0.00 1.72 0.00 0.00 1.57 0.00 0.00 2.88 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.29 1.33 7.81 76 K 8.46 4.01 0.00 1.71 1.75 0.00 1.72 0.00 0.00 1.70 0.00 0.00 3.11 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.43 1.53 7.81 77 L 8.28 4.18 0.00 1.66 1.70 0.91 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 78 L 7.55 4.25 0.00 1.61 1.61 0.93 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 79 C 7.59 4.23 0.00 3.01 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 80 E 7.71 4.32 0.00 2.07 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 2.29 2.36 0.00 81 T 8.05 4.29 4.33 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 1.22 0.00 0.00 82 E 8.82 4.27 0.00 1.96 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 2.31 2.31 0.00 83 G 7.66 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 0.00 0.00 0.00 0.00 84 R 8.17 4.60 0.00 1.89 1.88 0.00 3.14 0.00 0.00 3.41 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.60 0.00 85 V 7.53 4.69 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 0.87 0.00 0.00 1.06 0.00 0.00 86 R 8.53 4.67 0.00 2.02 1.83 0.00 3.03 0.00 0.00 3.11 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.54 0.00 87 V 8.45 4.42 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 0.68 0.00 0.00 0.74 0.00 0.00 88 E 8.66 4.85 0.00 2.20 1.75 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 2.22 2.29 0.00 89 T 8.45 4.78 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 1.28 0.00 0.00 90 T 8.54 4.23 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 1.24 0.00 0.00 91 K 8.71 4.13 0.00 1.82 1.91 0.00 1.63 0.00 0.00 1.75 0.00 0.00 2.84 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.54 1.39 7.81 92 D 7.56 5.24 0.00 2.74 2.53 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 93 R 7.65 4.71 0.00 2.16 2.01 0.00 3.01 0.00 0.00 3.41 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.50 0.00 94 S 8.25 5.23 0.00 4.18 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 95 I 8.59 5.06 1.96 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 1.15 1.00 0.00 0.00 96 F 9.02 4.83 0.00 1.69 2.27 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 97 T 8.77 5.26 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 1.29 0.00 0.00 98 V 7.95 4.65 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 0.28 0.00 0.00 1.02 0.00 0.00 99 E 7.02 5.13 0.00 2.07 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 2.35 2.21 0.00 100 G 7.45 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 0.00 0.00 0.00 0.00 101 A 8.07 4.21 1.12 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 0.00 0.00 102 E 7.96 4.44 0.00 2.04 1.93 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 2.36 2.49 0.00 103 K 8.67 4.08 0.00 1.83 1.85 0.00 1.73 0.00 0.00 1.83 0.00 0.00 2.93 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.53 1.57 7.81 104 E 8.18 4.15 0.00 2.02 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 2.34 2.43 0.00 105 D 8.34 4.82 0.00 2.82 2.79 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 0.00 106 E 7.16 4.21 0.00 2.06 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.48 0.00 107 G 6.68 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 V 8.34 4.97 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 0.97 0.00 0.00 109 Y 9.23 5.16 0.00 3.31 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 0.00 110 T 9.66 4.75 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 1.28 0.00 0.00 111 V 8.47 4.34 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 0.45 0.00 0.00 -0.86 0.00 0.00 112 T 8.71 4.83 4.16 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 1.19 0.00 0.00 113 V 8.51 4.62 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 0.63 0.00 0.00 0.91 0.00 0.00 114 K 8.39 4.90 0.00 1.74 1.53 0.00 1.63 0.00 0.00 1.62 0.00 0.00 2.79 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.29 1.36 7.81 115 N 8.46 5.10 0.00 2.62 2.64 0.00 0.00 7.08 8.13 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 0.00 116 P 0.00 4.45 0.00 2.16 2.16 0.00 3.77 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.94 0.00 117 V 6.98 4.15 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 0.75 0.00 0.00 0.93 0.00 0.00 118 G 7.25 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 E 8.56 5.24 0.00 1.95 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 0.00 2.08 2.20 0.00 120 D 9.26 4.88 0.00 2.68 2.45 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 0.00 121 Q 8.17 5.10 0.00 2.01 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.59 0.00 0.00 0.00 0.00 0.00 2.19 2.30 0.00 122 V 8.22 4.46 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 0.52 0.00 0.00 0.97 0.00 0.00 123 N 8.84 5.42 0.00 2.80 2.88 0.00 0.00 5.86 7.84 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 0.00 124 L 9.75 5.73 0.00 2.11 1.95 0.96 0.78 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 0.00 125 T 8.68 4.89 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 126 V 7.66 5.40 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 1.15 0.00 0.00 0.96 0.00 0.00 127 K 8.05 4.44 0.00 1.77 1.64 0.00 1.75 0.00 0.00 1.70 0.00 0.00 2.81 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.53 1.19 7.81 128 V 8.52 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 0.99 0.00 0.00 0.96 0.00 0.00 129 I 9.40 4.34 1.84 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 1.55 0.90 0.00 0.00 130 D 8.39 4.48 0.00 2.59 2.49 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