NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9742 8.3016 109.1322 45.6803 0.0000 173.5055 2 S 4.2973 8.6783 114.3282 58.5060 65.0420 174.3738 3 S 4.6274 8.1623 113.0649 57.9696 63.9133 172.5774 4 G 3.5528 8.2945 104.2057 45.3458 0.0000 172.3062 5 S 4.9220 7.4771 115.9634 56.7811 66.9347 175.0621 6 S 4.4919 7.9297 109.7421 58.9970 65.6417 175.9540 7 G 4.0497 7.9413 107.8644 45.2570 0.0000 174.5157 8 D 4.5403 8.2614 121.5582 55.9790 41.6641 177.8025 9 R 4.4281 7.6647 115.6626 57.1342 31.5722 175.8016 10 R 4.5047 7.7539 116.2609 56.9243 33.4077 173.9221 11 S 4.5994 8.4654 111.0801 59.1336 69.4426 171.8658 12 T 3.1337 8.4561 126.2704 63.0721 67.4439 170.1479 13 L 3.5105 8.4205 130.0052 54.2116 41.3308 173.3902 14 H 5.0524 8.2548 118.6970 54.8791 32.0288 173.5943 15 L 4.4189 7.7317 122.4655 54.0301 44.7290 174.2036 16 L 4.4612 8.2991 125.2020 53.7436 42.8656 176.8394 17 Q 4.4236 8.4479 121.2877 53.8788 29.5505 174.4112 18 G 3.8351 8.3704 110.3155 42.5463 0.0000 169.9812 19 G 3.8841 8.5556 111.2906 45.1747 0.0000 170.2191 20 D 4.9811 8.3313 115.0500 54.2446 41.7981 176.6462 21 E 4.5423 8.1785 117.2166 55.8024 31.2821 176.4182 22 K 4.3878 8.6688 123.4870 54.8322 35.6520 174.9699 23 K 4.2072 8.7728 129.9394 55.6807 33.0072 176.4284 24 V 4.2117 9.0256 130.4054 61.4534 32.1373 173.6228 25 N 5.2641 8.5124 125.5453 51.6010 38.6631 174.5014 26 L 4.8526 9.0136 123.5826 52.6167 45.8283 175.6141 27 V 4.2889 7.7465 122.3777 61.2716 32.8886 175.2079 28 L 4.5145 8.2388 128.3983 54.0879 43.7679 178.9528 29 G 3.7174 8.8161 108.9203 45.7277 0.0000 175.8984 30 D 4.6060 9.4700 126.8555 54.0886 41.7084 173.8740 31 G 3.9083 8.8797 114.2136 45.4543 0.0000 171.7799 32 R 4.3648 7.4331 118.8467 55.3329 30.5257 174.8695 33 S 4.5579 7.7424 112.9065 58.9375 66.2858 177.1553 34 L 4.3640 8.2095 120.3555 55.2342 42.1758 178.1992 35 G 4.1689 7.9693 105.1054 46.5335 0.0000 172.0986 36 L 5.1014 7.9040 118.9434 53.0687 43.8574 177.7445 37 T 4.4519 8.7235 122.4051 62.5765 67.5293 174.1930 38 I 5.1865 8.2505 118.6897 60.0733 39.2166 175.2620 39 R 4.7370 8.3741 118.9592 55.4389 33.4906 175.3290 40 G 4.6125 8.7032 103.7897 46.4367 0.0000 172.5139 41 G 4.0230 7.7730 107.1999 45.1107 0.0000 174.4995 42 A 4.1244 8.4325 122.0739 54.8776 18.4848 178.9408 43 E 3.9223 8.1806 115.8030 59.0209 29.8220 177.1436 44 Y 4.3535 7.8653 114.6220 58.1744 38.8321 176.2834 45 G 4.0643 8.9827 107.6278 45.2504 0.0000 172.5290 46 L 4.8904 7.9042 119.9549 52.5114 46.0992 176.4298 47 G 4.0293 8.9232 110.8700 46.4895 0.0000 172.1857 48 I 4.5866 8.1227 120.5127 60.3861 38.0083 175.0144 49 Y 5.2451 8.5719 125.6889 55.4317 41.5858 174.3444 50 I 5.0857 8.3385 119.3115 59.7018 41.0866 176.5052 51 T 4.9124 8.8484 118.0263 60.9714 69.1421 174.0060 52 G 4.3381 7.6820 104.3605 47.2218 0.0000 173.4201 53 V 4.8784 8.4181 123.6205 60.8708 34.4022 174.7198 54 D 4.5636 8.9496 128.4335 53.6076 42.0242 174.8899 55 P 4.6955 0.0000 0.0000 60.7300 29.5092 176.1328 56 G 4.1973 8.1957 121.5297 47.1380 0.0000 171.7270 57 S 4.7029 7.9881 114.8570 56.5655 66.7709 173.2048 58 E 4.0090 8.0718 118.9690 59.2044 28.9696 179.3576 59 A 4.0243 7.5628 121.2186 54.6599 18.6107 179.3549 60 E 3.9480 8.1068 118.1104 59.3627 29.5385 179.2529 61 G 3.6857 7.5282 104.1341 47.8881 0.0000 175.1913 62 S 4.3008 7.5516 114.7129 61.3171 62.7495 173.9086 63 G 3.7796 6.8692 108.7204 45.9631 0.0000 173.4593 64 L 4.6534 8.0529 120.0855 52.6097 43.6460 176.5220 65 K 4.7145 8.0756 120.8051 54.3739 36.4191 175.9047 66 V 4.0012 8.0524 112.8145 62.6244 31.9223 175.8155 67 G 4.1696 9.2675 110.8313 45.6284 0.0000 174.3249 68 D 4.5435 7.5555 118.4368 54.5170 42.3598 175.7093 69 Q 4.5239 8.4461 122.5110 54.1451 31.3295 174.5668 70 I 3.8694 8.5775 129.3823 61.5336 37.1985 176.3498 71 L 4.3130 8.9097 128.9238 56.8089 42.1103 176.8255 72 E 5.2874 7.7291 114.9023 54.9889 33.9804 173.6821 73 V 4.5845 7.9727 118.8903 61.4647 34.3712 175.1000 74 N 4.2241 9.6300 123.3280 54.4678 35.8373 174.3549 75 G 3.8711 8.4303 103.0121 46.4999 0.0000 173.9401 76 R 4.5745 7.6493 118.9549 53.6147 32.4462 174.7311 77 S 4.4524 8.8528 121.2158 59.4023 62.7305 173.8910 78 F 4.6426 8.7997 125.8445 57.5235 39.1954 177.4135 79 L 4.4331 8.0515 123.0227 55.9748 42.2312 176.9760 80 N 5.0315 7.8126 115.2724 52.2389 38.0221 173.6901 81 I 4.0782 7.4961 118.3386 60.4049 39.6270 174.8246 82 L 4.3860 8.0940 126.6999 54.8812 43.5183 178.1840 83 H 4.2595 8.6479 119.8714 59.7240 30.1466 177.3521 84 D 4.3596 8.0736 120.4983 56.3666 39.2817 177.8672 85 E 3.9325 8.0971 120.1384 58.8690 29.7839 178.3674 86 A 4.1800 8.0749 120.9935 54.7931 18.2161 179.6591 87 V 3.7748 7.5916 116.0990 65.5630 31.7569 178.0277 88 R 4.2065 7.9209 117.6115 58.6118 30.4396 178.4785 89 L 4.0403 8.3611 120.4477 58.1266 41.7718 179.0596 90 L 4.2600 7.6000 117.0096 56.5966 41.8242 178.0999 91 K 4.6454 7.6272 117.4458 56.4594 33.5517 177.4030 92 S 4.4152 7.8361 112.2176 59.8451 64.8563 174.1483 93 S 4.3666 7.4518 111.9689 58.0788 62.6722 173.8139 94 R 4.0085 8.3779 125.5829 59.3802 30.5178 176.2369 95 H 4.9197 8.1187 126.6507 55.4292 30.1159 173.9681 96 L 4.3291 8.6119 127.5188 53.5929 42.2206 176.6046 97 I 4.6228 7.8748 127.9686 59.6210 36.2902 173.7405 98 L 4.0729 8.5872 123.8421 55.1448 43.0876 176.8584 99 T 5.2596 8.4612 122.6328 61.4996 68.6043 174.5788 100 V 5.0234 8.1639 119.4505 58.7266 34.8380 174.4792 101 K 4.9399 8.2097 120.5309 55.1367 35.3883 176.6250 102 D 4.4587 8.4009 121.4837 54.6510 39.4300 176.0568 103 V 3.9800 8.1928 121.0068 59.5024 30.2016 173.5447 104 G 3.7213 7.6421 111.1829 45.0275 0.0000 169.9648 105 R 4.4214 8.0490 120.8885 57.4873 32.9000 175.6485 106 L 4.7516 7.5829 116.3918 52.1985 43.7835 175.1068 107 P 4.2355 0.0000 0.0000 64.3799 31.5010 176.4558 108 H 4.5268 7.4372 113.0713 54.5622 29.6293 172.7384 109 A 4.8266 8.4315 126.5705 50.8420 22.5186 173.8624 110 R 4.8288 8.4236 115.5423 57.7320 36.8924 175.4208 111 T 4.6897 7.6650 106.3912 59.8988 68.1972 173.2548 112 T 4.5721 7.6800 122.7170 63.4184 69.7448 175.1863 113 V 4.0216 7.0877 114.2722 61.7106 34.0337 173.2077 114 D 4.4363 8.1096 120.0345 53.4986 42.4081 175.3595 115 E 4.1582 8.9720 125.8025 59.2771 30.0266 178.8620 116 T 3.9544 7.8812 108.4854 61.7943 69.6870 173.5041 117 K 3.7065 8.3794 122.8555 57.1594 30.0086 171.4563 118 W 3.1978 8.2791 122.5375 55.9292 27.5285 174.7144 119 I 4.1512 8.1215 116.4053 59.9327 38.4277 175.0123 120 A 4.6048 8.2618 122.1400 50.6613 21.1550 175.5781 121 S 4.6469 8.5013 118.1878 56.9734 65.9406 172.7733 122 S 3.6453 8.6102 119.7194 59.0510 58.8883 171.6175 123 S 4.7363 7.9718 118.8257 57.2893 66.5610 172.6535 124 G 4.2695 7.8930 110.3002 45.9356 0.0000 171.8036 125 P 4.3784 0.0000 0.0000 62.8389 32.0175 177.6159 126 S 4.6358 8.3229 117.1471 58.5266 64.3533 175.3580 127 S 4.5529 8.1759 116.4062 58.7305 64.4323 174.7123 128 G 3.7766 7.7949 111.6134 46.4446 0.0000 172.7601 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 G 8.30 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 2 S 8.68 4.30 0.00 3.85 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 3 S 8.16 4.63 0.00 3.84 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 4 G 8.29 3.55 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 0.00 0.00 0.00 0.00 0.00 0.00 5 S 7.48 4.92 0.00 4.04 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 6 S 7.93 4.49 0.00 4.04 4.06 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 7 G 7.94 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 8 D 8.26 4.54 0.00 2.66 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 9 R 7.66 4.43 0.00 1.76 1.96 0.00 3.30 0.00 0.00 3.28 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.65 0.00 10 R 7.75 4.50 0.00 1.85 1.97 0.00 3.07 0.00 0.00 3.27 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.48 0.00 11 S 8.47 4.60 0.00 3.97 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 12 T 8.46 3.13 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 1.23 0.00 0.00 13 L 8.42 3.51 0.00 1.78 1.67 0.92 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 0.00 0.00 0.00 0.00 0.00 0.00 14 H 8.25 5.05 0.00 3.05 3.16 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 15 L 7.73 4.42 0.00 1.57 1.44 0.91 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 16 L 8.30 4.46 0.00 1.62 1.54 0.87 0.84 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 17 Q 8.45 4.42 0.00 1.96 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 7.07 0.00 0.00 0.00 0.00 0.00 2.23 2.29 0.00 18 G 8.37 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 19 G 8.56 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 20 D 8.33 4.98 0.00 2.68 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 21 E 8.18 4.54 0.00 1.81 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 2.27 2.34 0.00 22 K 8.67 4.39 0.00 1.77 1.72 0.00 1.61 0.00 0.00 1.56 0.00 0.00 2.75 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.31 1.36 7.81 23 K 8.77 4.21 0.00 1.78 1.69 0.00 1.78 0.00 0.00 1.60 0.00 0.00 2.65 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.35 1.39 7.81 24 V 9.03 4.21 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 0.90 0.00 0.00 0.95 0.00 0.00 25 N 8.51 5.26 0.00 2.81 2.80 0.00 0.00 6.12 7.80 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 26 L 9.01 4.85 0.00 1.55 1.54 0.90 0.91 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 27 V 7.75 4.29 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 0.76 0.00 0.00 0.72 0.00 0.00 28 L 8.24 4.51 0.00 1.50 1.56 0.95 0.84 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 29 G 8.82 3.72 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 0.00 0.00 0.00 30 D 9.47 4.61 0.00 2.58 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 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 32 R 7.43 4.36 0.00 1.80 1.90 0.00 3.41 0.00 0.00 3.22 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.64 0.00 33 S 7.74 4.56 0.00 3.82 3.72 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 34 L 8.21 4.36 0.00 1.70 1.69 0.91 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 35 G 7.97 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 36 L 7.90 5.10 0.00 1.53 1.61 0.92 1.00 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 37 T 8.72 4.45 4.23 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 1.24 0.00 0.00 38 I 8.25 5.19 2.03 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.18 1.00 0.00 0.00 39 R 8.37 4.74 0.00 1.88 2.06 0.00 3.27 0.00 0.00 3.34 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.78 0.00 40 G 8.70 4.61 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 0.00 0.00 0.00 41 G 7.77 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 0.00 0.00 0.00 42 A 8.43 4.12 1.27 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 0.00 0.00 43 E 8.18 3.92 0.00 1.75 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 2.13 0.00 44 Y 7.87 4.35 0.00 3.03 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 45 G 8.98 4.06 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 0.00 0.00 0.00 46 L 7.90 4.89 0.00 1.80 1.58 0.90 1.01 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 47 G 8.92 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 0.00 0.00 0.00 48 I 8.12 4.59 2.13 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.11 1.11 0.00 0.00 49 Y 8.57 5.25 0.00 2.89 2.94 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 50 I 8.34 5.09 2.05 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 0.90 0.94 0.00 0.00 51 T 8.85 4.91 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 1.21 0.00 0.00 52 G 7.68 4.34 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 0.00 53 V 8.42 4.88 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 1.06 0.00 0.00 1.00 0.00 0.00 54 D 8.95 4.56 0.00 2.80 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 55 P 0.00 4.70 0.00 2.18 2.09 0.00 3.74 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 56 G 8.20 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 57 S 7.99 4.70 0.00 4.08 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 58 E 8.07 4.01 0.00 2.16 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 2.32 2.45 0.00 59 A 7.56 4.02 1.35 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 0.00 0.00 0.00 60 E 8.11 3.95 0.00 2.05 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 0.00 2.30 2.37 0.00 61 G 7.53 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 62 S 7.55 4.30 0.00 3.95 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 63 G 6.87 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 0.00 0.00 0.00 64 L 8.05 4.65 0.00 1.69 1.58 0.93 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 65 K 8.08 4.71 0.00 1.75 1.67 0.00 1.67 0.00 0.00 1.82 0.00 0.00 2.90 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.42 1.43 7.81 66 V 8.05 4.00 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 0.64 0.00 0.00 0.94 0.00 0.00 67 G 9.27 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 68 D 7.56 4.54 0.00 2.97 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 69 Q 8.45 4.52 0.00 1.98 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.81 6.87 0.00 0.00 0.00 0.00 0.00 1.16 1.67 0.00 70 I 8.58 3.87 1.91 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 1.15 0.61 0.63 0.00 0.00 71 L 8.91 4.31 0.00 1.69 1.66 0.89 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 72 E 7.73 5.29 0.00 2.08 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 2.20 2.22 0.00 73 V 7.97 4.58 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 1.07 0.00 0.00 -0.22 0.00 0.00 74 N 9.63 4.22 0.00 2.94 2.91 0.00 0.00 7.09 7.79 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 75 G 8.43 3.87 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 0.00 0.00 0.00 76 R 7.65 4.57 0.00 1.96 2.16 0.00 3.17 0.00 0.00 3.18 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.60 0.00 77 S 8.85 4.45 0.00 3.92 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 78 F 8.80 4.64 0.00 3.01 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 79 L 8.05 4.43 0.00 1.65 1.73 0.93 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 80 N 7.81 5.03 0.00 2.75 2.83 0.00 0.00 5.86 7.78 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 81 I 7.50 4.08 1.34 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 0.76 0.98 0.45 0.00 0.00 82 L 8.09 4.39 0.00 1.67 1.71 0.94 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 83 H 8.65 4.26 0.00 3.40 3.41 0.00 5.87 0.00 0.00 0.00 0.00 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 D 8.07 4.36 0.00 2.91 2.93 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 85 E 8.10 3.93 0.00 2.00 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 2.31 2.33 0.00 86 A 8.07 4.18 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 87 V 7.59 3.77 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 0.86 0.00 0.00 0.84 0.00 0.00 88 R 7.92 4.21 0.00 2.08 1.95 0.00 3.18 0.00 0.00 3.09 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.63 0.00 89 L 8.36 4.04 0.00 1.85 1.83 0.97 0.84 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 90 L 7.60 4.26 0.00 1.86 1.74 1.03 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 91 K 7.63 4.65 0.00 1.68 1.83 0.00 1.67 0.00 0.00 1.64 0.00 0.00 2.99 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.63 1.58 7.81 92 S 7.84 4.42 0.00 4.02 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 93 S 7.45 4.37 0.00 3.97 3.77 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 94 R 8.38 4.01 0.00 1.87 1.92 0.00 3.23 0.00 0.00 3.27 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.69 0.00 95 H 8.12 4.92 0.00 3.16 3.22 0.00 5.73 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 L 8.61 4.33 0.00 1.66 1.56 0.95 0.76 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 97 I 7.87 4.62 1.81 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 1.26 1.00 0.86 0.00 0.00 98 L 8.59 4.07 0.00 1.59 1.52 0.84 0.52 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 99 T 8.46 5.26 4.29 0.00 0.00 0.00 0.00 0.00 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 0.00 100 V 8.16 5.02 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 0.95 0.00 0.00 0.98 0.00 0.00 101 K 8.21 4.94 0.00 1.80 1.74 0.00 1.56 0.00 0.00 1.68 0.00 0.00 2.96 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.27 1.42 7.81 102 D 8.40 4.46 0.00 2.57 2.70 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 0.00 103 V 8.19 3.98 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 0.91 0.00 0.00 1.02 0.00 0.00 104 G 7.64 3.72 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 0.00 0.00 0.00 105 R 8.05 4.42 0.00 1.76 1.92 0.00 3.35 0.00 0.00 3.23 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.56 0.00 106 L 7.58 4.75 0.00 1.63 1.59 0.93 1.04 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 0.00 107 P 0.00 4.24 0.00 2.07 2.14 0.00 3.87 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.98 0.00 108 H 7.44 4.53 0.00 3.24 3.31 0.00 5.49 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 A 8.43 4.83 1.24 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 0.00 0.00 0.00 110 R 8.42 4.83 0.00 1.75 1.92 0.00 3.38 0.00 0.00 3.33 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.58 0.00 111 T 7.67 4.69 4.38 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 1.36 0.00 0.00 112 T 7.68 4.57 4.26 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 1.23 0.00 0.00 113 V 7.09 4.02 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 0.53 0.00 0.00 0.92 0.00 0.00 114 D 8.11 4.44 0.00 2.61 2.60 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.97 4.16 0.00 2.12 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 2.27 2.30 0.00 116 T 7.88 3.95 4.26 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 1.21 0.00 0.00 117 K 8.38 3.71 0.00 2.01 1.97 0.00 2.01 0.00 0.00 1.75 0.00 0.00 2.99 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.48 1.54 7.81 118 W 8.28 3.20 0.00 3.43 3.31 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 0.00 119 I 8.12 4.15 1.89 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 1.31 0.54 0.91 0.00 0.00 120 A 8.26 4.60 1.25 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 0.00 0.00 121 S 8.50 4.65 0.00 3.85 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 0.00 122 S 8.61 3.65 0.00 4.03 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 0.00 123 S 7.97 4.74 0.00 3.79 3.72 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 0.00 124 G 7.89 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 0.00 0.00 0.00 0.00 125 P 0.00 4.38 0.00 2.05 2.02 0.00 3.70 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 2.03 2.13 0.00 126 S 8.32 4.64 0.00 3.81 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 0.00 127 S 8.18 4.55 0.00 3.83 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 0.00 128 G 7.79 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 0.00 0.00 0.00