NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.3572 8.2649 123.5836 52.3764 19.0438 176.2798 2 T 4.1944 8.3772 119.2316 66.2129 69.7009 173.3120 3 K 5.3169 8.4319 120.6745 54.7916 36.8377 174.6533 4 A 5.1810 8.8252 123.0248 51.3851 23.5205 175.0612 5 V 5.0048 8.7335 117.1115 61.4630 35.4749 173.1284 6 C 4.8642 8.8042 121.1253 58.4476 35.5171 172.5452 7 V 4.6148 8.4599 126.4025 61.6358 33.0016 174.2499 8 L 4.7853 8.7970 128.8091 53.9881 43.2152 176.1162 9 K 4.8745 8.7178 121.8242 55.4545 37.3819 175.0798 10 G 4.0692 8.0699 107.2929 46.1305 0.0000 173.2753 11 D 4.5281 9.0192 119.3747 57.0855 40.9570 177.8337 12 G 3.8668 7.7353 106.8352 44.7466 0.0000 170.9796 13 P 4.5583 0.0000 0.0000 62.8200 31.7908 176.1105 14 V 4.1375 7.5349 120.0441 63.2912 32.2541 174.9422 15 Q 4.6663 8.3134 122.8249 56.0713 32.3180 173.0887 16 G 4.1526 7.5087 106.1947 46.4355 0.0000 171.7276 17 I 5.1435 7.8131 119.1889 59.4810 41.2573 175.2071 18 I 4.7288 8.6807 126.3319 59.5823 40.9791 174.4891 19 N 5.3000 8.5933 123.7532 51.6266 41.6880 173.7480 20 F 5.4083 9.1697 118.3273 56.1335 43.9580 173.8709 21 E 5.1246 9.3641 122.2294 55.2748 33.2882 173.6399 22 Q 5.0403 9.5146 128.8490 53.9296 29.3235 174.7642 23 K 4.1451 8.8318 124.8821 58.1274 32.8247 177.5325 24 E 4.6528 7.8984 117.8748 53.8026 31.6168 175.1816 25 S 4.1815 8.8145 117.3634 60.4203 62.5977 173.2764 26 N 4.2335 8.2355 119.4577 54.0365 37.1547 175.4825 27 G 3.9451 8.0123 109.1510 44.6084 0.0000 171.5947 28 P 4.8176 0.0000 0.0000 62.0620 33.1915 175.7929 29 V 4.6222 8.5368 118.6415 61.0186 34.4770 174.4756 30 K 4.7267 9.0935 128.9222 56.2608 33.5059 176.3335 31 V 4.8036 9.0897 125.6483 60.7986 33.9215 174.2844 32 W 5.4486 8.3905 124.0034 54.8830 32.0392 175.1133 33 G 3.7911 7.5326 106.2045 46.4021 0.0000 171.0294 34 S 5.0273 7.6877 114.5318 57.2604 66.5070 174.5580 35 I 5.0436 8.7143 127.2149 59.3441 40.8223 174.5415 36 K 4.8747 9.2168 123.8214 55.4823 36.6137 175.9123 37 G 3.5925 8.8905 105.9427 46.6979 0.0000 173.3450 38 L 4.7381 7.5831 118.3485 52.1281 44.3557 176.5117 39 T 4.1179 8.3253 111.8522 61.0617 69.4853 173.8730 40 E 4.3438 8.1371 124.8496 57.2632 30.7337 176.2655 41 G 3.8990 8.5309 108.9465 44.0069 0.0000 172.4047 42 L 4.9133 8.1346 119.6532 54.6924 43.2132 176.4197 43 H 5.0780 9.0864 118.4970 53.9899 33.4644 173.5865 44 G 4.0457 9.1441 110.6107 46.8443 0.0000 172.8316 45 F 5.2199 8.5155 124.0782 57.7578 42.3022 172.7077 46 H 5.0827 8.8901 122.9138 54.1119 33.9485 172.7073 47 V 4.4171 8.5216 121.0266 62.6001 32.6496 175.2909 48 H 5.0320 9.1507 125.4055 54.1076 30.5876 174.8727 49 E 3.9117 8.7528 121.0574 58.6624 29.3969 177.1580 50 F 5.2342 8.1535 117.5280 55.6744 41.7412 175.5348 51 G 3.8327 8.5139 111.4687 45.2289 0.0000 173.2319 52 D 4.8609 8.0532 118.5739 52.5219 42.7104 175.1615 53 N 5.3840 8.4056 122.4059 52.1963 40.1278 175.6083 54 T 3.9323 8.2136 116.5413 66.5570 68.8297 175.1038 55 A 4.6421 8.9393 125.2305 51.1214 19.1227 176.3421 56 G 3.8361 7.6556 115.8479 46.4275 0.0000 174.6308 57 C 4.3582 8.5883 116.0752 59.5617 38.2545 175.6046 58 T 3.7550 7.9443 117.1579 66.5336 67.7532 176.3888 59 S 4.1921 7.4894 116.5742 61.3249 63.0295 175.9679 60 A 4.3724 8.0020 123.8713 54.9043 18.1357 178.3192 61 G 4.0836 8.0279 103.9571 43.9304 0.0000 170.5281 62 P 4.6909 0.0000 0.0000 62.1351 33.4554 175.2793 63 H 4.2192 8.6292 116.5624 55.7150 29.5612 175.5720 64 F 4.2878 8.8745 124.7218 58.6890 40.1080 174.2105 65 N 5.1286 8.1605 125.5763 51.5264 39.0029 172.5203 66 P 4.1665 0.0000 0.0000 64.3246 31.1771 178.0535 67 L 4.3622 7.7056 117.7459 53.7041 41.6971 176.4522 68 S 3.5952 7.4052 113.5549 59.5295 60.8492 172.7889 69 R 4.3593 7.3173 115.7645 55.1826 31.7195 176.3714 70 K 4.4683 8.2047 118.2035 55.7865 33.6435 176.7045 71 H 3.9806 8.5188 123.0339 56.9897 30.5847 174.6610 72 G 4.0295 7.2344 109.1371 46.2605 0.0000 172.5053 73 G 4.0914 8.6273 109.2037 43.7409 0.0000 173.3777 74 P 4.4014 0.0000 0.0000 65.2513 31.4955 177.6894 75 K 4.2536 7.8646 115.6340 56.9026 32.5871 176.7160 76 D 4.5440 7.5008 118.7697 54.3115 41.4512 176.1421 77 E 4.0138 8.6186 121.8405 58.7338 29.8371 176.7995 78 E 4.1303 7.9247 124.7650 55.9981 28.6964 175.2008 79 R 4.7895 7.6856 120.3097 54.8349 32.6045 174.5642 80 H 4.4827 9.3393 116.8000 55.2139 29.3877 176.9972 81 V 3.4177 8.4086 123.2900 66.0586 31.4092 176.8961 82 G 3.9456 8.2102 106.6360 45.6287 0.0000 172.8905 83 D 5.0649 8.1024 121.1041 53.5025 39.7397 175.6552 84 L 4.6665 8.3800 122.6275 53.8519 43.1650 178.5181 85 G 3.8974 7.8316 111.7859 47.1483 0.0000 175.9998 86 N 5.6674 8.8629 120.3039 51.1863 42.1577 172.2775 87 V 4.5095 8.6862 112.6383 59.9083 36.4776 174.8240 88 T 5.0908 8.2601 117.6612 61.8332 71.7727 172.8404 89 A 4.9601 9.0501 128.6211 50.5012 21.1114 176.3738 90 D 4.5051 8.9688 122.9846 52.6216 42.2018 178.4461 91 K 3.9314 8.9076 119.2710 60.2906 31.6922 178.9110 92 D 4.5045 8.1245 115.3141 54.6232 40.9045 177.7381 93 G 4.2093 7.8309 107.2492 44.8115 0.0000 173.0792 94 V 4.5166 7.2310 120.0960 61.7058 33.2585 174.5234 95 A 5.2913 9.0415 129.7316 49.6926 21.2735 175.2627 96 D 5.0057 8.6435 123.6015 52.8807 41.0784 176.2197 97 V 3.7250 8.2635 124.0856 62.8140 33.0364 175.0901 98 S 5.0064 8.3047 119.9357 57.8973 65.0199 173.8572 99 I 4.7480 8.8807 127.8135 59.9861 41.7479 173.8616 100 E 5.2058 8.7252 125.2572 55.0784 31.9243 174.8385 101 D 4.8118 8.4612 120.4353 53.1907 45.1846 175.5196 102 S 4.7002 8.6077 117.4100 58.0016 64.0955 175.0338 103 V 3.8074 8.2389 122.7143 65.9173 31.4374 176.8305 104 I 4.2607 7.7769 111.0928 60.7721 38.7652 174.4833 105 S 4.6922 8.1962 113.7139 57.3357 65.0981 174.3832 106 L 4.4213 9.3505 124.4015 55.0537 42.0282 176.2010 107 S 4.6372 7.6099 111.7892 56.8806 66.2793 173.5808 108 G 3.8238 8.4530 108.5007 45.1229 0.0000 173.5639 109 D 4.9109 8.5506 117.8866 53.7957 39.6358 176.2363 110 H 4.9655 8.0447 115.3189 55.8774 28.9800 174.4276 111 C 4.6228 8.0978 120.7387 59.4185 31.7553 173.4387 112 I 3.9975 8.1508 118.5719 60.3031 37.9860 175.2154 113 I 3.7122 7.2902 123.1374 62.9778 37.3120 176.1251 114 G 3.8925 9.4447 113.9203 44.9762 0.0000 172.5733 115 R 4.6461 7.3977 117.6209 54.2253 33.8551 175.1980 116 T 4.5813 7.9942 117.5236 63.1852 70.2304 173.6995 117 L 4.8391 8.5732 128.0306 53.9316 44.2711 175.3882 118 V 4.9394 8.8142 125.1598 61.1089 35.3265 174.1012 119 V 5.1781 8.6122 126.5164 60.4300 34.0706 174.4014 120 H 5.2804 8.7025 119.7539 53.9125 31.5757 174.1559 121 E 4.1492 9.1656 120.8307 59.4356 29.7456 176.4185 122 K 4.8336 8.4942 117.7384 54.0307 35.7996 174.7383 123 A 4.5214 8.3369 121.8177 52.2136 19.5569 176.8589 124 D 4.7748 9.4411 123.0109 54.1672 41.7212 175.7541 125 D 4.7068 9.1696 124.4474 52.5689 39.7176 176.8214 126 L 3.5144 9.4601 117.6563 56.0618 39.5564 175.8407 127 G 3.9843 8.7962 107.5134 45.4879 0.0000 174.8556 128 K 4.4742 7.8050 118.2288 56.3522 32.2636 177.6343 129 G 3.7373 7.6547 108.4101 44.7929 0.0000 175.7147 130 G 3.9832 8.2116 107.1137 46.0659 0.0000 172.6211 131 N 5.0589 7.3125 114.9933 49.9618 40.5807 174.3423 132 E 4.0313 8.7759 118.7003 59.4549 29.9863 178.4737 133 E 3.9544 8.2550 118.5234 59.3800 29.3657 178.5342 134 S 4.1696 8.1447 113.2895 61.0383 62.3620 175.1247 135 T 4.4888 7.6567 110.6344 61.7044 68.4052 175.0171 136 K 4.2396 7.9515 118.7015 58.1746 34.3205 177.2886 137 T 3.9777 7.5903 105.5863 60.3804 69.5790 174.8714 138 G 3.9221 8.2123 110.2246 46.3782 0.0000 174.0590 139 N 4.3983 7.8783 113.5758 53.8579 36.8509 176.5095 140 A 4.2924 7.1263 123.1087 53.0502 18.8559 179.1844 141 G 3.7373 7.3408 102.6089 44.0063 0.0000 172.5912 142 S 4.3806 7.9791 113.5062 58.6901 64.7860 173.8932 143 R 4.6104 8.2572 119.2937 54.5263 29.1855 176.3961 144 L 4.2605 8.4636 124.1466 57.4230 42.3856 177.2929 145 A 4.9271 7.6364 118.0157 51.2754 22.9253 173.8319 146 C 5.1072 9.3386 113.1585 55.2803 46.7727 172.8560 147 G 4.7218 8.1478 103.9489 46.0114 0.0000 173.1987 148 V 4.2636 8.3955 121.4830 62.7576 32.7256 175.2912 149 I 4.2770 8.2788 128.0085 60.3246 38.4392 175.2304 150 G 4.4400 9.0182 113.8510 43.9062 0.0000 171.5539 151 I 4.3267 8.2823 120.9149 60.9895 37.5845 175.8660 152 A 4.7171 8.0992 128.7742 49.7767 21.6342 176.6210 153 Q 4.0673 8.4602 118.7808 56.4690 29.1946 176.0371 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 A 8.26 4.36 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 2 T 8.38 4.19 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 1.27 0.00 0.00 3 K 8.43 5.32 0.00 1.72 1.74 0.00 1.94 0.00 0.00 1.96 0.00 0.00 3.10 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.54 1.48 7.81 4 A 8.83 5.18 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 V 8.73 5.00 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 0.73 0.00 0.00 0.89 0.00 0.00 6 C 8.80 4.86 0.00 3.05 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 7 V 8.46 4.61 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 0.98 0.00 0.00 0.92 0.00 0.00 8 L 8.80 4.79 0.00 1.76 1.59 1.04 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 9 K 8.72 4.87 0.00 1.62 1.63 0.00 1.71 0.00 0.00 1.64 0.00 0.00 2.81 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.34 1.52 7.81 10 G 8.07 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 11 D 9.02 4.53 0.00 2.68 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 12 G 7.74 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 13 P 0.00 4.56 0.00 2.18 2.16 0.00 3.77 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.94 0.00 14 V 7.53 4.14 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 0.84 0.00 0.00 0.99 0.00 0.00 15 Q 8.31 4.67 0.00 2.24 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.44 0.00 0.00 0.00 0.00 0.00 2.12 2.19 0.00 16 G 7.51 4.15 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 0.00 0.00 0.00 17 I 7.81 5.14 1.79 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 1.20 1.28 0.84 0.00 0.00 18 I 8.68 4.73 1.93 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 1.27 1.68 0.61 0.00 0.00 19 N 8.59 5.30 0.00 1.44 1.98 0.00 0.00 6.48 8.15 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 20 F 9.17 5.41 0.00 2.88 2.96 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 21 E 9.36 5.12 0.00 2.38 1.96 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 2.31 2.39 0.00 22 Q 9.51 5.04 0.00 2.10 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.80 6.74 0.00 0.00 0.00 0.00 0.00 2.43 2.55 0.00 23 K 8.83 4.15 0.00 1.81 1.88 0.00 1.76 0.00 0.00 1.71 0.00 0.00 3.07 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.47 1.50 7.81 24 E 7.90 4.65 0.00 2.02 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 2.31 2.27 0.00 25 S 8.81 4.18 0.00 3.84 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 26 N 8.24 4.23 0.00 2.96 2.88 0.00 0.00 7.01 7.53 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 27 G 8.01 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 28 P 0.00 4.82 0.00 2.12 2.11 0.00 3.74 0.00 0.00 3.60 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 29 V 8.54 4.62 2.32 0.00 0.00 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 1.09 0.00 0.00 30 K 9.09 4.73 0.00 1.86 1.83 0.00 1.56 0.00 0.00 1.46 0.00 0.00 2.92 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.44 1.40 7.81 31 V 9.09 4.80 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 0.62 0.00 0.00 0.91 0.00 0.00 32 W 8.39 5.45 0.00 3.63 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 33 G 7.53 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 34 S 7.69 5.03 0.00 3.90 3.63 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 35 I 8.71 5.04 1.82 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 1.28 0.47 0.95 0.00 0.00 36 K 9.22 4.87 0.00 1.70 1.85 0.00 1.33 0.00 0.00 1.64 0.00 0.00 2.86 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.36 1.34 7.81 37 G 8.89 3.59 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 38 L 7.58 4.74 0.00 1.82 1.41 0.83 0.35 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 39 T 8.33 4.12 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 1.24 0.00 0.00 40 E 8.14 4.34 0.00 2.00 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 2.31 2.53 0.00 41 G 8.53 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 42 L 8.13 4.91 0.00 1.49 1.59 0.91 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 43 H 9.09 5.08 0.00 3.03 3.28 0.00 5.62 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 G 9.14 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 45 F 8.52 5.22 0.00 3.01 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 46 H 8.89 5.08 0.00 3.08 3.06 0.00 5.85 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 V 8.52 4.42 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 0.82 0.00 0.00 0.93 0.00 0.00 48 H 9.15 5.03 0.00 2.94 3.26 0.00 5.73 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 8.75 3.91 0.00 1.60 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 1.67 2.26 0.00 50 F 8.15 5.23 0.00 3.21 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 51 G 8.51 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 0.00 0.00 0.00 52 D 8.05 4.86 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 53 N 8.41 5.38 0.00 2.68 2.73 0.00 0.00 7.28 7.54 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 54 T 8.21 3.93 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 55 A 8.94 4.64 1.20 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 56 G 7.66 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 57 C 8.59 4.36 0.00 2.95 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 58 T 7.94 3.76 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 59 S 7.49 4.19 0.00 4.08 4.12 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 60 A 8.00 4.37 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 61 G 8.03 4.08 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 0.00 0.00 0.00 62 P 0.00 4.69 0.00 2.07 2.20 0.00 3.46 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.94 0.00 63 H 8.63 4.22 0.00 2.93 3.26 0.00 5.72 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 F 8.87 4.29 0.00 2.90 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 65 N 8.16 5.13 0.00 2.47 2.38 0.00 0.00 6.92 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 66 P 0.00 4.17 0.00 2.04 1.84 0.00 3.29 0.00 0.00 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.13 0.00 67 L 7.71 4.36 0.00 1.65 1.65 0.84 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 68 S 7.41 3.60 0.00 3.89 3.89 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 69 R 7.32 4.36 0.00 1.88 1.87 0.00 3.56 0.00 0.00 3.20 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.81 0.00 70 K 8.20 4.47 0.00 1.59 1.69 0.00 1.68 0.00 0.00 1.57 0.00 0.00 2.75 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.42 1.51 7.81 71 H 8.52 3.98 0.00 3.04 3.07 0.00 5.98 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 G 7.23 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 73 G 8.63 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 0.00 0.00 0.00 74 P 0.00 4.40 0.00 2.23 2.27 0.00 3.78 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 2.02 2.03 0.00 75 K 7.86 4.25 0.00 1.77 1.90 0.00 1.76 0.00 0.00 1.72 0.00 0.00 2.97 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.43 1.47 7.81 76 D 7.50 4.54 0.00 2.97 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 77 E 8.62 4.01 0.00 1.92 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 2.25 2.28 0.00 78 E 7.92 4.13 0.00 2.06 1.83 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 2.35 2.47 0.00 79 R 7.69 4.79 0.00 1.84 1.78 0.00 2.94 0.00 0.00 3.88 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.58 0.00 80 H 9.34 4.48 0.00 3.52 3.38 0.00 5.66 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 V 8.41 3.42 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 0.74 0.00 0.00 0.52 0.00 0.00 82 G 8.21 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 83 D 8.10 5.06 0.00 2.75 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 84 L 8.38 4.67 0.00 2.05 1.90 0.99 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 85 G 7.83 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 86 N 8.86 5.67 0.00 2.59 2.71 0.00 0.00 6.54 7.68 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 87 V 8.69 4.51 1.79 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 -0.05 0.00 0.00 0.76 0.00 0.00 88 T 8.26 5.09 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 1.20 0.00 0.00 89 A 9.05 4.96 1.29 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 0.00 0.00 0.00 90 D 8.97 4.51 0.00 3.01 2.82 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 91 K 8.91 3.93 0.00 1.78 1.88 0.00 1.68 0.00 0.00 1.82 0.00 0.00 2.97 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.69 1.43 7.81 92 D 8.12 4.50 0.00 2.92 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 93 G 7.83 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 0.00 0.00 0.00 0.00 94 V 7.23 4.52 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 0.75 0.00 0.00 0.92 0.00 0.00 95 A 9.04 5.29 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 96 D 8.64 5.01 0.00 2.56 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 97 V 8.26 3.72 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 0.76 0.00 0.00 0.57 0.00 0.00 98 S 8.30 5.01 0.00 3.93 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 99 I 8.88 4.75 1.94 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 1.24 0.44 0.99 0.00 0.00 100 E 8.73 5.21 0.00 1.85 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 2.24 2.28 0.00 101 D 8.46 4.81 0.00 2.87 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 0.00 102 S 8.61 4.70 0.00 3.99 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 0.00 103 V 8.24 3.81 2.28 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 0.82 0.00 0.00 0.96 0.00 0.00 104 I 7.78 4.26 2.00 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.85 1.07 0.00 0.00 105 S 8.20 4.69 0.00 3.89 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 0.00 106 L 9.35 4.42 0.00 1.85 1.69 1.03 0.74 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 0.00 107 S 7.61 4.64 0.00 3.93 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 0.00 108 G 8.45 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 0.00 0.00 0.00 109 D 8.55 4.91 0.00 2.87 2.82 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 0.00 110 H 8.04 4.97 0.00 3.19 3.44 0.00 5.73 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 C 8.10 4.62 0.00 2.94 2.90 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 0.00 112 I 8.15 4.00 1.70 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.29 1.07 0.00 0.00 113 I 7.29 3.71 1.78 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 1.19 0.39 0.83 0.00 0.00 114 G 9.44 3.89 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 0.00 0.00 0.00 115 R 7.40 4.65 0.00 1.58 1.76 0.00 2.21 0.00 0.00 2.25 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.35 0.00 116 T 7.99 4.58 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 0.00 117 L 8.57 4.84 0.00 1.76 1.49 0.52 0.72 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 0.00 118 V 8.81 4.94 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 0.75 0.00 0.00 0.72 0.00 0.00 119 V 8.61 5.18 2.31 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 0.80 0.00 0.00 1.01 0.00 0.00 120 H 8.70 5.28 0.00 3.22 3.52 0.00 5.66 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 E 9.17 4.15 0.00 2.15 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 2.36 2.34 0.00 122 K 8.49 4.83 0.00 1.67 1.70 0.00 1.73 0.00 0.00 1.66 0.00 0.00 2.86 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.35 1.38 7.81 123 A 8.34 4.52 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 0.00 124 D 9.44 4.77 0.00 2.78 2.78 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 0.00 125 D 9.17 4.71 0.00 2.94 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 0.00 126 L 9.46 3.51 0.00 1.81 1.78 0.93 1.09 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 0.00 127 G 8.80 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 0.00 0.00 0.00 128 K 7.81 4.47 0.00 1.77 1.82 0.00 1.70 0.00 0.00 1.70 0.00 0.00 2.80 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.40 1.51 7.81 129 G 7.65 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 0.00 0.00 0.00 130 G 8.21 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 0.00 0.00 0.00 131 N 7.31 5.06 0.00 2.93 2.79 0.00 0.00 6.76 7.54 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 0.00 132 E 8.78 4.03 0.00 2.06 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 0.00 2.37 2.36 0.00 133 E 8.25 3.95 0.00 2.11 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 2.38 2.47 0.00 134 S 8.14 4.17 0.00 4.15 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 0.00 135 T 7.66 4.49 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 1.20 0.00 0.00 136 K 7.95 4.24 0.00 1.77 1.78 0.00 1.81 0.00 0.00 1.74 0.00 0.00 3.03 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.34 1.43 7.81 137 T 7.59 3.98 4.22 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 1.27 0.00 0.00 138 G 8.21 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 0.00 0.00 0.00 139 N 7.88 4.40 0.00 3.07 2.90 0.00 0.00 6.93 7.21 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 0.00 140 A 7.13 4.29 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 0.00 141 G 7.34 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 0.00 0.00 0.00 142 S 7.98 4.38 0.00 4.05 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 0.00 143 R 8.26 4.61 0.00 1.65 1.82 0.00 3.19 0.00 0.00 3.13 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.62 0.00 144 L 8.46 4.26 0.00 1.67 1.73 0.99 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 145 A 7.64 4.93 1.16 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 0.00 0.00 146 C 9.34 5.11 0.00 3.02 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 0.00 147 G 8.15 4.72 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 0.00 148 V 8.40 4.26 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 0.75 0.00 0.00 0.90 0.00 0.00 149 I 8.28 4.28 1.85 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.38 0.44 0.00 0.00 150 G 9.02 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 0.00 0.00 0.00 0.00 151 I 8.28 4.33 1.85 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 1.24 0.53 0.90 0.00 0.00 152 A 8.10 4.72 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 0.00 153 Q 8.46 4.07 0.00 2.04 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.77 6.60 0.00 0.00 0.00 0.00 0.00 2.36 2.37 0.00