NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 26 K 4.3241 8.3149 120.1369 56.1740 33.5691 175.7905 27 R 3.8065 8.6733 121.2884 58.3304 30.1565 176.2417 28 L 4.5198 7.9881 115.6369 54.7185 43.1534 175.8186 29 K 4.4742 7.9068 117.3661 56.5908 33.4365 175.7581 30 A 4.5005 7.7490 120.6485 51.1983 20.5881 177.2214 31 C 4.3734 7.9467 118.3872 57.8525 38.2392 173.1208 32 R 4.6463 8.6899 121.5649 54.9130 33.1501 173.8000 33 K 4.5466 8.4802 120.8874 56.5378 33.1762 175.4944 34 H 4.8345 8.8118 123.4141 53.6181 32.5025 172.8868 35 E 4.5856 8.5238 121.0806 56.4517 30.5374 176.4730 36 L 4.4217 8.6791 125.6383 54.4759 45.9392 173.0187 37 Y 4.8094 8.7004 127.9449 55.9437 41.0948 174.0222 38 V 4.1286 7.3853 126.2266 60.8510 34.5946 173.8736 39 S 4.4943 8.1227 122.1580 56.8008 63.7134 174.9460 40 F 4.2069 8.4868 125.9536 60.5520 38.3008 177.7085 41 Q 4.1585 8.1076 119.0720 59.1157 28.6447 177.4429 42 D 4.6009 7.9385 118.0830 55.8124 41.0242 177.4406 43 L 4.4583 7.5002 118.1344 54.3284 42.4607 177.0181 44 G 4.4183 7.6447 106.1155 45.7733 0.0000 173.6997 45 W 4.9126 9.0340 117.9193 56.3042 29.4422 178.1924 46 Q 4.2560 8.6550 122.3797 59.0043 28.2558 177.3030 47 D 5.0607 8.2903 113.6184 53.7325 42.9660 176.4668 48 W 4.7768 8.4277 115.3031 56.5711 29.2752 175.5218 49 I 4.1887 7.5805 118.8365 60.0920 38.5482 174.8724 50 I 4.1501 8.3839 128.5217 62.3641 38.2141 176.1060 51 A 4.4372 7.1287 119.2575 50.8952 21.2816 174.4173 52 P 4.8702 0.0000 0.0000 62.3896 33.1478 175.9961 53 K 4.5872 8.5115 115.4406 57.0005 32.6436 176.0668 54 G 3.6098 7.7620 104.1447 46.8295 0.0000 171.7416 55 Y 4.7870 6.8771 116.0593 55.8403 41.6447 174.3470 56 A 4.6403 8.6552 122.9630 51.0149 17.6644 177.0907 57 A 4.1019 7.8216 124.7763 54.0936 18.9888 179.0829 58 N 4.7927 8.2892 113.0473 53.5128 38.2134 172.4289 59 Y 4.7107 7.4508 113.3690 57.3562 41.4810 172.2097 60 C 5.3085 8.9074 117.9384 56.0270 39.3895 172.5669 61 D 4.5901 8.6003 120.0276 54.0711 44.8396 173.6980 62 G 4.4402 8.8897 108.4552 43.3983 0.0000 173.8849 63 E 4.0970 8.4983 120.8541 56.0769 30.1263 175.7972 64 C 4.8337 8.1981 119.6955 55.6845 41.5084 173.3786 65 S 4.3228 7.9611 117.4190 57.0481 64.8677 175.0073 66 F 4.4614 8.2626 119.8950 57.0168 39.1381 173.7804 67 P 4.7794 0.0000 0.0000 62.6207 32.1031 175.6509 68 L 4.8443 8.5233 119.6584 52.9923 45.5710 175.7536 69 N 4.8415 8.4371 118.2259 51.7158 40.8380 175.0232 70 A 4.4226 8.5925 128.7562 54.4999 18.7239 177.6230 71 H 4.6295 8.5641 111.7393 57.0093 29.7485 175.4356 72 M 5.0048 7.5784 119.7651 54.1522 33.8060 175.4530 73 N 4.1273 8.8792 116.9346 56.6303 39.1499 174.3953 74 A 4.9506 8.1286 120.8096 50.1598 21.1654 175.3596 75 T 4.9192 7.8208 108.7254 59.5438 73.0236 174.7772 76 N 4.3251 8.5702 118.6858 56.7932 38.4916 177.0307 77 H 4.0225 8.2774 118.8681 59.3002 29.9513 177.0058 78 A 4.0382 8.0219 122.1004 54.9780 18.2440 179.8141 79 I 3.5748 7.5240 118.6172 64.5859 37.2668 178.7311 80 V 3.6313 7.7718 119.0821 66.0761 31.3191 177.7770 81 Q 3.9447 8.3684 119.6601 59.4575 28.8549 178.2975 82 T 3.8020 7.9968 116.8108 66.6774 68.5749 176.5860 83 L 4.1627 7.9116 120.4119 57.8578 41.6560 179.7696 84 V 3.7575 7.9072 118.3101 66.0289 31.1457 177.6225 85 H 4.2872 8.4596 118.2680 59.2794 29.5368 177.2930 86 L 3.9787 7.8805 119.4894 57.4874 41.4359 178.5821 87 M 4.3923 7.3915 116.0882 56.0167 34.0380 176.4548 88 N 5.0643 8.0819 116.0101 50.9195 39.6757 173.4803 89 P 4.2523 0.0000 0.0000 64.0872 31.8571 177.6820 90 E 4.4494 8.0957 116.7602 56.7798 30.4387 175.6962 91 Y 4.4051 8.1620 119.3568 58.0113 40.0401 175.8392 92 V 4.3505 7.6572 118.2603 60.1221 33.8649 173.2225 93 P 4.6130 0.0000 0.0000 61.6119 32.4092 175.9003 94 K 4.0240 7.9418 118.0634 55.5672 32.4709 175.2018 95 P 4.7051 0.0000 0.0000 62.7290 32.3950 175.1479 96 C 4.9150 8.7931 115.4531 56.3307 33.1274 172.4041 97 C 4.9081 8.6848 120.4145 56.5084 39.7154 172.3212 98 A 4.8840 9.0999 127.4307 49.4076 23.0850 173.1011 99 P 4.9090 0.0000 0.0000 63.2749 31.4365 176.8161 100 T 4.6286 8.9183 113.0356 61.7127 71.0060 174.3956 101 K 4.6717 7.8390 123.5027 54.9525 35.7338 174.5661 102 L 5.4234 8.6298 126.1281 53.1285 45.3156 175.4577 103 N 5.1796 9.3888 119.4727 51.4161 42.2129 174.1314 104 A 5.1145 8.4686 123.0410 51.3880 20.7371 176.5355 105 I 4.7269 8.7040 111.4081 59.6019 41.2222 174.4383 106 S 5.3441 8.7577 119.9380 57.1032 65.2487 173.8741 107 V 4.7454 9.0243 116.1805 59.6290 36.0749 174.3987 108 L 5.0542 9.0757 124.3713 53.2969 43.6272 175.3259 109 Y 4.9080 8.4573 121.4962 55.5125 42.1016 173.6190 110 F 5.4876 8.9156 118.7358 56.1953 40.7107 175.8253 111 D 5.4038 8.3543 122.4469 51.7123 41.7760 176.2073 112 D 4.5231 8.7791 116.9964 55.7555 39.6400 176.3869 113 N 4.7237 8.9215 117.9321 52.8502 38.6890 175.4928 114 S 3.9912 7.8107 109.5275 58.9867 61.5147 170.7465 115 N 4.6479 7.9092 116.6510 52.8908 39.5486 174.2339 116 V 3.9316 8.2581 123.4620 61.7895 32.6831 174.9217 117 I 4.2751 8.0705 128.9849 59.1265 40.3042 174.1334 118 L 4.9102 8.1855 127.7983 53.1532 43.8448 175.2566 119 K 4.5154 9.1600 127.2997 54.3755 35.7559 174.2894 120 K 4.8278 8.4329 127.6876 54.9928 34.0130 174.6167 121 Y 4.7568 9.0135 125.5653 56.3004 39.9332 175.8142 122 R 4.3595 8.8535 123.4601 55.5653 31.3876 176.0259 123 N 4.1979 8.3115 116.0598 55.3197 35.9748 174.3878 124 M 4.6313 7.8868 114.9620 55.2060 35.3650 178.0971 125 V 4.6271 8.0619 119.4536 60.8051 34.2947 174.8072 126 V 4.1357 8.6360 128.9668 63.0538 31.3058 175.4896 127 R 4.5737 9.1230 127.1957 57.3819 31.8010 176.5379 128 A 4.8084 7.7368 118.0346 50.5956 22.9083 175.7826 129 C 5.4844 8.7036 115.8442 55.5511 42.4282 173.2763 130 G 4.2780 8.9941 106.9112 45.8437 0.0000 171.1651 131 C 5.1469 8.5892 117.4785 56.1707 42.1817 174.0549 132 H 4.6800 9.0294 120.9543 55.8974 29.1921 173.7620 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 26 K 8.31 4.32 0.00 1.77 1.82 0.00 1.73 0.00 0.00 1.71 0.00 0.00 2.95 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.35 1.48 7.81 27 R 8.67 3.81 0.00 1.88 1.98 0.00 3.17 0.00 0.00 3.19 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.68 0.00 28 L 7.99 4.52 0.00 1.54 1.60 0.89 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 29 K 7.91 4.47 0.00 1.87 1.76 0.00 1.77 0.00 0.00 1.83 0.00 0.00 2.85 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.43 1.43 7.81 30 A 7.75 4.50 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 31 C 7.95 4.37 0.00 3.02 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 32 R 8.69 4.65 0.00 1.87 1.97 0.00 2.74 0.00 0.00 3.06 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.50 0.00 33 K 8.48 4.55 0.00 1.76 1.69 0.00 1.83 0.00 0.00 1.91 0.00 0.00 2.67 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.32 1.42 7.81 34 H 8.81 4.83 0.00 1.68 2.57 0.00 5.68 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 E 8.52 4.59 0.00 1.82 1.86 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 2.24 2.21 0.00 36 L 8.68 4.42 0.00 1.98 1.68 0.97 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 37 Y 8.70 4.81 0.00 3.06 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 38 V 7.39 4.13 1.02 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 0.63 0.00 0.00 0.55 0.00 0.00 39 S 8.12 4.49 0.00 3.98 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 F 8.49 4.21 0.00 3.22 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.11 4.16 0.00 2.24 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.85 0.00 0.00 0.00 0.00 0.00 2.43 2.50 0.00 42 D 7.94 4.60 0.00 2.76 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 43 L 7.50 4.46 0.00 1.23 0.85 0.79 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 44 G 7.64 4.42 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 0.00 45 W 9.03 4.91 0.00 3.61 3.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 Q 8.65 4.26 0.00 2.15 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.01 6.82 0.00 0.00 0.00 0.00 0.00 2.45 2.53 0.00 47 D 8.29 5.06 0.00 2.75 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 48 W 8.43 4.78 0.00 3.63 3.24 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 49 I 7.58 4.19 2.13 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.89 1.21 0.00 0.00 50 I 8.38 4.15 1.81 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.54 0.84 0.00 0.00 51 A 7.13 4.44 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 52 P 0.00 4.87 0.00 2.50 2.24 0.00 3.96 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.16 0.00 53 K 8.51 4.59 0.00 1.93 2.02 0.00 1.87 0.00 0.00 2.01 0.00 0.00 2.99 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.59 1.47 7.81 54 G 7.76 3.61 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 55 Y 6.88 4.79 0.00 2.94 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 56 A 8.66 4.64 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 A 7.82 4.10 1.11 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 0.00 0.00 58 N 8.29 4.79 0.00 3.00 2.98 0.00 0.00 6.93 7.04 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 59 Y 7.45 4.71 0.00 2.99 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 60 C 8.91 5.31 0.00 2.92 3.05 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 61 D 8.60 4.59 0.00 2.96 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 62 G 8.89 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 63 E 8.50 4.10 0.00 2.03 1.86 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 2.31 2.27 0.00 64 C 8.20 4.83 0.00 2.99 2.92 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 65 S 7.96 4.32 0.00 3.88 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 66 F 8.26 4.46 0.00 3.12 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 67 P 0.00 4.78 0.00 2.25 2.12 0.00 3.76 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 2.03 2.03 0.00 68 L 8.52 4.84 0.00 1.74 1.59 0.48 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 69 N 8.44 4.84 0.00 2.70 2.66 0.00 0.00 6.90 8.51 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 70 A 8.59 4.42 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 71 H 8.56 4.63 0.00 3.29 3.39 0.00 5.80 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 M 7.58 5.00 0.00 1.98 1.94 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.54 0.00 73 N 8.88 4.13 0.00 2.75 2.90 0.00 0.00 6.66 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 74 A 8.13 4.95 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 75 T 7.82 4.92 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 1.22 0.00 0.00 76 N 8.57 4.33 0.00 2.80 2.93 0.00 0.00 6.43 8.16 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 77 H 8.28 4.02 0.00 3.21 3.31 0.00 5.67 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 A 8.02 4.04 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 79 I 7.52 3.57 2.09 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 1.54 1.12 1.14 0.00 0.00 80 V 7.77 3.63 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 0.98 0.00 0.00 0.94 0.00 0.00 81 Q 8.37 3.94 0.00 2.07 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.56 0.00 0.00 0.00 0.00 0.00 2.34 2.41 0.00 82 T 8.00 3.80 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 0.73 0.00 0.00 83 L 7.91 4.16 0.00 1.98 1.80 1.02 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 84 V 7.91 3.76 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 1.05 0.00 0.00 1.01 0.00 0.00 85 H 8.46 4.29 0.00 3.37 3.56 0.00 5.84 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 86 L 7.88 3.98 0.00 1.92 1.77 1.13 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 87 M 7.39 4.39 0.00 2.06 2.23 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 2.70 2.57 0.00 88 N 8.08 5.06 0.00 2.86 2.71 0.00 0.00 6.61 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 89 P 0.00 4.25 0.00 2.13 2.05 0.00 3.34 0.00 0.00 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.92 0.00 90 E 8.10 4.45 0.00 2.03 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.36 0.00 91 Y 8.16 4.41 0.00 2.84 3.01 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 0.00 0.00 0.00 92 V 7.66 4.35 2.17 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 0.96 0.00 0.00 1.06 0.00 0.00 93 P 0.00 4.61 0.00 2.18 2.02 0.00 3.81 0.00 0.00 3.63 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 94 K 7.94 4.02 0.00 1.66 1.66 0.00 1.67 0.00 0.00 1.79 0.00 0.00 2.95 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.13 1.16 7.81 95 P 0.00 4.71 0.00 1.88 2.06 0.00 3.51 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.04 0.00 96 C 8.79 4.92 0.00 2.93 2.97 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 97 C 8.68 4.91 0.00 3.11 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 98 A 9.10 4.88 1.21 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 99 P 0.00 4.91 0.00 1.98 2.03 0.00 3.67 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 2.06 2.12 0.00 100 T 8.92 4.63 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 1.26 0.00 0.00 101 K 7.84 4.67 0.00 1.82 1.65 0.00 1.67 0.00 0.00 1.83 0.00 0.00 2.86 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.42 1.49 7.81 102 L 8.63 5.42 0.00 1.65 1.54 0.96 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 103 N 9.39 5.18 0.00 2.63 2.71 0.00 0.00 6.75 7.15 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 0.00 104 A 8.47 5.11 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 0.00 105 I 8.70 4.73 1.85 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.87 0.91 0.00 0.00 106 S 8.76 5.34 0.00 3.77 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 0.00 107 V 9.02 4.75 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 0.88 0.00 0.00 1.08 0.00 0.00 108 L 9.08 5.05 0.00 1.65 1.42 0.80 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 109 Y 8.46 4.91 0.00 2.31 2.34 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 0.00 110 F 8.92 5.49 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 0.00 111 D 8.35 5.40 0.00 3.02 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 0.00 112 D 8.78 4.52 0.00 2.83 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 0.00 113 N 8.92 4.72 0.00 2.76 2.85 0.00 0.00 6.49 7.11 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 0.00 114 S 7.81 3.99 0.00 3.96 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 0.00 115 N 7.91 4.65 0.00 2.90 2.69 0.00 0.00 6.61 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 0.00 116 V 8.26 3.93 1.90 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 0.43 0.00 0.00 0.61 0.00 0.00 117 I 8.07 4.28 0.56 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 0.88 0.18 0.59 0.00 0.00 118 L 8.19 4.91 0.00 1.47 1.42 0.87 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 119 K 9.16 4.52 0.00 1.89 1.38 0.00 1.71 0.00 0.00 0.94 0.00 0.00 2.79 0.00 0.00 2.88 0.00 0.00 0.00 0.00 0.88 1.23 7.81 120 K 8.43 4.83 0.00 1.72 1.59 0.00 1.76 0.00 0.00 1.69 0.00 0.00 2.82 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.32 1.43 7.81 121 Y 9.01 4.76 0.00 2.98 2.80 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 0.00 122 R 8.85 4.36 0.00 1.75 1.90 0.00 3.38 0.00 0.00 3.24 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.69 0.00 123 N 8.31 4.20 0.00 2.86 2.87 0.00 0.00 6.81 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 M 7.89 4.63 0.00 1.71 2.05 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.73 0.00 125 V 8.06 4.63 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 0.95 0.00 0.00 1.09 0.00 0.00 126 V 8.64 4.14 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 0.81 0.00 0.00 0.98 0.00 0.00 127 R 9.12 4.57 0.00 1.85 1.96 0.00 3.37 0.00 0.00 3.25 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.85 0.00 128 A 7.74 4.81 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 0.00 129 C 8.70 5.48 0.00 2.80 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 0.00 130 G 8.99 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 0.00 131 C 8.59 5.15 0.00 2.85 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 0.00 132 H 9.03 4.68 0.00 3.04 3.08 0.00 5.66 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