NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 7 F 4.7315 8.3249 119.4109 57.8126 39.9374 174.6819 8 T 4.2817 7.7710 123.4427 59.0653 68.7688 170.0070 9 P 3.9485 0.0000 0.0000 58.7687 33.6572 175.2156 10 P 4.2517 0.0000 0.0000 66.0646 30.7574 178.0378 11 I 3.6308 7.9229 117.7329 64.3288 37.6419 177.7607 12 V 3.6920 8.0269 118.7329 65.8088 31.1037 178.2540 13 K 4.0264 7.8742 117.0207 59.4130 32.3391 179.0015 14 R 4.1833 8.9385 119.4759 59.5826 30.0248 179.2191 15 L 4.2893 8.4615 118.8852 57.8682 41.2937 179.6247 16 L 4.3337 8.5829 119.4520 57.7017 41.2834 179.4553 17 G 3.7948 7.9737 105.0769 47.0407 0.0000 174.4233 18 W 4.3304 8.0531 121.7148 54.9810 27.5272 175.1121 19 K 3.8443 7.9214 120.3752 55.9049 29.2581 175.5777 20 K 4.2609 7.7970 120.9896 57.9488 33.0579 177.7806 21 G 4.0176 8.7895 120.8803 47.8321 0.0000 173.9913 22 E 3.5137 8.1695 121.7201 60.7912 26.6110 177.6918 23 Q 2.8066 8.5281 122.3892 58.8644 29.9205 173.9231 24 N 4.0184 7.6799 113.5381 57.0688 36.5203 178.0786 25 G 3.4226 6.6986 105.0170 45.5113 0.0000 173.4323 26 Q 4.0038 7.7159 119.5619 58.3845 29.5189 178.2445 27 E 3.9793 8.8691 120.6973 59.2642 29.0533 178.3116 28 E 3.9338 8.1973 118.8031 59.3880 29.8694 178.7141 29 K 4.0591 7.9146 119.2868 58.6550 32.1735 178.7383 30 W 3.9452 8.0080 128.6608 60.7984 30.7224 177.5708 31 C 3.9920 8.2619 116.5842 62.8821 27.5161 176.0070 32 E 3.8796 7.8493 119.9526 59.1037 29.1685 178.9367 33 K 3.7873 7.6601 118.0313 59.4158 32.1630 179.1010 34 A 3.5590 7.6741 121.2535 54.9779 18.1024 179.9230 35 V 3.6817 7.8361 116.7445 65.9258 31.6405 178.2884 36 K 3.9172 8.4570 118.7239 59.5743 31.6030 179.2020 37 S 4.0273 8.2372 113.3911 61.2382 62.4246 175.9324 38 L 3.8937 7.7674 122.5365 58.0621 41.8085 178.9268 39 V 3.5167 8.1628 118.5958 65.9339 31.3227 177.5759 40 K 3.8182 7.9388 119.2342 59.8547 32.0324 178.8096 41 K 4.0133 7.7806 118.1350 59.3045 31.9043 179.3198 42 L 4.2366 7.8626 120.2303 56.2458 41.5379 179.4256 43 K 3.8945 8.1109 120.2085 59.5201 32.0240 179.0906 44 K 4.1554 7.7317 117.3560 58.3995 31.8212 177.8704 45 T 4.4284 7.2991 106.9502 60.2436 68.9832 174.3977 46 G 3.7453 7.5984 108.6920 47.4200 0.0000 175.0003 47 Q 4.4470 8.4633 116.5668 55.3699 29.5780 176.5218 48 L 3.8574 7.8781 120.2291 58.5632 41.5615 178.5465 49 D 4.3957 8.0640 117.4399 57.9947 40.9410 179.1762 50 E 3.9317 7.8823 118.6659 58.9961 29.3203 179.3055 51 L 3.6884 8.1967 120.8916 57.8737 42.1246 178.1904 52 E 3.6232 7.9814 118.8341 59.5422 29.3873 178.0464 53 K 3.5692 8.1900 119.2127 59.8008 32.0723 178.0965 54 A 3.7148 7.8438 120.2103 55.3244 18.1321 179.7821 55 I 3.3005 7.1611 117.2406 64.3846 37.1186 178.5190 56 T 2.4800 7.0759 109.8751 64.1423 68.8371 176.4523 57 T 3.9480 7.9474 111.2724 61.3317 69.1995 175.2068 58 Q 2.5200 7.1422 118.3852 55.8958 27.1228 172.6823 59 N 4.3580 7.3023 117.9667 52.8870 38.9245 176.2126 60 V 3.9232 8.3704 126.1631 65.9043 31.8245 176.2244 61 N 4.6849 8.3201 114.7374 53.7478 38.3060 174.9911 62 T 4.0862 7.4199 109.1898 61.0481 69.4507 174.1176 63 K 4.3934 8.3150 122.1843 55.5918 32.9716 176.8798 64 C 4.3329 8.5280 117.9815 60.0928 28.7102 173.7322 65 I 4.3996 8.2664 124.8871 60.2220 38.3160 174.3743 66 T 4.9259 8.6928 124.5477 62.1635 69.9304 174.8598 67 I 4.6670 8.6584 126.0698 58.5109 41.1875 173.3067 68 P 4.8005 0.0000 0.0000 63.1659 31.8463 175.8252 69 R 4.7228 8.4027 120.3317 55.0049 31.3050 176.4872 70 S 4.6514 8.5249 116.1316 56.7760 65.0548 174.8669 71 L 3.9200 8.6830 120.9042 58.0073 41.1422 178.5063 72 D 4.6271 8.1689 113.5748 52.8025 39.8414 177.3153 73 G 4.1536 8.1002 108.6207 45.8287 0.0000 174.1738 74 R 4.5472 7.7361 117.9565 55.5927 31.6970 175.6682 75 L 4.8022 8.9193 122.2114 53.4657 45.4751 174.6543 76 Q 5.1511 8.8129 126.9828 54.4657 31.0204 174.6958 77 V 4.2812 8.5145 125.5513 61.8595 35.1941 175.7339 78 S 3.6802 8.7492 123.3856 60.1332 61.6471 172.0025 79 H 4.9962 9.5217 113.0310 55.4359 29.7408 173.5021 80 R 4.7467 8.2122 119.5211 54.6600 32.4275 175.4628 81 K 5.1008 8.2009 119.8924 54.7874 35.7486 175.3892 82 G 3.9623 8.1387 108.7467 46.0203 0.0000 172.4525 83 L 4.3754 7.7022 120.2433 53.5148 42.3362 175.9078 84 P 4.2290 0.0000 0.0000 66.5044 31.3179 178.2088 85 H 4.1685 8.1867 112.8573 58.8347 28.2860 177.5221 86 V 3.3627 7.1066 120.2444 65.7166 31.2579 177.9337 87 I 3.5518 7.7516 119.7069 64.4446 36.9497 177.7997 88 Y 4.2309 7.7244 116.8512 60.2568 37.8365 177.7043 89 C 4.1399 8.1881 118.2197 62.5007 28.1593 175.8850 90 R 4.0871 8.0067 120.4223 59.0371 29.3993 178.2383 91 L 3.8463 7.3761 119.7151 56.6143 42.1455 177.7417 92 W 4.9512 7.8598 115.2702 57.0290 30.7051 175.2131 93 R 4.0254 8.2869 114.9053 54.7569 32.8434 175.8568 94 W 4.7791 7.0249 126.3446 54.2824 29.2442 175.0184 95 P 4.6260 0.0000 0.0000 64.2225 31.1013 177.8035 96 D 4.4135 8.2199 118.0927 56.2075 41.5319 175.9765 97 L 3.9430 7.6076 120.0174 56.0676 42.2863 174.9846 98 H 4.5538 8.5629 124.8252 57.0884 31.3609 174.4284 99 S 4.8255 7.4709 111.4227 56.0686 66.1142 174.1338 100 H 4.3077 8.7229 115.2701 57.7858 28.5808 176.1777 101 H 4.4420 7.6455 116.8801 58.5508 29.0257 176.7191 102 E 4.3156 8.2652 116.7325 56.7815 28.9503 175.6759 103 L 5.3382 7.0474 118.1664 53.1650 45.7673 176.0434 104 R 4.5537 8.4454 115.3537 55.5950 34.0337 174.1203 105 A 4.4304 9.1327 128.3879 52.3222 19.6738 176.0599 106 M 4.4154 8.4019 119.2911 53.5257 34.1360 175.5681 107 E 4.2097 9.0029 123.0169 58.7118 29.3362 176.8362 108 L 5.4347 7.9457 135.0000 56.9057 38.1922 173.5560 109 C 4.1565 7.7728 121.1896 58.5389 31.3093 172.9073 110 E 3.9504 8.9629 127.8200 58.9291 29.4509 178.4330 111 F 4.8276 8.1091 116.4366 56.4579 40.1523 175.3981 112 A 4.4994 8.1072 122.7687 52.3675 19.1488 179.2514 113 F 4.3130 9.3859 122.4977 61.6188 39.4336 177.5069 114 N 4.3647 8.4102 115.3149 55.6216 38.3897 175.2524 115 M 4.1575 7.5918 116.6053 55.4713 32.1166 178.0327 116 K 3.9368 6.9774 112.9229 57.5442 28.3222 173.4520 117 K 4.7619 7.5417 125.5070 53.7181 36.2248 176.7516 118 D 4.6393 8.7627 118.9080 56.9497 41.5021 176.5654 119 E 5.1509 8.0740 115.5897 54.2827 33.0893 175.6158 120 V 4.7654 8.9660 122.4125 61.2784 34.6138 173.9236 121 C 4.8930 9.0903 128.9881 58.8977 32.1100 173.4589 122 V 4.6582 8.7872 119.6456 61.1152 32.7755 175.3601 123 N 4.4053 8.3895 120.8327 52.8282 38.5340 173.8621 124 P 4.4303 0.0000 0.0000 65.3673 31.4776 176.4678 125 Y 4.4247 8.3222 116.2440 58.4103 37.8837 175.4214 126 H 5.0642 8.4587 115.7371 55.8045 30.1920 173.3874 127 Y 5.4274 8.1525 115.1690 56.3201 41.7768 174.7373 128 Q 5.0146 9.4855 120.2636 54.2287 32.6678 174.8452 129 R 4.3846 8.0036 121.9928 55.5679 30.8788 175.7855 130 V 4.4345 8.4447 117.4385 59.2980 35.8329 175.7363 131 E 4.2424 8.7256 121.8885 55.9090 29.4751 176.7337 132 T 3.7025 7.3352 119.1776 62.6652 68.9189 171.5695 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 7 F 8.32 4.73 0.00 3.03 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 8 T 7.77 4.28 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 1.30 0.00 0.00 9 P 0.00 3.95 0.00 2.27 2.19 0.00 3.84 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.03 0.00 10 P 0.00 4.25 0.00 2.31 2.40 0.00 3.74 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 2.10 2.06 0.00 11 I 7.92 3.63 1.88 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 1.51 1.45 0.93 0.00 0.00 12 V 8.03 3.69 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 1.09 0.00 0.00 0.96 0.00 0.00 13 K 7.87 4.03 0.00 1.97 1.90 0.00 1.87 0.00 0.00 1.73 0.00 0.00 3.04 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.49 1.51 7.81 14 R 8.94 4.18 0.00 1.99 2.10 0.00 3.19 0.00 0.00 3.21 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.88 0.00 15 L 8.46 4.29 0.00 1.90 2.02 0.91 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 16 L 8.58 4.33 0.00 2.04 1.80 0.96 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 17 G 7.97 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 18 W 8.05 4.33 0.00 3.46 3.42 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 19 K 7.92 3.84 0.00 2.00 2.26 0.00 1.86 0.00 0.00 1.80 0.00 0.00 3.17 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.44 1.48 7.81 20 K 7.80 4.26 0.00 2.18 1.95 0.00 1.73 0.00 0.00 0.61 0.00 0.00 2.81 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.43 1.43 7.81 21 G 8.79 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 22 E 8.17 3.51 0.00 2.02 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 2.28 2.42 0.00 23 Q 8.53 2.81 0.00 2.11 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.15 0.00 0.00 0.00 0.00 0.00 2.30 2.28 0.00 24 N 7.68 4.02 0.00 2.92 2.91 0.00 0.00 7.59 7.41 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 25 G 6.70 3.42 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 26 Q 7.72 4.00 0.00 2.18 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.82 0.00 0.00 0.00 0.00 0.00 2.43 2.51 0.00 27 E 8.87 3.98 0.00 2.15 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 0.00 2.26 2.38 0.00 28 E 8.20 3.93 0.00 2.13 2.21 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 2.39 2.45 0.00 29 K 7.91 4.06 0.00 1.90 1.97 0.00 1.67 0.00 0.00 1.58 0.00 0.00 2.99 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.44 1.49 7.81 30 W 8.01 3.95 0.00 3.45 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 31 C 8.26 3.99 0.00 3.19 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 32 E 7.85 3.88 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 2.27 2.34 0.00 33 K 7.66 3.79 0.00 1.50 1.59 0.00 1.66 0.00 0.00 1.58 0.00 0.00 2.92 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.63 1.48 7.81 34 A 7.67 3.56 0.56 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 0.00 0.00 35 V 7.84 3.68 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 1.23 0.00 0.00 0.95 0.00 0.00 36 K 8.46 3.92 0.00 1.92 1.83 0.00 1.74 0.00 0.00 1.58 0.00 0.00 2.87 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.45 1.65 7.81 37 S 8.24 4.03 0.00 3.82 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 38 L 7.77 3.89 0.00 1.56 1.71 0.70 0.26 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 39 V 8.16 3.52 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 0.93 0.00 0.00 1.01 0.00 0.00 40 K 7.94 3.82 0.00 1.87 1.98 0.00 1.68 0.00 0.00 1.64 0.00 0.00 2.95 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.44 1.50 7.81 41 K 7.78 4.01 0.00 1.92 1.82 0.00 1.72 0.00 0.00 1.66 0.00 0.00 2.98 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.46 1.66 7.81 42 L 7.86 4.24 0.00 1.67 1.72 0.81 0.62 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 43 K 8.11 3.89 0.00 2.07 1.85 0.00 1.62 0.00 0.00 1.63 0.00 0.00 2.91 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.41 1.46 7.81 44 K 7.73 4.16 0.00 1.84 1.85 0.00 1.70 0.00 0.00 1.75 0.00 0.00 3.06 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.46 1.61 7.81 45 T 7.30 4.43 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 1.23 0.00 0.00 46 G 7.60 3.75 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 0.00 0.00 0.00 47 Q 8.46 4.45 0.00 1.98 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.33 6.63 0.00 0.00 0.00 0.00 0.00 2.23 2.43 0.00 48 L 7.88 3.86 0.00 1.63 1.64 0.89 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 49 D 8.06 4.40 0.00 2.62 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 50 E 7.88 3.93 0.00 1.99 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 0.00 2.28 2.41 0.00 51 L 8.20 3.69 0.00 1.55 1.60 0.76 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 52 E 7.98 3.62 0.00 1.95 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 2.24 2.26 0.00 53 K 8.19 3.57 0.00 1.82 1.84 0.00 1.62 0.00 0.00 1.57 0.00 0.00 2.90 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.31 1.35 7.81 54 A 7.84 3.71 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 55 I 7.16 3.30 1.15 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 -0.35 0.05 0.00 0.00 56 T 7.08 2.48 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 0.75 0.00 0.00 57 T 7.95 3.95 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 1.08 0.00 0.00 58 Q 7.14 2.52 0.00 1.89 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.93 0.00 0.00 0.00 0.00 0.00 2.02 2.09 0.00 59 N 7.30 4.36 0.00 2.61 2.56 0.00 0.00 6.87 7.87 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 60 V 8.37 3.92 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 1.02 0.00 0.00 1.07 0.00 0.00 61 N 8.32 4.68 0.00 2.87 2.83 0.00 0.00 6.94 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 62 T 7.42 4.09 4.32 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 0.00 0.00 0.00 1.12 0.00 0.00 63 K 8.32 4.39 0.00 1.89 1.83 0.00 1.69 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.49 1.49 7.81 64 C 8.53 4.33 0.00 3.14 2.99 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 65 I 8.27 4.40 1.83 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.59 0.82 0.00 0.00 66 T 8.69 4.93 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 0.92 0.00 0.00 67 I 8.66 4.67 1.91 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 1.25 0.83 0.98 0.00 0.00 68 P 0.00 4.80 0.00 1.95 2.01 0.00 3.67 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 2.03 2.09 0.00 69 R 8.40 4.72 0.00 1.97 2.01 0.00 3.08 0.00 0.00 3.33 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.62 0.00 70 S 8.52 4.65 0.00 4.06 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 71 L 8.68 3.92 0.00 1.68 1.83 0.94 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 72 D 8.17 4.63 0.00 2.81 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 73 G 8.10 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 74 R 7.74 4.55 0.00 2.08 1.90 0.00 3.12 0.00 0.00 3.16 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.61 0.00 75 L 8.92 4.80 0.00 1.74 1.63 0.97 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 76 Q 8.81 5.15 0.00 2.13 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.50 0.00 0.00 0.00 0.00 0.00 2.32 2.64 0.00 77 V 8.51 4.28 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 0.04 0.00 0.00 0.75 0.00 0.00 78 S 8.75 3.68 0.00 4.03 3.38 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 0.00 79 H 9.52 5.00 0.00 3.19 3.28 0.00 5.75 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 80 R 8.21 4.75 0.00 1.94 1.76 0.00 2.95 0.00 0.00 2.97 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.40 0.00 81 K 8.20 5.10 0.00 1.60 1.68 0.00 1.83 0.00 0.00 1.73 0.00 0.00 2.99 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.35 1.43 7.81 82 G 8.14 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 0.00 0.00 0.00 83 L 7.70 4.38 0.00 1.41 1.06 0.67 0.87 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 84 P 0.00 4.23 0.00 2.23 2.26 0.00 3.40 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.23 0.00 85 H 8.19 4.17 0.00 2.61 3.41 0.00 5.48 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 V 7.11 3.36 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 0.94 0.00 0.00 0.55 0.00 0.00 87 I 7.75 3.55 1.48 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 1.50 1.07 0.45 0.00 0.00 88 Y 7.72 4.23 0.00 3.26 3.32 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 0.00 0.00 0.00 0.00 89 C 8.19 4.14 0.00 3.08 3.07 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 90 R 8.01 4.09 0.00 1.92 1.95 0.00 3.00 0.00 0.00 3.01 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.62 0.00 91 L 7.38 3.85 0.00 1.52 1.08 0.46 -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 0.00 0.00 0.00 0.00 92 W 7.86 4.95 0.00 3.59 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 93 R 8.29 4.03 0.00 0.67 0.66 0.00 2.77 0.00 0.00 2.25 7.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.55 0.00 94 W 7.02 4.78 0.00 3.51 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 95 P 0.00 4.63 0.00 2.19 2.20 0.00 3.53 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.96 0.00 96 D 8.22 4.41 0.00 2.73 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 97 L 7.61 3.94 0.00 1.92 1.79 0.94 1.10 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 98 H 8.56 4.55 0.00 3.15 3.42 0.00 5.75 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 99 S 7.47 4.83 0.00 4.00 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 0.00 100 H 8.72 4.31 0.00 3.30 3.32 0.00 5.72 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 0.00 101 H 7.65 4.44 0.00 3.23 3.32 0.00 5.63 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 E 8.27 4.32 0.00 2.00 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 2.29 2.38 0.00 103 L 7.05 5.34 0.00 1.70 1.68 1.02 0.29 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 0.00 104 R 8.45 4.55 0.00 1.91 1.79 0.00 3.13 0.00 0.00 3.20 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.57 0.00 105 A 9.13 4.43 1.08 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 0.00 106 M 8.40 4.42 0.00 1.99 1.95 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 2.56 0.00 107 E 9.00 4.21 0.00 1.92 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 2.31 2.36 0.00 108 L 7.95 5.43 0.00 1.82 1.84 0.90 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 109 C 7.77 4.16 0.00 2.69 2.81 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 0.00 110 E 8.96 3.95 0.00 1.92 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 2.18 2.28 0.00 111 F 8.11 4.83 0.00 3.15 3.33 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 0.00 112 A 8.11 4.50 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 0.00 113 F 9.39 4.31 0.00 2.93 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 0.00 114 N 8.41 4.36 0.00 2.83 2.90 0.00 0.00 6.84 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 0.00 115 M 7.59 4.16 0.00 1.99 2.17 0.00 0.00 0.00 0.00 0.00 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.46 0.00 116 K 6.98 3.94 0.00 1.78 2.03 0.00 1.55 0.00 0.00 1.60 0.00 0.00 2.80 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.10 1.21 7.81 117 K 7.54 4.76 0.00 2.12 1.83 0.00 1.42 0.00 0.00 1.68 0.00 0.00 3.00 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.39 1.56 7.81 118 D 8.76 4.64 0.00 2.75 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 0.00 119 E 8.07 5.15 0.00 1.58 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 0.00 2.24 2.06 0.00 120 V 8.97 4.77 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 1.29 0.00 0.00 1.17 0.00 0.00 121 C 9.09 4.89 0.00 3.27 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 0.00 122 V 8.79 4.66 2.29 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 0.90 0.00 0.00 0.90 0.00 0.00 123 N 8.39 4.41 0.00 2.65 2.62 0.00 0.00 6.84 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 0.00 124 P 0.00 4.43 0.00 1.85 2.25 0.00 3.79 0.00 0.00 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 2.07 0.00 125 Y 8.32 4.42 0.00 3.12 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 0.00 126 H 8.46 5.06 0.00 3.20 3.01 0.00 5.57 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 0.00 127 Y 8.15 5.43 0.00 3.04 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 0.00 128 Q 9.49 5.01 0.00 1.98 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.89 0.00 0.00 0.00 0.00 0.00 2.41 2.37 0.00 129 R 8.00 4.38 0.00 0.67 0.99 0.00 2.21 0.00 0.00 2.65 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 1.24 0.00 130 V 8.44 4.43 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 0.80 0.00 0.00 0.94 0.00 0.00 131 E 8.73 4.24 0.00 1.89 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 0.00 2.25 2.29 0.00 132 T 7.34 3.70 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 1.17 0.00 0.00