NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4711 8.3049 120.3261 54.5098 34.0409 175.1202 2 Q 4.2303 7.5411 113.3474 55.0647 32.4403 170.6007 3 G 3.7948 9.0571 106.2117 44.6005 0.0000 173.9771 4 Q 4.2799 8.0841 118.2546 53.5446 30.6769 175.0282 5 D 4.3774 8.4602 123.5714 54.0053 42.5237 177.3416 6 R 3.8367 8.3150 123.7635 59.6866 30.5198 178.1982 7 H 4.2878 7.9536 114.4356 59.0679 28.3599 176.5238 8 M 3.9027 7.9582 121.3629 58.2892 31.8325 177.8654 9 I 3.6385 7.5392 119.4026 64.7525 37.2074 177.8455 10 R 3.9055 8.1920 119.1626 60.2375 29.9821 177.7365 11 M 3.9874 8.2674 116.8240 59.0988 31.9092 178.5081 12 R 3.8892 8.5931 115.4751 59.8872 29.4994 178.8139 13 Q 3.9405 8.2421 118.7823 58.6107 28.7781 178.7775 14 L 3.9607 8.5891 120.9338 58.1711 41.7359 179.9402 15 I 3.6115 7.6925 119.1706 64.1412 36.6966 177.6513 16 D 4.2810 8.5499 120.2431 56.7327 40.5943 177.7961 17 I 3.7955 8.7194 114.5596 64.3582 37.4087 177.8114 18 V 3.5150 7.6246 119.8568 65.9708 31.2329 177.5510 19 D 4.4023 8.1446 117.3664 57.0802 40.7736 178.0179 20 Q 3.8120 8.7038 120.6056 59.1938 29.3917 177.7127 21 L 4.3297 9.2172 121.8862 57.9173 42.1193 178.9199 22 K 3.8849 8.5480 118.9612 59.6900 31.8897 178.6036 23 N 4.4469 7.9128 115.4189 55.9105 38.6410 175.0411 24 Y 4.9459 7.7965 118.3658 57.4974 39.4874 177.7963 25 V 3.4879 8.2113 122.7851 66.3096 31.3251 176.3781 26 N 4.3679 8.3490 115.4508 55.9220 39.2296 174.1147 27 D 5.1281 9.1983 119.6571 54.3021 41.6481 175.9913 28 L 5.1576 8.1344 118.8107 52.8273 44.2881 177.3708 29 V 4.0926 8.4757 125.1687 59.9970 32.6581 174.4015 30 P 4.3684 0.0000 0.0000 62.4923 31.1527 175.2371 31 E 4.3033 8.0667 121.4033 54.0353 33.5249 175.7928 32 F 4.3290 8.1884 119.1144 58.0725 37.9151 174.3242 33 L 4.6391 8.1229 126.0947 51.6839 44.2505 174.2914 34 P 4.5930 0.0000 0.0000 62.5754 32.2568 175.5701 35 A 4.2972 8.0301 125.5393 49.1393 21.5543 173.9795 36 P 3.1844 0.0000 0.0000 62.5762 31.3610 175.6465 37 E 3.9938 7.5886 125.1141 55.0877 30.0140 172.9249 38 D 4.2107 8.5836 129.7238 54.3795 39.0377 172.5498 39 V 4.4859 7.7552 117.5829 58.6768 34.1918 175.8131 40 E 4.1464 8.6446 122.8572 56.4942 30.2194 177.8842 41 T 3.8676 8.5355 119.3188 66.7255 68.9642 175.2315 42 N 5.1970 7.9818 115.5966 53.0797 38.5927 175.0647 43 C 4.9484 7.7122 116.6280 58.2971 39.1295 176.8360 44 E 3.7786 7.8048 119.4535 59.3186 28.6431 179.1143 45 W 4.5373 8.1137 118.6185 60.0108 29.0747 178.4585 46 S 4.1422 8.3896 112.2699 61.1602 62.6004 175.5705 47 A 4.3492 8.5041 124.9553 54.5169 18.7020 178.8563 48 F 4.5102 9.3460 120.5107 61.7852 39.2486 177.3779 49 S 4.3780 8.0256 112.4700 61.3094 62.3923 175.2956 50 C 4.4561 8.8188 119.4878 59.4357 39.6433 175.2148 51 F 4.3089 7.2138 115.7959 58.2191 38.4410 177.3085 52 Q 4.2684 8.2778 119.1451 58.2681 28.9466 178.0950 53 K 4.1235 7.9755 116.9987 58.9953 32.7861 178.1434 54 A 3.9654 7.1054 120.9454 53.6962 18.7401 175.0352 55 Q 3.2718 7.5626 122.6501 55.5887 27.1583 171.5914 56 L 4.2080 8.4212 125.0238 54.5231 42.5888 175.7335 57 K 4.7530 8.6029 127.9813 54.6627 34.2361 175.0807 58 S 5.6879 8.7757 120.8619 56.3585 64.9398 174.5791 59 A 3.8173 8.9007 123.1217 53.4044 18.4795 177.3741 60 N 4.0752 7.6200 109.3199 54.6740 35.9265 173.8876 61 T 4.3844 7.7661 103.0311 60.3808 70.5935 174.2220 62 G 3.7701 7.9001 111.8534 47.4179 0.0000 173.0626 63 N 4.8186 7.3231 129.8242 52.5141 37.5895 174.7045 64 N 4.6790 7.3989 119.1626 53.2011 39.9225 177.2810 65 E 3.9186 7.9308 119.0949 59.1433 30.2308 176.6445 66 R 3.9766 7.7959 118.0262 59.3642 29.6589 178.3728 67 I 3.5649 7.5343 117.7927 64.2648 38.0126 177.4527 68 I 3.9576 7.4290 120.4007 64.7603 37.0386 177.5524 69 N 4.2189 7.9142 117.1942 56.6365 38.3395 177.1504 70 V 3.7564 9.0631 114.3373 64.2029 31.5271 178.4971 71 S 4.1489 8.7539 115.5414 61.1240 62.6500 176.4935 72 I 3.9714 7.7952 122.0794 64.8444 36.7193 177.7042 73 K 4.1190 7.6581 116.5725 60.1444 32.0722 178.6055 74 K 4.0273 7.9960 118.5700 59.6827 32.0993 178.5799 75 L 4.0093 8.5844 120.6663 58.1176 43.0246 178.7529 76 K 4.3956 8.7952 118.9463 54.9866 30.4208 177.4088 77 R 4.5397 7.3139 118.2780 55.2059 31.7387 177.5583 78 K 4.9960 8.8310 121.0919 54.6767 32.9842 175.2006 79 P 4.4437 0.0000 0.0000 61.3623 32.3367 175.5182 80 P 4.2074 0.0000 0.0000 62.7190 29.2521 173.1402 81 S 3.6980 7.8732 127.0510 59.5212 64.1009 174.2001 82 T 2.9708 8.8548 114.5570 62.3773 68.0685 171.1795 83 N 4.1661 5.7700 125.1758 53.5290 45.6332 173.9849 84 A 4.4357 7.5934 128.9626 50.4397 19.8637 175.6531 85 G 3.9575 8.5508 108.9365 45.8407 0.0000 171.2013 86 R 4.3291 8.3235 117.0780 57.3086 32.0957 176.5779 87 R 4.2110 7.6940 117.7227 55.8515 29.2447 175.3640 88 Q 3.0734 8.8857 126.0213 57.7463 27.5905 173.2545 89 K 3.5436 7.5648 116.3493 58.0447 32.3460 172.8603 90 H 4.8041 8.6138 116.7972 56.0750 35.8352 174.7870 91 R 4.0554 8.6920 118.9911 57.8268 30.8567 176.5720 92 L 4.4101 7.3082 113.1591 55.5014 42.2222 173.4303 93 T 4.5343 8.4055 109.8802 60.8714 70.3974 174.7674 94 C 5.0907 8.2619 119.1380 54.4504 44.1870 173.1391 95 P 4.4357 0.0000 0.0000 62.0618 32.5851 175.3905 96 S 4.2702 8.3334 114.6870 59.4830 62.7825 173.9573 97 C 4.5810 8.0110 119.7924 58.8878 44.2633 174.7038 98 D 4.6616 7.6087 125.0183 54.4307 38.3644 175.2715 99 S 4.2358 7.9126 114.3130 59.6180 65.1279 174.1260 100 Y 4.3610 7.1920 115.3841 57.9587 38.0652 174.8168 101 E 4.6164 8.5450 117.6077 55.6492 32.2878 176.0424 102 K 4.7497 8.4248 120.4274 56.5806 33.9851 175.2880 103 K 4.5865 8.6402 119.7090 55.3663 37.5449 173.7932 104 P 4.8220 0.0000 0.0000 61.6247 32.5710 175.6967 105 P 4.5172 0.0000 0.0000 65.8705 31.3573 178.3253 106 K 3.9020 8.1759 118.4987 59.8217 32.2148 178.7283 107 E 3.9795 8.1334 119.0045 59.1494 29.7906 178.4889 108 F 4.5341 8.6738 120.9822 61.4232 39.0893 177.2402 109 L 3.8343 8.2977 118.5362 57.4399 40.3868 178.7164 110 E 3.8658 8.2258 118.7989 58.5132 28.9020 178.5335 111 R 4.0750 8.4822 118.7832 58.7411 30.5749 177.4717 112 F 3.3094 8.0395 120.3751 61.1951 39.1545 176.7567 113 K 3.3186 7.8818 118.9576 59.4765 31.8721 178.5475 114 S 3.9236 7.3004 112.6693 61.3914 62.3988 175.4991 115 L 3.9434 8.9549 123.6349 59.0293 41.5858 178.4812 116 L 4.2417 8.3703 120.7026 56.8413 41.3298 178.8416 117 Q 4.1057 8.1777 119.3344 58.5807 28.6316 178.4719 118 K 4.0704 8.2252 121.3520 58.9482 32.1258 178.0838 119 M 4.5710 8.1934 119.1729 56.8438 32.5250 178.6552 120 I 3.2329 7.1546 118.8570 65.5024 37.6232 176.7733 121 H 3.8059 8.5835 117.9385 59.8942 29.2973 176.4829 122 Q 4.4619 8.2305 119.5110 59.3267 28.1627 178.6035 123 H 3.9265 9.0431 119.5806 58.8529 29.7098 176.3485 124 L 4.3401 8.3637 120.3074 55.3463 42.7259 176.9141 125 S 4.5071 7.4508 111.9632 56.7946 65.0620 173.7633 126 S 3.8025 8.1399 122.4201 58.4811 63.0208 171.7701 127 R 3.5371 7.7662 134.1451 57.3831 27.4283 175.2510 128 T 3.3283 8.0470 111.1629 64.5843 65.3487 170.4077 129 H 4.5812 8.7352 124.6115 53.5148 30.9488 175.0137 130 G 4.5123 7.2431 127.0700 45.6530 0.0000 169.9753 131 S 4.4605 7.3407 118.6940 56.2473 65.4220 173.0342 132 E 4.9304 8.1585 125.3603 56.2533 32.0611 174.0470 133 D 4.6013 8.9074 124.1864 55.3689 44.5942 174.7598 134 S 4.3370 7.9870 116.0755 58.2401 62.5472 173.3189 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 M 8.30 4.47 0.00 2.02 2.19 0.00 0.00 0.00 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.57 0.00 2 Q 7.54 4.23 0.00 2.06 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.59 6.40 0.00 0.00 0.00 0.00 0.00 2.23 2.42 0.00 3 G 9.06 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 4 Q 8.08 4.28 0.00 1.99 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.86 0.00 0.00 0.00 0.00 0.00 2.25 2.37 0.00 5 D 8.46 4.38 0.00 2.52 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 0.00 0.00 0.00 6 R 8.31 3.84 0.00 1.77 1.94 0.00 3.25 0.00 0.00 3.28 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.68 0.00 7 H 7.95 4.29 0.00 3.48 3.59 0.00 5.75 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 M 7.96 3.90 0.00 2.22 2.14 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.67 0.00 9 I 7.54 3.64 2.08 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 1.40 0.62 0.92 0.00 0.00 10 R 8.19 3.91 0.00 1.93 2.16 0.00 3.31 0.00 0.00 3.25 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.79 0.00 11 M 8.27 3.99 0.00 2.08 2.21 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.75 2.64 0.00 12 R 8.59 3.89 0.00 2.00 2.20 0.00 2.77 0.00 0.00 3.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.68 0.00 13 Q 8.24 3.94 0.00 2.26 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.80 0.00 0.00 0.00 0.00 0.00 2.43 2.55 0.00 14 L 8.59 3.96 0.00 1.72 1.33 0.71 0.96 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 15 I 7.69 3.61 1.88 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 1.28 0.60 0.81 0.00 0.00 16 D 8.55 4.28 0.00 2.92 2.63 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 17 I 8.72 3.80 1.88 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 1.38 0.66 0.97 0.00 0.00 18 V 7.62 3.52 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 0.83 0.00 0.00 0.57 0.00 0.00 19 D 8.14 4.40 0.00 2.86 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 20 Q 8.70 3.81 0.00 2.03 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.98 6.69 0.00 0.00 0.00 0.00 0.00 2.43 2.48 0.00 21 L 9.22 4.33 0.00 1.83 1.87 0.99 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 22 K 8.55 3.88 0.00 1.88 1.81 0.00 1.72 0.00 0.00 1.56 0.00 0.00 2.84 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.47 1.59 7.81 23 N 7.91 4.45 0.00 2.54 2.25 0.00 0.00 6.54 7.06 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 24 Y 7.80 4.95 0.00 3.22 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 25 V 8.21 3.49 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 1.01 0.00 0.00 0.99 0.00 0.00 26 N 8.35 4.37 0.00 2.77 2.92 0.00 0.00 6.83 8.49 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 27 D 9.20 5.13 0.00 2.73 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 28 L 8.13 5.16 0.00 1.75 1.61 0.99 0.80 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 29 V 8.48 4.09 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 0.70 0.00 0.00 0.91 0.00 0.00 30 P 0.00 4.37 0.00 2.09 2.08 0.00 3.68 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 1.92 1.94 0.00 31 E 8.07 4.30 0.00 1.83 1.74 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 2.07 2.20 0.00 32 F 8.19 4.33 0.00 2.99 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 33 L 8.12 4.64 0.00 1.38 0.66 0.79 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 34 P 0.00 4.59 0.00 1.92 1.97 0.00 3.25 0.00 0.00 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.83 0.00 35 A 8.03 4.30 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 36 P 0.00 3.18 0.00 1.97 1.96 0.00 3.00 0.00 0.00 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.71 0.00 37 E 7.59 3.99 0.00 1.81 1.82 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 2.20 2.26 0.00 38 D 8.58 4.21 0.00 2.80 2.68 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 0.00 0.00 0.00 0.00 39 V 7.76 4.49 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 0.83 0.00 0.00 0.95 0.00 0.00 40 E 8.64 4.15 0.00 2.06 1.91 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 2.44 2.40 0.00 41 T 8.54 3.87 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 42 N 7.98 5.20 0.00 2.77 2.93 0.00 0.00 6.93 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 43 C 7.71 4.95 0.00 3.19 3.16 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 44 E 7.80 3.78 0.00 1.97 1.61 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 2.35 2.55 0.00 45 W 8.11 4.54 0.00 3.43 3.35 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 46 S 8.39 4.14 0.00 4.14 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 0.00 47 A 8.50 4.35 1.54 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 0.00 0.00 0.00 0.00 0.00 0.00 48 F 9.35 4.51 0.00 3.37 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 49 S 8.03 4.38 0.00 4.12 4.10 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 0.00 0.00 0.00 50 C 8.82 4.46 0.00 2.95 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 51 F 7.21 4.31 0.00 2.30 1.45 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 52 Q 8.28 4.27 0.00 2.14 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.87 0.00 0.00 0.00 0.00 0.00 2.36 2.53 0.00 53 K 7.98 4.12 0.00 1.89 1.94 0.00 1.59 0.00 0.00 1.84 0.00 0.00 3.03 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.34 1.43 7.81 54 A 7.11 3.97 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 7.56 3.27 0.00 2.24 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.86 0.00 0.00 0.00 0.00 0.00 2.27 2.30 0.00 56 L 8.42 4.21 0.00 1.94 1.73 1.00 0.79 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 57 K 8.60 4.75 0.00 1.90 1.62 0.00 1.66 0.00 0.00 1.87 0.00 0.00 2.96 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.40 1.47 7.81 58 S 8.78 5.69 0.00 3.96 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 59 A 8.90 3.82 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 60 N 7.62 4.08 0.00 2.85 2.82 0.00 0.00 6.66 7.36 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 61 T 7.77 4.38 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 1.22 0.00 0.00 62 G 7.90 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 0.00 0.00 0.00 63 N 7.32 4.82 0.00 2.81 2.73 0.00 0.00 7.02 8.01 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 64 N 7.40 4.68 0.00 2.53 1.60 0.00 0.00 6.54 7.52 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 65 E 7.93 3.92 0.00 1.92 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 2.42 2.27 0.00 66 R 7.80 3.98 0.00 1.93 1.87 0.00 3.27 0.00 0.00 3.25 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.73 0.00 67 I 7.53 3.56 1.66 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 1.59 1.36 0.31 0.00 0.00 68 I 7.43 3.96 2.13 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 1.44 0.62 0.95 0.00 0.00 69 N 7.91 4.22 0.00 2.80 2.92 0.00 0.00 7.21 8.84 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 70 V 9.06 3.76 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 0.79 0.00 0.00 0.97 0.00 0.00 71 S 8.75 4.15 0.00 4.05 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 72 I 7.80 3.97 1.91 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.10 0.96 0.00 0.00 73 K 7.66 4.12 0.00 1.78 1.90 0.00 1.74 0.00 0.00 1.66 0.00 0.00 3.00 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.52 1.70 7.81 74 K 8.00 4.03 0.00 1.92 1.83 0.00 1.75 0.00 0.00 1.64 0.00 0.00 2.97 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.46 1.50 7.81 75 L 8.58 4.01 0.00 1.67 2.14 1.12 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 76 K 8.80 4.40 0.00 1.98 1.84 0.00 1.79 0.00 0.00 1.75 0.00 0.00 3.12 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.63 1.54 7.81 77 R 7.31 4.54 0.00 2.04 2.29 0.00 3.44 0.00 0.00 3.38 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.90 0.00 78 K 8.83 5.00 0.00 1.86 1.84 0.00 1.87 0.00 0.00 2.49 0.00 0.00 3.13 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.76 1.41 7.81 79 P 0.00 4.44 0.00 2.24 2.44 0.00 3.93 0.00 0.00 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.28 0.00 80 P 0.00 4.21 0.00 1.66 1.73 0.00 3.38 0.00 0.00 3.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 0.44 0.00 81 S 7.87 3.70 0.00 3.92 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 82 T 8.85 2.97 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 1.21 0.00 0.00 83 N 5.77 4.17 0.00 2.65 2.77 0.00 0.00 7.26 8.25 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 84 A 7.59 4.44 1.32 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 0.00 0.00 85 G 8.55 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 86 R 8.32 4.33 0.00 1.69 1.86 0.00 3.37 0.00 0.00 3.21 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.51 0.00 87 R 7.69 4.21 0.00 1.81 1.85 0.00 3.56 0.00 0.00 3.14 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.53 0.00 88 Q 8.89 3.07 0.00 2.07 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.61 6.00 0.00 0.00 0.00 0.00 0.00 2.26 2.41 0.00 89 K 7.56 3.54 0.00 1.88 1.82 0.00 1.74 0.00 0.00 1.78 0.00 0.00 3.40 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.55 1.61 7.81 90 H 8.61 4.80 0.00 3.19 3.12 0.00 5.59 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 R 8.69 4.06 0.00 1.87 2.12 0.00 3.42 0.00 0.00 3.27 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.58 0.00 92 L 7.31 4.41 0.00 1.71 1.62 1.02 0.67 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 93 T 8.41 4.53 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 94 C 8.26 5.09 0.00 3.00 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 95 P 0.00 4.44 0.00 2.12 2.08 0.00 3.83 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 1.98 1.99 0.00 96 S 8.33 4.27 0.00 3.81 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 97 C 8.01 4.58 0.00 2.97 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 D 7.61 4.66 0.00 2.65 2.58 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.91 4.24 0.00 3.52 3.22 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 0.00 100 Y 7.19 4.36 0.00 2.98 2.89 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 0.00 101 E 8.54 4.62 0.00 2.07 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 0.00 2.36 2.37 0.00 102 K 8.42 4.75 0.00 1.77 1.95 0.00 1.64 0.00 0.00 1.66 0.00 0.00 3.02 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.59 1.63 7.81 103 K 8.64 4.59 0.00 1.75 1.75 0.00 1.59 0.00 0.00 1.74 0.00 0.00 2.98 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.59 1.45 7.81 104 P 0.00 4.82 0.00 2.25 2.20 0.00 3.81 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 1.97 0.00 105 P 0.00 4.52 0.00 2.39 2.44 0.00 3.74 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.18 0.00 106 K 8.18 3.90 0.00 2.03 2.16 0.00 1.52 0.00 0.00 1.84 0.00 0.00 2.94 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.53 1.59 7.81 107 E 8.13 3.98 0.00 2.11 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 0.00 2.43 2.39 0.00 108 F 8.67 4.53 0.00 3.08 3.37 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.30 3.83 0.00 1.82 1.64 0.81 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 110 E 8.23 3.87 0.00 2.30 1.97 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 2.29 2.30 0.00 111 R 8.48 4.08 0.00 2.20 2.11 0.00 3.28 0.00 0.00 3.13 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.73 0.00 112 F 8.04 3.31 0.00 2.80 2.62 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.88 3.32 0.00 1.54 1.79 0.00 1.59 0.00 0.00 1.47 0.00 0.00 2.83 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.27 1.47 7.81 114 S 7.30 3.92 0.00 4.21 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 0.00 115 L 8.95 3.94 0.00 2.00 1.75 0.95 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 116 L 8.37 4.24 0.00 1.65 1.46 -0.16 1.19 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 0.00 117 Q 8.18 4.11 0.00 2.13 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.92 0.00 0.00 0.00 0.00 0.00 2.41 2.50 0.00 118 K 8.23 4.07 0.00 1.75 1.81 0.00 1.66 0.00 0.00 1.67 0.00 0.00 3.01 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.41 1.45 7.81 119 M 8.19 4.57 0.00 1.83 1.89 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 2.50 2.52 0.00 120 I 7.15 3.23 1.76 0.00 0.00 0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 -0.36 0.82 0.00 0.00 121 H 8.58 3.81 0.00 3.14 3.24 0.00 5.62 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 Q 8.23 4.46 0.00 2.35 2.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.54 0.00 0.00 0.00 0.00 0.00 2.53 2.39 0.00 123 H 9.04 3.93 0.00 3.25 3.57 0.00 5.94 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 L 8.36 4.34 0.00 1.74 1.65 0.91 0.08 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 0.00 125 S 7.45 4.51 0.00 3.75 3.62 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.14 3.80 0.00 3.90 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 0.00 127 R 7.77 3.54 0.00 1.99 2.11 0.00 3.43 0.00 0.00 3.25 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.72 0.00 128 T 8.05 3.33 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 1.21 0.00 0.00 129 H 8.74 4.58 0.00 3.12 3.18 0.00 5.86 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 0.00 130 G 7.24 4.51 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 S 7.34 4.46 0.00 3.69 3.64 0.00 0.00 0.00 0.00 0.00 0.00 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 8.16 4.93 0.00 1.90 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 2.02 2.09 0.00 133 D 8.91 4.60 0.00 2.57 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 0.00 134 S 7.99 4.34 0.00 3.83 3.68 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 0.00 0.00 0.00 0.00