NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 22 H 4.7411 8.4449 116.3353 55.2892 30.4780 173.2565 23 M 4.1430 7.4628 118.7651 54.5398 32.9236 175.8529 24 A 3.9648 8.7996 123.8220 55.0108 19.4936 178.0956 25 Q 4.4522 7.9314 112.0054 55.9107 28.8881 175.2727 26 Q 4.5070 7.5264 118.3191 53.6769 30.9182 174.8237 27 N 4.4611 8.4220 117.1322 54.0630 39.4875 174.6372 28 I 3.9786 8.3592 123.9628 62.9682 39.5546 174.7830 29 L 5.3925 8.7416 124.4454 53.4910 45.1947 175.3380 30 S 5.2814 9.0794 119.7468 56.9348 67.2197 173.0457 31 V 5.0130 8.3762 112.3499 59.3813 36.8039 174.0355 32 H 5.3233 8.4898 120.2910 55.3067 33.5503 171.7824 33 I 4.6539 9.0836 127.0469 59.3211 39.8252 174.1061 34 L 4.8133 8.5446 129.8358 52.9375 44.6251 174.7291 35 N 5.0916 8.8882 126.1487 53.4794 39.3456 175.1996 36 Q 4.3702 9.3241 125.9468 57.2629 28.7068 177.2843 37 Q 4.3873 9.1555 118.7800 56.8788 29.4198 176.4920 38 T 4.4424 8.0071 105.0088 60.2502 70.5030 174.8716 39 G 3.9482 8.5888 109.8808 45.8002 0.0000 173.0755 40 K 4.8086 7.5128 117.9635 53.2143 36.0925 174.2008 41 P 4.7835 0.0000 0.0000 62.9895 32.3905 176.2179 42 A 4.3974 8.5468 124.5471 50.5985 19.6835 176.4542 43 A 4.5337 8.5469 123.0537 51.7207 20.8820 175.5969 44 D 4.3253 8.4129 115.9532 55.2601 40.4592 173.5578 45 V 4.2948 7.6966 117.0760 61.2557 33.3548 175.0457 46 T 4.5471 8.4339 124.5863 63.6134 70.0151 173.6582 47 V 4.7418 9.0321 125.4998 61.4499 34.9265 174.2052 48 T 4.9309 8.4682 117.8350 59.8810 72.0154 172.9368 49 L 5.1583 8.7849 124.8860 53.4583 44.9858 175.0790 50 E 5.2675 9.5041 124.9744 54.4603 34.1828 174.3200 51 K 4.6222 9.3843 124.0428 54.2906 34.9132 175.0559 52 K 3.2719 8.1612 129.4178 55.9677 32.5445 175.7538 53 A 4.4510 7.7011 130.0827 49.9038 21.9958 173.7365 54 D 4.1072 8.5625 117.0315 55.4145 40.3692 175.0928 55 N 3.8280 8.9844 123.4685 51.5449 36.6731 173.0172 56 G 4.2372 6.5439 107.8447 42.5407 0.0000 169.4763 57 W 5.1360 8.1406 119.0761 54.4570 32.4798 174.7333 58 L 4.7603 8.7542 123.6016 53.1813 44.2817 175.0004 59 Q 4.5577 8.7839 128.0308 56.1284 28.9873 175.2285 60 L 4.2758 8.7659 127.1230 56.4284 43.0735 175.7944 61 N 4.3662 7.6689 115.1952 53.6759 42.4101 172.8822 62 T 5.0739 8.3038 114.5313 61.0323 70.6059 172.0609 63 A 4.6558 8.9521 128.8588 51.1760 23.5674 174.5202 64 K 5.1750 8.2941 117.6727 54.5401 35.1335 177.1037 65 T 4.2770 8.7219 114.9375 62.0563 70.2331 174.5379 66 D 5.1006 8.9290 123.9877 52.1066 41.7227 176.7982 67 K 4.0230 8.6291 117.1277 59.8866 31.6237 177.0252 68 D 4.6747 8.7831 119.3038 53.6302 40.9784 177.1036 69 G 3.9511 8.5576 107.4914 46.5434 0.0000 173.8971 70 R 5.0631 7.5669 114.4174 54.0424 33.5074 175.4851 71 I 4.7748 8.1413 119.5671 59.3435 38.8936 176.7144 72 K 3.8717 8.8734 125.2518 58.5664 32.0571 177.5805 73 A 4.7209 7.6978 122.0961 50.3014 19.3172 174.6716 74 L 4.3201 9.0848 123.2495 55.8927 43.0420 176.7460 75 W 4.1085 8.3782 129.0625 56.0069 31.0151 173.9237 76 P 4.4145 0.0000 0.0000 62.2759 31.8951 177.1935 77 E 4.4740 8.2500 119.0435 55.2159 27.0915 176.2459 78 Q 4.6743 7.5403 116.5763 54.6154 31.8708 175.4706 79 T 3.9587 8.5674 116.5863 63.7530 68.7916 174.3633 80 A 4.5651 8.4750 130.0374 52.0084 19.2122 176.4058 81 T 4.7426 7.9582 109.3633 59.3332 71.8148 174.1798 82 T 4.0255 8.7200 113.9168 61.1648 69.3796 174.2898 83 G 3.8295 7.7202 112.7360 45.9940 0.0000 170.3458 84 D 5.1950 7.4573 118.2148 53.6495 42.8860 175.6184 85 Y 5.3192 8.7696 118.9598 56.7148 43.4470 174.0152 86 R 5.0163 9.0881 119.8160 55.3666 33.8304 173.8015 87 V 4.7664 8.9656 119.7276 59.5487 34.6031 174.8898 88 V 4.5238 8.3411 125.0681 61.0775 33.9810 174.2723 89 F 4.5992 8.9746 128.2097 56.3282 39.8046 176.7939 90 K 4.1789 8.7347 127.7161 55.6988 28.8667 177.7075 91 T 3.9436 7.7887 112.7235 63.9075 69.6444 177.2545 92 G 4.0841 8.0798 110.1318 47.5474 0.0000 175.3221 93 D 4.4391 8.1211 120.9105 56.9752 40.6841 177.9585 94 Y 4.0551 7.3014 119.0715 60.9134 39.0841 178.0751 95 F 4.2251 8.2862 118.5724 60.3678 38.9726 177.8364 96 K 4.0155 8.1781 118.2339 59.3885 31.6180 179.3311 97 K 4.1111 7.7710 117.0007 58.3364 31.9944 178.2427 98 Q 4.3290 7.6467 116.6353 54.4897 29.3502 174.8368 99 N 4.3239 8.1792 116.2755 54.6502 36.4781 174.1652 100 L 4.8393 7.7820 115.2677 52.9742 45.5070 176.5767 101 E 4.5001 8.4474 120.8604 55.5052 31.0644 175.5986 102 S 3.9847 7.7698 113.6346 56.3151 65.5599 174.0260 103 F 4.2754 7.6468 127.5675 59.8597 39.3098 175.3774 104 F 4.8143 7.1042 119.3432 54.6746 40.7690 174.0316 105 P 4.4342 0.0000 0.0000 65.6178 31.5451 175.5362 106 E 5.0136 7.6362 113.6027 55.3477 32.6453 175.1056 107 I 4.3500 8.8748 121.4678 58.9051 39.5854 173.1530 108 P 5.0076 0.0000 0.0000 61.8235 33.2007 175.8058 109 V 4.4500 8.8418 121.6813 61.4491 34.5158 173.8128 110 E 5.1842 9.0255 128.1961 55.3569 30.7841 175.6493 111 F 5.2235 9.0602 118.7501 55.5742 42.3044 172.5822 112 H 5.3955 9.1679 118.7823 54.5526 32.1926 173.0356 113 I 4.1509 8.5793 127.0423 59.9532 38.0681 176.0271 114 N 4.5395 9.2072 124.8889 53.7565 38.4466 175.6959 115 K 4.6068 8.2139 117.3752 54.4661 34.7691 176.3488 116 V 3.9622 8.4946 115.7637 61.9240 31.6849 176.0766 117 N 4.9678 7.9764 116.7272 52.5691 38.8848 173.9184 118 E 4.6798 7.7298 114.4928 54.6059 32.8500 173.9042 119 H 4.6712 8.4251 119.5449 56.1097 31.1639 173.7756 120 Y 4.4655 8.8317 122.6597 56.2823 40.9598 173.9753 121 H 5.2739 8.7353 123.5074 54.2768 33.2273 172.1163 122 V 4.3483 8.4608 126.1620 60.4923 33.0542 172.5848 123 P 4.7069 0.0000 0.0000 61.5152 33.8644 174.4865 124 L 4.5130 8.5938 123.0116 53.2626 45.0972 175.1580 125 L 4.8061 8.9687 127.7222 53.5844 42.9851 175.1638 126 L 5.1616 8.9436 127.4589 53.4601 44.2448 175.4512 127 S 5.2328 8.8769 120.7656 56.7742 66.9653 174.3639 128 Q 3.3778 9.9382 120.6610 58.5861 28.4349 178.0809 129 Y 4.4801 7.6413 113.3138 56.9954 39.2382 175.1851 130 G 4.3443 8.3903 105.9361 45.7102 0.0000 172.4056 131 Y 5.3227 7.8081 117.3068 56.1989 40.7954 173.6884 132 S 4.9012 9.0697 115.2955 57.4458 67.3974 173.1194 133 T 5.0862 8.4776 115.4814 61.3285 70.5177 171.5853 134 Y 4.6915 7.3555 121.2455 56.1349 40.5390 173.3737 135 R 4.0610 8.9440 121.2737 55.7740 30.3951 176.3674 136 G 3.9462 8.8553 115.0634 46.6077 0.0000 173.3617 137 S 4.5380 8.6775 116.8908 58.4405 63.1440 174.3516 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 22 H 8.44 4.74 0.00 3.27 3.44 0.00 5.45 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 23 M 7.46 4.14 0.00 1.74 1.88 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.02 0.00 24 A 8.80 3.96 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 0.00 0.00 0.00 0.00 0.00 25 Q 7.93 4.45 0.00 2.01 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.74 0.00 0.00 0.00 0.00 0.00 2.29 2.41 0.00 26 Q 7.53 4.51 0.00 2.10 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.85 0.00 0.00 0.00 0.00 0.00 2.31 2.31 0.00 27 N 8.42 4.46 0.00 2.74 2.80 0.00 0.00 6.86 7.94 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 28 I 8.36 3.98 1.69 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 1.33 0.40 0.00 0.00 29 L 8.74 5.39 0.00 1.88 1.64 0.82 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 30 S 9.08 5.28 0.00 4.07 4.18 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.38 5.01 2.38 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 1.01 0.00 0.00 0.98 0.00 0.00 32 H 8.49 5.32 0.00 3.22 3.05 0.00 5.64 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 33 I 9.08 4.65 1.66 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.89 0.55 0.00 0.00 34 L 8.54 4.81 0.00 1.51 1.38 0.92 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 35 N 8.89 5.09 0.00 2.88 2.93 0.00 0.00 6.79 7.01 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 36 Q 9.32 4.37 0.00 2.03 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.99 6.67 0.00 0.00 0.00 0.00 0.00 2.43 2.47 0.00 37 Q 9.16 4.39 0.00 2.27 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.72 0.00 0.00 0.00 0.00 0.00 2.46 2.46 0.00 38 T 8.01 4.44 4.30 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 1.29 0.00 0.00 39 G 8.59 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 40 K 7.51 4.81 0.00 1.70 1.70 0.00 1.71 0.00 0.00 1.68 0.00 0.00 2.88 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.36 1.59 7.81 41 P 0.00 4.78 0.00 1.95 2.17 0.00 3.68 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 2.05 2.15 0.00 42 A 8.55 4.40 0.41 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 0.00 0.00 0.00 0.00 0.00 0.00 43 A 8.55 4.53 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 44 D 8.41 4.33 0.00 2.81 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 45 V 7.70 4.29 1.99 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 0.93 0.00 0.00 0.71 0.00 0.00 46 T 8.43 4.55 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 1.17 0.00 0.00 47 V 9.03 4.74 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 0.57 0.00 0.00 0.91 0.00 0.00 48 T 8.47 4.93 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 1.14 0.00 0.00 49 L 8.78 5.16 0.00 1.68 1.42 1.18 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 50 E 9.50 5.27 0.00 1.89 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 2.21 2.16 0.00 51 K 9.38 4.62 0.00 1.93 1.63 0.00 1.87 0.00 0.00 1.60 0.00 0.00 2.75 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.09 0.78 7.81 52 K 8.16 3.27 0.00 0.79 1.16 0.00 1.40 0.00 0.00 1.48 0.00 0.00 2.67 0.00 0.00 2.61 0.00 0.00 0.00 0.00 0.81 0.21 7.81 53 A 7.70 4.45 1.06 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 54 D 8.56 4.11 0.00 2.56 2.59 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 55 N 8.98 3.83 0.00 2.76 2.70 0.00 0.00 7.24 7.98 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 56 G 6.54 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 0.00 0.00 0.00 0.00 57 W 8.14 5.14 0.00 3.20 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 L 8.75 4.76 0.00 1.70 1.47 0.90 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 59 Q 8.78 4.56 0.00 2.10 1.97 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 2.28 2.49 0.00 60 L 8.77 4.28 0.00 1.24 1.27 0.61 0.87 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 61 N 7.67 4.37 0.00 2.59 2.47 0.00 0.00 6.64 7.22 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 62 T 8.30 5.07 4.18 0.00 0.00 0.00 0.00 0.00 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 63 A 8.95 4.66 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.29 5.17 0.00 1.60 1.68 0.00 1.75 0.00 0.00 1.90 0.00 0.00 2.75 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.30 1.37 7.81 65 T 8.72 4.28 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 1.26 0.00 0.00 66 D 8.93 5.10 0.00 2.88 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 67 K 8.63 4.02 0.00 1.89 2.01 0.00 1.56 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.41 1.47 7.81 68 D 8.78 4.67 0.00 2.81 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 69 G 8.56 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 70 R 7.57 5.06 0.00 1.82 1.79 0.00 2.99 0.00 0.00 3.09 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.64 0.00 71 I 8.14 4.77 1.88 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.27 0.91 0.00 0.00 72 K 8.87 3.87 0.00 1.75 1.88 0.00 1.69 0.00 0.00 1.70 0.00 0.00 2.83 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.44 1.38 7.81 73 A 7.70 4.72 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 74 L 9.08 4.32 0.00 1.55 1.87 0.86 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 75 W 8.38 4.11 0.00 3.45 3.12 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 76 P 0.00 4.41 0.00 1.97 1.92 0.00 2.26 0.00 0.00 3.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 1.46 0.00 77 E 8.25 4.47 0.00 1.98 1.99 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 2.35 2.31 0.00 78 Q 7.54 4.67 0.00 2.19 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.51 6.94 0.00 0.00 0.00 0.00 0.00 2.07 2.46 0.00 79 T 8.57 3.96 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 1.25 0.00 0.00 80 A 8.47 4.57 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.96 4.74 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 1.33 0.00 0.00 82 T 8.72 4.03 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 1.28 0.00 0.00 83 G 7.72 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 84 D 7.46 5.20 0.00 2.37 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 85 Y 8.77 5.32 0.00 1.67 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 86 R 9.09 5.02 0.00 1.23 1.20 0.00 2.62 0.00 0.00 2.28 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 1.49 0.00 87 V 8.97 4.77 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 0.75 0.00 0.00 1.03 0.00 0.00 88 V 8.34 4.52 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 0.90 0.00 0.00 0.80 0.00 0.00 89 F 8.97 4.60 0.00 2.89 2.83 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 90 K 8.73 4.18 0.00 1.81 1.77 0.00 1.66 0.00 0.00 1.72 0.00 0.00 2.91 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.52 1.55 7.81 91 T 7.79 3.94 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 1.08 0.00 0.00 92 G 8.08 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 93 D 8.12 4.44 0.00 2.74 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 94 Y 7.30 4.06 0.00 2.81 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 95 F 8.29 4.23 0.00 3.20 3.15 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 96 K 8.18 4.02 0.00 2.00 1.88 0.00 1.69 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.50 1.87 7.81 97 K 7.77 4.11 0.00 1.78 1.81 0.00 1.70 0.00 0.00 1.70 0.00 0.00 3.03 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.46 1.65 7.81 98 Q 7.65 4.33 0.00 2.12 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.77 0.00 0.00 0.00 0.00 0.00 2.01 2.11 0.00 99 N 8.18 4.32 0.00 2.89 2.92 0.00 0.00 6.68 7.46 0.00 0.00 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 L 7.78 4.84 0.00 1.76 1.43 1.10 0.99 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 0.00 101 E 8.45 4.50 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 2.27 2.30 0.00 102 S 7.77 3.98 0.00 3.45 3.65 0.00 0.00 0.00 0.00 0.00 0.00 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 F 7.65 4.28 0.00 2.55 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 0.00 0.00 0.00 104 F 7.10 4.81 0.00 3.05 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 0.00 105 P 0.00 4.43 0.00 2.22 2.30 0.00 3.76 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 1.93 0.00 106 E 7.64 5.01 0.00 2.08 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 2.18 2.31 0.00 107 I 8.87 4.35 1.55 0.00 0.00 0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.44 0.43 0.04 0.00 0.00 108 P 0.00 5.01 0.00 1.95 1.93 0.00 3.67 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.90 0.00 109 V 8.84 4.45 2.33 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 1.14 0.00 0.00 1.09 0.00 0.00 110 E 9.03 5.18 0.00 1.99 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 2.13 2.22 0.00 111 F 9.06 5.22 0.00 3.21 3.18 0.00 0.00 0.00 0.00 0.00 0.00 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 H 9.17 5.40 0.00 3.20 3.35 0.00 5.90 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 I 8.58 4.15 1.76 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.08 0.61 0.53 0.00 0.00 114 N 9.21 4.54 0.00 2.90 3.10 0.00 0.00 6.07 7.13 0.00 0.00 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 K 8.21 4.61 0.00 1.92 1.75 0.00 1.87 0.00 0.00 1.71 0.00 0.00 3.04 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.39 1.42 7.81 116 V 8.49 3.96 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 0.62 0.00 0.00 0.89 0.00 0.00 117 N 7.98 4.97 0.00 2.67 2.78 0.00 0.00 6.77 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 0.00 118 E 7.73 4.68 0.00 1.84 1.78 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 2.29 1.77 0.00 119 H 8.43 4.67 0.00 3.09 3.15 0.00 5.86 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 Y 8.83 4.47 0.00 2.90 2.65 0.00 0.00 0.00 0.00 0.00 0.00 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 H 8.74 5.27 0.00 3.22 3.10 0.00 5.80 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 V 8.46 4.35 1.95 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 0.90 0.00 0.00 0.39 0.00 0.00 123 P 0.00 4.71 0.00 1.86 1.91 0.00 3.37 0.00 0.00 3.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.54 1.13 0.00 124 L 8.59 4.51 0.00 0.63 0.82 0.50 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 125 L 8.97 4.81 0.00 1.69 1.79 1.04 0.26 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 0.00 126 L 8.94 5.16 0.00 1.59 1.59 1.03 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 127 S 8.88 5.23 0.00 4.16 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 0.00 128 Q 9.94 3.38 0.00 2.07 1.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.87 6.86 0.00 0.00 0.00 0.00 0.00 1.25 1.80 0.00 129 Y 7.64 4.48 0.00 2.87 2.84 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 0.00 130 G 8.39 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 0.00 131 Y 7.81 5.32 0.00 2.92 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 0.00 132 S 9.07 4.90 0.00 3.85 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 0.00 133 T 8.48 5.09 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 1.32 0.00 0.00 134 Y 7.36 4.69 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 0.00 135 R 8.94 4.06 0.00 1.93 1.99 0.00 3.33 0.00 0.00 3.25 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.64 0.00 136 G 8.86 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 0.00 137 S 8.68 4.54 0.00 3.92 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