NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1C H 4.7868 8.4449 117.8360 56.2519 29.9898 172.8893 1D H 4.5607 8.6813 117.9434 55.7368 29.7456 172.8414 1E H 5.0991 7.5895 115.4278 53.6197 33.5958 171.8682 1F H 4.6664 8.8838 116.7900 55.8936 29.0508 174.4257 1G F 4.8629 8.4603 119.6360 57.7894 39.9589 174.3569 2 N 4.6668 8.4895 117.4195 52.2496 39.0775 174.4752 3 L 4.7726 8.0655 123.4925 51.9690 43.8968 174.7946 4 P 4.4556 0.0000 0.0000 61.7254 32.1228 174.2201 5 P 4.3661 0.0000 0.0000 62.3029 32.3501 175.4978 6 G 3.8584 9.4147 104.7643 45.0067 0.0000 171.3441 7 N 4.2795 7.7429 113.7622 51.9644 39.8458 174.1585 8 Y 4.8812 7.9008 115.9669 58.1612 38.6190 176.7879 9 K 4.0796 8.3465 122.3674 58.8167 32.2582 177.3279 10 K 4.7235 7.6027 115.1557 53.2633 35.2550 173.7804 11 P 4.8015 0.0000 0.0000 63.3853 32.4412 174.7695 12 K 4.6887 9.2561 119.1110 56.4009 36.5565 174.1006 13 L 5.1416 9.2864 119.5634 52.9876 45.1304 175.9809 14 L 5.1197 8.6568 121.6170 53.4360 44.1276 174.5364 15 Y 4.9933 9.5369 126.7472 56.1329 40.9293 173.7374 16 C 3.8576 8.3614 128.5893 57.7082 32.2480 174.7737 17 S 3.8680 7.8670 121.4910 60.8544 63.0193 174.9429 18 N 4.0790 7.7591 119.1204 56.2107 38.3685 175.2992 19 G 3.8849 7.5263 102.4517 44.3790 0.0000 172.2513 20 G 3.3420 7.4299 106.3274 44.8788 0.0000 173.4203 21 H 4.9852 7.0697 114.3648 53.5531 32.8635 174.2928 22 F 5.2735 9.0926 120.8747 56.3237 40.4438 175.1516 23 L 4.5887 9.2432 126.0431 55.3593 43.1822 175.6469 24 R 4.9010 9.3490 126.1646 54.6123 33.8278 173.9514 25 I 4.6074 8.2000 125.9739 59.4024 39.1459 175.6588 26 L 4.0786 8.7311 127.9096 53.4019 42.3587 176.7036 27 P 4.2119 0.0000 0.0000 66.0304 31.2442 177.2531 28 D 4.4894 7.9455 113.9019 53.7969 39.7235 177.0066 29 G 4.0096 8.7989 110.2170 45.2597 0.0000 173.7485 30 T 4.3234 8.0573 114.9146 61.6629 68.0408 173.0860 31 V 4.8382 7.9853 126.2580 61.2014 34.1585 174.4361 32 D 4.6284 8.4979 124.9856 52.9765 42.5481 174.0497 33 G 4.6393 8.5851 104.7288 45.4109 0.0000 172.5289 34 T 5.0065 8.7789 114.4890 60.7194 70.9519 174.7202 35 R 4.3181 8.8919 124.8505 57.0025 31.0402 176.3143 36 D 4.5536 8.2742 118.9480 53.5447 40.2234 176.5682 37 R 3.5975 8.5716 127.7318 57.9977 30.2826 177.0441 38 S 4.4202 8.1203 110.7066 58.3519 64.0967 173.9834 39 D 4.3260 7.8259 122.5300 55.1529 41.1348 176.7560 40 Q 4.5227 8.5328 123.4177 56.9598 29.3351 176.0578 41 H 4.8887 9.3652 116.0883 55.4524 29.0245 175.5381 42 I 4.5694 7.0091 110.8129 60.1019 38.4875 175.6148 43 Q 4.1791 7.8999 121.9891 55.9885 29.6319 174.8929 44 L 4.9894 9.0876 124.6602 52.7726 45.6397 175.4657 45 Q 4.8344 9.2655 124.4640 54.4493 30.9774 174.5154 46 L 5.4142 8.8241 126.5760 53.4827 43.3842 176.3657 47 S 4.6791 8.1751 114.3821 56.9608 66.6123 172.5915 48 A 5.1203 8.4994 122.6548 51.2834 20.5318 175.0220 49 E 4.1218 8.9907 119.2031 55.9128 30.8814 177.6576 50 S 4.6928 6.3654 113.1531 56.3023 65.7761 173.8618 51 V 3.8341 8.2021 121.2873 64.8641 31.5845 176.2757 52 G 3.9477 9.1794 114.2855 45.3762 0.0000 171.9391 53 E 5.2490 8.2182 119.6590 54.6084 32.3342 175.6095 54 V 4.8114 8.8030 115.9449 59.9492 36.9544 173.7892 55 Y 5.2181 8.8575 119.6517 56.4237 41.3772 175.2741 56 I 4.3726 8.6113 122.8677 59.6385 40.0096 174.0565 57 K 4.6534 8.6227 129.1609 54.0946 34.8560 175.1243 58 S 4.4299 8.7616 123.1789 58.3973 62.5794 174.8930 59 T 3.7795 8.4727 118.9335 64.7944 68.7958 176.0385 60 E 4.0208 8.3615 122.4532 58.9014 29.8585 177.3071 61 T 4.1943 7.9146 106.3764 61.1477 69.7738 175.8734 62 G 3.7653 8.2247 109.6987 45.3200 0.0000 173.5576 63 Q 4.4185 7.5634 118.4749 55.8171 30.3805 174.5011 64 Y 4.8023 8.9331 118.7007 55.9254 41.1389 175.2864 65 L 4.4128 8.9854 125.3262 55.3470 43.4433 175.6137 66 A 5.1502 8.5922 125.8060 50.7503 23.1722 174.4436 67 M 5.3558 8.7082 119.9385 53.8806 34.8792 175.6575 68 D 5.2517 9.5605 126.0279 51.6317 41.2234 177.0591 69 T 4.3191 8.5605 108.4913 64.0471 68.5571 174.3936 70 D 4.6268 8.4466 121.1004 54.0079 41.4525 177.2081 71 G 3.1963 8.7021 108.7261 45.1805 0.0000 172.9400 72 L 4.7354 7.6621 119.4169 53.1397 43.0730 175.9191 73 L 5.0759 8.3366 122.7990 55.1394 42.8439 175.5224 74 Y 4.7945 8.7903 119.0713 56.1415 41.9145 173.4280 75 G 4.1037 9.1393 109.0968 45.5347 0.0000 173.2387 76 S 5.0039 9.1956 121.8142 56.9340 63.8318 175.3571 77 Q 4.4573 9.0262 125.1852 58.1019 28.9606 176.4099 78 T 4.7067 7.6125 106.4720 59.0533 71.9512 172.7979 79 P 3.8472 0.0000 0.0000 61.1971 29.9508 174.6510 80 N 4.7922 7.3418 121.8441 51.8452 40.2676 176.1084 81 E 3.8681 8.6982 115.0226 59.5762 29.2470 177.5368 82 E 4.1715 8.8982 118.0393 57.3343 29.7856 177.1789 83 C 5.0428 7.8095 115.2996 58.7157 29.1528 173.3319 84 L 4.2219 7.2772 121.4959 53.6888 42.5431 175.6903 85 F 5.1701 8.9128 122.3966 55.5012 43.2482 174.6522 86 L 4.7681 9.3724 123.1916 53.8065 42.6280 175.5212 87 E 4.5823 8.7722 126.7938 55.2966 30.1879 175.7346 88 R 4.8464 8.6110 125.4783 53.9882 34.6947 174.7260 89 L 4.6834 8.8277 123.9447 55.2793 43.1477 175.8450 90 E 4.7113 9.1904 124.9395 55.2367 33.6228 174.8931 91 E 4.0301 9.6713 123.7123 58.0511 27.3094 174.1198 92 N 4.3107 8.4714 110.2665 54.0328 36.6736 174.1706 93 H 4.8254 8.4431 116.4736 57.6351 37.7809 173.5296 94 Y 4.6933 7.7932 116.0981 57.6517 39.9553 173.4692 95 N 5.6362 9.7492 117.9960 51.9038 41.4557 174.4996 96 T 5.1559 8.7873 112.4811 60.1666 72.8714 172.7475 97 Y 4.9998 8.6582 119.1308 56.6716 41.4582 174.0992 98 I 4.6418 8.4975 126.0014 59.1268 39.5884 175.5754 99 S 4.1505 8.7017 122.0974 58.6164 62.4137 174.0183 100 K 3.9744 8.8515 129.3952 59.4014 32.2770 178.7013 101 K 3.7759 7.9151 118.1395 59.0908 32.2031 176.7382 102 H 4.7042 8.1311 114.9974 55.0551 29.4489 176.3336 103 A 3.9387 7.7262 126.0839 55.2618 18.2833 180.8720 104 E 3.7486 7.8546 112.2885 58.6005 29.7708 177.7861 105 K 3.9707 7.6415 117.3631 55.7926 32.6905 175.8983 106 N 3.9794 7.4693 115.4471 53.9508 36.4884 174.5058 107 W 5.0799 7.7318 117.6372 55.8599 31.0003 177.0421 108 F 5.4774 9.3105 123.9254 55.5670 41.4469 175.4474 109 V 4.0718 8.9608 122.3612 62.7776 31.9795 175.5331 110 G 4.4625 8.6532 113.0222 45.5281 0.0000 171.4230 111 L 5.3270 7.9599 119.5280 52.5064 45.4867 177.2788 112 K 4.2506 9.2148 122.6476 55.5128 33.0284 178.3295 113 K 4.0454 8.3455 118.6908 58.8955 31.9587 177.9803 114 N 4.5566 8.0018 114.2877 52.7322 38.0084 175.8166 115 G 3.5786 7.8599 108.8719 44.8800 0.0000 173.6907 116 S 4.7752 8.5576 115.8035 57.7627 64.5137 173.8425 117 C 4.7996 8.5587 117.0843 58.4374 30.2974 173.2323 118 K 4.4262 8.7559 120.9742 55.7538 33.3699 176.6001 119 R 4.4155 8.3048 120.9607 54.7342 31.7120 177.6748 120 G 3.3120 8.4212 112.6303 48.2504 0.0000 174.1186 121 P 4.2969 0.0000 0.0000 64.4265 31.3447 177.2776 122 R 4.4496 7.9644 115.8379 55.9259 30.3814 175.9585 123 T 5.2569 7.6799 108.5397 59.5927 71.0871 173.2576 124 H 4.6590 7.8250 115.0837 55.0367 30.3509 173.2593 125 Y 3.8510 8.6824 118.4300 59.9263 38.1156 177.0968 126 G 4.0388 8.9631 111.2828 45.4928 0.0000 174.0444 127 Q 4.1550 7.3123 118.7185 55.3811 29.6957 177.0942 128 K 3.7909 8.2509 118.8056 58.5531 33.0280 179.4134 129 A 3.8380 7.7514 121.6907 54.4751 18.3310 178.4099 130 I 4.3454 7.2311 106.6055 61.0816 38.4001 175.2935 131 L 4.3011 7.3033 123.3867 53.8660 42.6273 175.8441 132 W 5.2510 9.2476 123.7141 54.7860 33.2696 174.5120 133 L 5.2847 9.3307 124.1371 52.7326 44.6702 173.9344 134 P 5.1977 0.0000 0.0000 63.0930 32.4455 175.5881 135 L 5.0697 9.1875 121.4373 52.2719 46.4946 174.1045 136 P 4.6547 0.0000 0.0000 62.5736 32.3820 176.7857 137 V 3.7289 8.2060 113.5002 61.8769 31.4920 176.2340 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 1C H 8.44 4.79 0.00 3.10 3.44 0.00 5.66 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1D H 8.68 4.56 0.00 3.19 3.21 0.00 5.64 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 1E H 7.59 5.10 0.00 3.16 3.33 0.00 5.70 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 1F H 8.88 4.67 0.00 3.33 3.40 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 1G F 8.46 4.86 0.00 2.95 3.11 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 2 N 8.49 4.67 0.00 2.96 2.79 0.00 0.00 6.88 6.74 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 3 L 8.07 4.77 0.00 1.48 1.43 0.65 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 4 P 0.00 4.46 0.00 2.17 2.14 0.00 3.70 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 1.99 1.93 0.00 5 P 0.00 4.37 0.00 2.17 2.08 0.00 3.71 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.94 0.00 6 G 9.41 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 0.00 0.00 0.00 7 N 7.74 4.28 0.00 2.55 2.60 0.00 0.00 5.82 7.55 0.00 0.00 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 Y 7.90 4.88 0.00 3.04 3.11 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 9 K 8.35 4.08 0.00 1.88 1.91 0.00 1.63 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.50 1.50 7.81 10 K 7.60 4.72 0.00 1.72 1.69 0.00 1.76 0.00 0.00 1.76 0.00 0.00 3.05 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.33 1.39 7.81 11 P 0.00 4.80 0.00 2.06 2.06 0.00 3.79 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.96 0.00 12 K 9.26 4.69 0.00 2.00 1.99 0.00 1.35 0.00 0.00 1.76 0.00 0.00 2.95 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.37 1.50 7.81 13 L 9.29 5.14 0.00 1.73 1.77 0.58 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 14 L 8.66 5.12 0.00 1.41 1.44 0.17 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 15 Y 9.54 4.99 0.00 3.15 3.11 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 16 C 8.36 3.86 0.00 1.23 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 0.00 0.00 0.00 0.00 17 S 7.87 3.87 0.00 3.86 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 18 N 7.76 4.08 0.00 2.51 2.70 0.00 0.00 6.72 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 19 G 7.53 3.88 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 0.00 0.00 0.00 20 G 7.43 3.34 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 21 H 7.07 4.99 0.00 2.98 3.25 0.00 5.81 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 22 F 9.09 5.27 0.00 3.20 3.10 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 23 L 9.24 4.59 0.00 1.63 1.44 0.96 0.02 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 24 R 9.35 4.90 0.00 1.94 2.05 0.00 3.25 0.00 0.00 3.34 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.72 0.00 25 I 8.20 4.61 1.83 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.73 0.87 0.00 0.00 26 L 8.73 4.08 0.00 1.80 1.51 0.92 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 27 P 0.00 4.21 0.00 1.99 2.13 0.00 3.52 0.00 0.00 3.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 2.00 0.00 28 D 7.95 4.49 0.00 2.79 2.77 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 29 G 8.80 4.01 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 0.00 0.00 0.00 30 T 8.06 4.32 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 1.31 0.00 0.00 31 V 7.99 4.84 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 0.91 0.00 0.00 0.94 0.00 0.00 32 D 8.50 4.63 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 33 G 8.59 4.64 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 0.00 0.00 0.00 34 T 8.78 5.01 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 1.37 0.00 0.00 35 R 8.89 4.32 0.00 1.91 2.04 0.00 3.24 0.00 0.00 3.12 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.59 0.00 36 D 8.27 4.55 0.00 2.83 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 37 R 8.57 3.60 0.00 1.81 1.86 0.00 3.27 0.00 0.00 3.19 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.86 0.00 38 S 8.12 4.42 0.00 3.99 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 39 D 7.83 4.33 0.00 2.86 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 40 Q 8.53 4.52 0.00 1.88 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 7.11 0.00 0.00 0.00 0.00 0.00 2.30 2.21 0.00 41 H 9.37 4.89 0.00 3.32 3.44 0.00 5.78 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 42 I 7.01 4.57 1.92 0.00 0.00 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 1.52 1.19 1.04 0.00 0.00 43 Q 7.90 4.18 0.00 2.03 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.88 0.00 0.00 0.00 0.00 0.00 2.40 2.40 0.00 44 L 9.09 4.99 0.00 1.57 1.42 0.76 0.44 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 45 Q 9.27 4.83 0.00 2.08 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.86 0.00 0.00 0.00 0.00 0.00 2.24 2.36 0.00 46 L 8.82 5.41 0.00 1.66 1.22 0.87 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 47 S 8.18 4.68 0.00 3.92 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 48 A 8.50 5.12 1.35 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 0.00 0.00 49 E 8.99 4.12 0.00 1.66 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 2.15 2.35 0.00 50 S 6.37 4.69 0.00 4.14 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 51 V 8.20 3.83 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 0.94 0.00 0.00 1.03 0.00 0.00 52 G 9.18 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 53 E 8.22 5.25 0.00 2.03 1.67 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 2.20 2.28 0.00 54 V 8.80 4.81 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 0.47 0.00 0.00 1.11 0.00 0.00 55 Y 8.86 5.22 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 56 I 8.61 4.37 1.67 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.55 0.63 0.00 0.00 57 K 8.62 4.65 0.00 1.45 1.52 0.00 1.17 0.00 0.00 1.14 0.00 0.00 2.66 0.00 0.00 2.72 0.00 0.00 0.00 0.00 0.87 0.21 7.81 58 S 8.76 4.43 0.00 3.82 3.73 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 59 T 8.47 3.78 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 60 E 8.36 4.02 0.00 1.98 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 2.16 2.36 0.00 61 T 7.91 4.19 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 1.23 0.00 0.00 62 G 8.22 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 Q 7.56 4.42 0.00 2.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.85 6.70 0.00 0.00 0.00 0.00 0.00 2.37 2.30 0.00 64 Y 8.93 4.80 0.00 2.86 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 65 L 8.99 4.41 0.00 1.58 1.45 0.77 0.25 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 66 A 8.59 5.15 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 M 8.71 5.36 0.00 2.26 2.26 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.68 0.00 68 D 9.56 5.25 0.00 2.99 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 69 T 8.56 4.32 4.37 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 1.34 0.00 0.00 70 D 8.45 4.63 0.00 2.82 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 71 G 8.70 3.20 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 0.00 72 L 7.66 4.74 0.00 2.03 1.62 0.89 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 73 L 8.34 5.08 0.00 1.58 1.62 0.94 0.86 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 74 Y 8.79 4.79 0.00 3.00 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 75 G 9.14 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 0.00 0.00 0.00 76 S 9.20 5.00 0.00 3.72 3.81 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 77 Q 9.03 4.46 0.00 2.14 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.54 0.00 0.00 0.00 0.00 0.00 2.44 2.34 0.00 78 T 7.61 4.71 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 1.22 0.00 0.00 79 P 0.00 3.85 0.00 0.71 0.49 0.00 3.48 0.00 0.00 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.28 0.00 80 N 7.34 4.79 0.00 2.95 2.99 0.00 0.00 5.84 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 81 E 8.70 3.87 0.00 2.04 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 2.27 2.33 0.00 82 E 8.90 4.17 0.00 2.19 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 0.00 2.37 2.46 0.00 83 C 7.81 5.04 0.00 3.19 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 84 L 7.28 4.22 0.00 1.33 1.30 0.77 0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 85 F 8.91 5.17 0.00 3.08 3.11 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 86 L 9.37 4.77 0.00 1.50 1.60 0.89 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 87 E 8.77 4.58 0.00 2.17 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 2.19 1.91 0.00 88 R 8.61 4.85 0.00 1.77 1.87 0.00 3.20 0.00 0.00 2.87 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.60 0.00 89 L 8.83 4.68 0.00 1.57 1.61 1.03 0.86 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 90 E 9.19 4.71 0.00 2.21 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 2.30 2.43 0.00 91 E 9.67 4.03 0.00 2.42 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 0.00 2.30 2.39 0.00 92 N 8.47 4.31 0.00 2.83 2.88 0.00 0.00 6.88 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 93 H 8.44 4.83 0.00 2.86 2.93 0.00 5.94 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 Y 7.79 4.69 0.00 2.99 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 95 N 9.75 5.64 0.00 2.98 2.47 0.00 0.00 6.96 7.00 0.00 0.00 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 T 8.79 5.16 4.59 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 1.39 0.00 0.00 97 Y 8.66 5.00 0.00 2.78 2.72 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 98 I 8.50 4.64 1.67 0.00 0.00 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.68 0.62 0.00 0.00 99 S 8.70 4.15 0.00 4.10 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 0.00 100 K 8.85 3.97 0.00 1.70 1.64 0.00 1.69 0.00 0.00 1.46 0.00 0.00 2.80 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.34 1.31 7.81 101 K 7.92 3.78 0.00 1.73 1.62 0.00 1.72 0.00 0.00 1.63 0.00 0.00 2.99 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.03 1.31 7.81 102 H 8.13 4.70 0.00 3.13 2.40 0.00 5.69 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 A 7.73 3.94 1.37 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 0.00 0.00 104 E 7.85 3.75 0.00 1.76 1.76 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 2.06 2.11 0.00 105 K 7.64 3.97 0.00 0.79 1.13 0.00 0.61 0.00 0.00 0.67 0.00 0.00 2.57 0.00 0.00 2.64 0.00 0.00 0.00 0.00 1.04 0.87 7.81 106 N 7.47 3.98 0.00 3.05 3.12 0.00 0.00 6.91 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 0.00 107 W 7.73 5.08 0.00 3.26 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 0.00 108 F 9.31 5.48 0.00 2.84 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 0.00 109 V 8.96 4.07 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 0.51 0.00 0.00 0.49 0.00 0.00 110 G 8.65 4.46 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 L 7.96 5.33 0.00 1.30 1.42 1.09 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 112 K 9.21 4.25 0.00 1.96 1.69 0.00 1.62 0.00 0.00 1.60 0.00 0.00 2.88 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.40 1.46 7.81 113 K 8.35 4.05 0.00 1.69 1.83 0.00 1.68 0.00 0.00 1.70 0.00 0.00 2.95 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.53 1.42 7.81 114 N 8.00 4.56 0.00 2.78 2.89 0.00 0.00 6.33 7.00 0.00 0.00 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 G 7.86 3.58 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 0.00 0.00 0.00 116 S 8.56 4.78 0.00 3.85 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 0.00 117 C 8.56 4.80 0.00 3.03 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 0.00 118 K 8.76 4.43 0.00 1.61 1.74 0.00 1.60 0.00 0.00 1.63 0.00 0.00 3.02 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.39 1.36 7.81 119 R 8.30 4.42 0.00 1.73 1.60 0.00 3.06 0.00 0.00 3.28 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.54 0.00 120 G 8.42 3.31 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 P 0.00 4.30 0.00 1.93 2.19 0.00 3.06 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 1.70 1.70 0.00 122 R 7.96 4.45 0.00 1.83 1.92 0.00 3.28 0.00 0.00 3.28 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.64 0.00 123 T 7.68 5.26 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 1.39 0.00 0.00 124 H 7.83 4.66 0.00 3.43 3.51 0.00 5.67 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 Y 8.68 3.85 0.00 3.13 2.95 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 0.00 126 G 8.96 4.04 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 0.00 0.00 0.00 127 Q 7.31 4.16 0.00 1.78 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.71 0.00 0.00 0.00 0.00 0.00 2.12 1.90 0.00 128 K 8.25 3.79 0.00 1.61 1.62 0.00 1.50 0.00 0.00 1.60 0.00 0.00 2.81 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.37 1.25 7.81 129 A 7.75 3.84 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 0.00 130 I 7.23 4.35 1.72 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 1.28 0.43 0.59 0.00 0.00 131 L 7.30 4.30 0.00 1.13 0.69 0.31 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 132 W 9.25 5.25 0.00 3.68 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 0.00 133 L 9.33 5.28 0.00 2.03 1.81 0.88 1.19 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 0.00 134 P 0.00 5.20 0.00 2.22 2.19 0.00 3.89 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.10 0.00 135 L 9.19 5.07 0.00 1.73 1.61 0.96 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 136 P 0.00 4.65 0.00 2.07 2.06 0.00 3.80 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.00 0.00 137 V 8.21 3.73 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 0.66 0.00 0.00 0.91 0.00 0.00