NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 P 4.3316 0.0000 0.0000 61.8922 32.5891 175.8177 3 K 3.9936 8.6436 121.5875 55.5506 32.5762 175.1234 4 K 3.8554 9.3674 127.4481 57.3578 33.5355 175.0627 5 V 4.9271 8.4163 126.1888 61.3322 33.9154 174.1202 6 L 4.8992 9.4915 126.6873 53.2848 46.4978 175.1894 7 T 4.9122 7.8239 114.9288 62.3479 73.0055 174.0114 8 G 4.0717 8.2590 109.9888 46.3267 0.0000 171.7300 9 V 4.8686 7.5196 118.8843 61.0789 34.2535 176.0446 10 V 4.2445 8.3978 127.4897 62.6548 30.7797 176.4393 11 V 3.9231 8.4545 121.3616 62.2427 32.5038 176.4457 12 S 4.7097 7.8380 115.3119 56.4435 65.0365 173.5106 13 D 4.9345 8.7275 123.3443 53.6548 42.3707 176.7998 14 K 4.1496 7.7508 116.1516 59.0469 32.0359 176.4059 15 M 4.5105 7.3391 117.4381 53.6147 34.0887 175.0061 16 Q 4.3330 8.3595 118.5147 55.7053 29.7080 176.5681 17 K 4.9450 9.4550 120.7644 56.7208 30.4732 174.9151 18 T 5.2619 7.4980 113.5531 62.1170 72.4656 173.7501 19 V 4.6957 9.2507 117.0451 60.0211 36.7194 174.7352 20 T 4.8054 8.5968 119.7471 62.2462 70.1647 173.7975 21 V 4.4292 8.9301 127.9266 61.4643 33.3597 174.7251 22 L 4.5793 9.0374 131.4696 53.5128 42.3319 173.8225 23 V 4.4027 8.4483 124.7367 61.4901 32.7000 173.8855 24 E 4.8874 8.7811 129.3057 54.9697 30.9854 174.8607 25 R 4.8736 9.2449 126.7362 54.7486 33.6347 174.0000 26 Q 5.0507 8.3244 122.8453 54.5214 32.4771 173.6549 27 F 4.8515 7.9347 117.7396 55.6714 41.5659 171.1360 28 P 4.8788 0.0000 0.0000 62.7358 32.4949 175.3564 29 H 4.5771 9.3475 123.7342 55.4202 30.3306 174.3295 30 P 4.2378 0.0000 0.0000 65.1952 31.1864 176.6545 31 L 4.3454 7.9584 118.3974 55.7929 43.3279 176.1575 32 Y 4.7808 7.7545 113.7961 56.9827 38.5581 178.0021 33 G 4.0437 8.5129 107.0859 46.3593 0.0000 174.5139 34 K 4.0829 8.0149 119.5972 57.0948 33.5963 176.7275 35 V 4.2422 8.3245 122.8477 62.9147 32.5278 175.0752 36 I 4.4666 8.8312 121.3931 58.8357 41.0243 174.3064 37 K 4.4488 8.5471 126.0315 55.3609 32.9627 175.2096 38 R 4.8257 8.2795 128.0304 55.1422 33.4130 174.0483 39 S 4.9992 8.1385 114.7374 58.0682 66.0303 173.5478 40 K 4.3688 8.6644 118.1793 55.5680 35.8203 173.8297 41 K 4.9498 8.5036 125.5004 55.4554 33.6615 175.4851 42 Y 4.6509 8.9758 122.1856 56.2591 41.3584 175.1999 43 L 5.0688 8.7052 123.2912 53.4111 41.8969 175.7971 44 A 4.6078 8.9328 126.6153 51.7071 20.4963 175.6011 45 H 4.9151 9.6104 122.3811 55.6779 31.3468 173.7005 46 D 4.6959 8.9579 126.3340 51.3091 41.3170 173.8940 47 P 4.1604 0.0000 0.0000 65.2790 31.5446 177.3219 48 E 4.3288 8.1791 115.1833 55.9269 29.4509 178.3459 49 E 3.8425 7.3203 123.9009 57.8408 27.9740 178.6636 50 K 3.8599 8.2457 115.2589 57.5114 35.2047 174.0014 51 Y 4.1400 8.0799 116.5882 58.0859 38.6699 176.1949 52 K 4.7573 8.7417 124.0757 53.7596 34.8067 175.4017 53 L 4.1357 8.0083 122.7732 57.1388 41.7665 176.9439 54 G 4.0534 8.5555 113.6767 45.7777 0.0000 173.4520 55 D 4.8634 8.0978 119.7340 54.2124 42.5946 175.5219 56 V 4.6572 8.3955 120.0772 61.5060 33.7853 174.9328 57 V 4.8271 8.5416 120.4501 59.5501 36.0864 174.2807 58 E 4.9482 8.9491 121.9686 55.3786 31.1924 175.4622 59 I 4.7473 9.6224 124.7839 59.6078 40.2657 174.4936 60 I 5.2073 8.4531 125.2487 58.7823 41.1778 173.9573 61 E 3.3708 9.2816 130.7133 57.3323 29.8450 176.0667 62 S 4.7454 8.0494 121.6188 56.2793 67.4955 173.5953 63 R 3.9861 8.4604 120.7702 55.2527 30.3987 173.9958 64 P 4.1656 0.0000 0.0000 63.3584 31.7892 175.9368 65 I 4.3414 7.6599 121.1891 61.6577 39.4643 175.4064 66 S 4.5025 7.3530 111.6930 57.0664 64.8117 175.2510 67 K 3.8799 8.5834 122.2949 57.5846 32.8910 176.2369 68 R 3.6539 8.3820 123.7699 55.4646 27.9609 177.2240 69 K 4.8959 6.6865 120.1015 56.6715 34.3266 173.5476 70 R 4.9444 7.8587 126.7834 55.4436 32.3511 174.6340 71 F 5.2615 8.3003 115.7535 55.9743 43.8652 173.8548 72 R 5.1880 8.6269 119.9975 54.1281 33.8394 175.2695 73 V 3.6810 8.0400 122.5567 63.0285 31.1636 175.6427 74 L 4.3442 9.0129 131.9753 57.5847 42.7244 176.6864 75 R 4.5837 7.3267 112.1610 55.5221 32.1616 173.1113 76 L 4.7234 8.7799 122.6381 54.8698 42.4315 176.3325 77 V 4.0853 9.4503 128.4013 65.1781 32.6253 176.2646 78 E 4.7103 7.6780 116.6236 55.3047 32.4137 175.2664 79 S 5.2000 8.6429 118.2793 57.7468 63.4125 174.9754 80 G 3.5939 8.3384 107.5398 45.5888 0.0000 174.9050 81 R 5.4668 7.0229 133.1440 56.0897 30.4062 174.6203 82 M 4.2758 7.5407 126.0378 57.8798 32.3426 176.9096 83 D 4.2967 8.2131 119.7306 56.3935 39.1141 178.6591 84 L 4.1572 7.7486 119.6038 57.4428 41.9434 179.0801 85 V 3.6783 7.8020 117.5838 66.7339 31.1740 176.7433 86 E 3.9631 9.6126 118.8780 58.9441 29.1160 179.4527 87 K 4.0796 8.0215 116.5115 60.4338 32.4389 177.7000 88 Y 4.0677 8.0358 118.8842 60.6975 38.5498 177.9267 89 L 3.6839 8.6954 119.4469 58.1478 42.0095 179.8597 90 I 3.5864 7.8499 119.2636 64.4023 36.8553 178.2057 91 R 3.7992 7.6989 118.1262 59.6390 30.0843 178.3293 92 R 2.9688 7.4081 117.4111 58.9881 29.6997 178.6562 93 Q 3.9161 8.1693 119.6223 59.4346 28.6567 178.3048 94 N 4.3724 8.4009 117.4901 56.3789 38.3168 176.5928 95 Y 4.1819 8.1259 118.2801 61.1903 37.7842 179.2102 96 Q 4.1596 7.3788 117.9405 56.3585 28.4517 177.2291 97 S 4.5196 10.7700 109.6795 57.1794 67.2620 172.2982 98 L 4.0053 5.8687 133.0153 54.9719 39.6101 176.3291 99 S 4.6161 7.7767 126.0918 58.8693 66.2580 178.4140 100 K 4.4183 7.8757 114.7425 55.6582 34.3682 176.3423 101 R 4.2774 8.9164 114.3007 53.5298 32.6902 175.9662 102 G 4.3651 7.1908 109.0793 44.1267 0.0000 171.8988 103 G 4.2279 7.7712 108.9264 42.0428 0.0000 173.3424 104 K 3.7083 8.7278 123.3659 57.1309 32.6919 176.5052 105 A 4.2716 8.5110 124.2988 52.3748 18.9382 176.9487 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 2 P 0.00 4.33 0.00 2.19 2.13 0.00 3.74 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 2.00 0.00 3 K 8.64 3.99 0.00 1.74 1.92 0.00 1.76 0.00 0.00 1.90 0.00 0.00 2.80 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.41 1.48 7.81 4 K 9.37 3.86 0.00 1.94 1.85 0.00 1.47 0.00 0.00 1.60 0.00 0.00 2.88 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.50 1.47 7.81 5 V 8.42 4.93 2.06 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 0.88 0.00 0.00 1.01 0.00 0.00 6 L 9.49 4.90 0.00 0.97 1.22 0.05 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 7 T 7.82 4.91 4.19 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 1.19 0.00 0.00 8 G 8.26 4.07 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 0.00 0.00 0.00 9 V 7.52 4.87 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 0.92 0.00 0.00 0.91 0.00 0.00 10 V 8.40 4.24 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 0.91 0.00 0.00 0.91 0.00 0.00 11 V 8.45 3.92 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.30 0.00 0.00 0.09 0.00 0.00 12 S 7.84 4.71 0.00 3.84 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 13 D 8.73 4.93 0.00 2.71 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 14 K 7.75 4.15 0.00 1.92 1.87 0.00 1.76 0.00 0.00 1.72 0.00 0.00 2.94 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.50 1.44 7.81 15 M 7.34 4.51 0.00 2.06 2.17 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.50 0.00 16 Q 8.36 4.33 0.00 2.13 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.75 6.25 0.00 0.00 0.00 0.00 0.00 2.40 2.38 0.00 17 K 9.46 4.95 0.00 2.03 1.94 0.00 1.68 0.00 0.00 1.79 0.00 0.00 2.91 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.52 1.38 7.81 18 T 7.50 5.26 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 1.31 0.00 0.00 19 V 9.25 4.70 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 0.80 0.00 0.00 0.96 0.00 0.00 20 T 8.60 4.81 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 1.11 0.00 0.00 21 V 8.93 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 0.89 0.00 0.00 0.84 0.00 0.00 22 L 9.04 4.58 0.00 1.51 1.50 0.96 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 23 V 8.45 4.40 2.31 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 1.17 0.00 0.00 0.79 0.00 0.00 24 E 8.78 4.89 0.00 2.03 1.83 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 2.25 2.32 0.00 25 R 9.24 4.87 0.00 1.93 1.97 0.00 3.10 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 1.81 1.65 0.00 26 Q 8.32 5.05 0.00 2.07 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.72 0.00 0.00 0.00 0.00 0.00 2.18 2.31 0.00 27 F 7.93 4.85 0.00 3.20 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 28 P 0.00 4.88 0.00 2.18 2.15 0.00 4.07 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.05 0.00 29 H 9.35 4.58 0.00 3.22 3.26 0.00 5.60 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 P 0.00 4.24 0.00 2.15 2.15 0.00 3.43 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 1.73 1.85 0.00 31 L 7.96 4.35 0.00 1.38 1.16 0.90 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 32 Y 7.75 4.78 0.00 2.89 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 33 G 8.51 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 34 K 8.01 4.08 0.00 1.82 1.98 0.00 1.29 0.00 0.00 1.54 0.00 0.00 2.82 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.44 1.40 7.81 35 V 8.32 4.24 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 0.79 0.00 0.00 0.93 0.00 0.00 36 I 8.83 4.47 1.67 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 0.12 -0.36 0.88 0.00 0.00 37 K 8.55 4.45 0.00 1.74 1.74 0.00 1.74 0.00 0.00 2.03 0.00 0.00 2.86 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.35 1.48 7.81 38 R 8.28 4.83 0.00 2.24 2.00 0.00 3.46 0.00 0.00 3.33 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.69 0.00 39 S 8.14 5.00 0.00 4.05 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 40 K 8.66 4.37 0.00 1.74 1.57 0.00 1.46 0.00 0.00 1.42 0.00 0.00 2.13 0.00 0.00 2.57 0.00 0.00 0.00 0.00 0.40 0.96 7.81 41 K 8.50 4.95 0.00 1.60 1.65 0.00 1.64 0.00 0.00 1.71 0.00 0.00 2.76 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.23 1.43 7.81 42 Y 8.98 4.65 0.00 2.73 2.71 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 0.00 0.00 0.00 0.00 43 L 8.71 5.07 0.00 1.60 1.70 0.95 0.83 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 44 A 8.93 4.61 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 45 H 9.61 4.92 0.00 3.25 3.24 0.00 5.72 0.00 0.00 0.00 0.00 6.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 D 8.96 4.70 0.00 2.87 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 47 P 0.00 4.16 0.00 2.06 2.12 0.00 3.70 0.00 0.00 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.78 0.00 48 E 8.18 4.33 0.00 1.97 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 2.36 2.32 0.00 49 E 7.32 3.84 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 2.20 2.22 0.00 50 K 8.25 3.86 0.00 1.36 1.61 0.00 1.68 0.00 0.00 1.14 0.00 0.00 2.60 0.00 0.00 2.76 0.00 0.00 0.00 0.00 0.31 1.06 7.81 51 Y 8.08 4.14 0.00 3.10 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 52 K 8.74 4.76 0.00 1.82 1.70 0.00 1.68 0.00 0.00 1.57 0.00 0.00 2.83 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.36 1.52 7.81 53 L 8.01 4.14 0.00 1.54 1.64 0.99 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 54 G 8.56 4.05 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 0.00 0.00 0.00 55 D 8.10 4.86 0.00 2.66 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 56 V 8.40 4.66 2.25 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 1.01 0.00 0.00 0.93 0.00 0.00 57 V 8.54 4.83 1.84 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 0.60 0.00 0.00 0.74 0.00 0.00 58 E 8.95 4.95 0.00 1.84 1.80 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 2.22 2.24 0.00 59 I 9.62 4.75 1.51 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 0.91 0.96 0.17 0.00 0.00 60 I 8.45 5.21 1.89 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 1.77 0.97 0.00 0.00 61 E 9.28 3.37 0.00 2.13 1.84 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 2.15 1.97 0.00 62 S 8.05 4.75 0.00 3.63 3.67 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 0.00 0.00 0.00 63 R 8.46 3.99 0.00 1.73 1.78 0.00 3.25 0.00 0.00 3.20 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.62 0.00 64 P 0.00 4.17 0.00 2.04 1.99 0.00 3.62 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.10 0.00 65 I 7.66 4.34 1.81 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.72 0.69 0.00 0.00 66 S 7.35 4.50 0.00 3.91 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 67 K 8.58 3.88 0.00 1.74 1.76 0.00 1.93 0.00 0.00 1.64 0.00 0.00 2.77 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.43 1.43 7.81 68 R 8.38 3.65 0.00 1.96 1.93 0.00 3.44 0.00 0.00 3.16 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.68 0.00 69 K 6.69 4.90 0.00 1.87 1.87 0.00 1.76 0.00 0.00 1.83 0.00 0.00 2.98 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.28 1.57 7.81 70 R 7.86 4.94 0.00 1.65 1.43 0.00 3.16 0.00 0.00 3.35 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.58 0.00 71 F 8.30 5.26 0.00 2.92 2.79 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 72 R 8.63 5.19 0.00 1.79 1.82 0.00 3.17 0.00 0.00 3.12 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.55 0.00 73 V 8.04 3.68 1.50 0.00 0.00 0.00 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 0.76 0.00 0.00 74 L 9.01 4.34 0.00 1.64 1.81 0.92 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 75 R 7.33 4.58 0.00 1.92 2.00 0.00 3.03 0.00 0.00 3.28 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.51 0.00 76 L 8.78 4.72 0.00 1.97 1.72 0.97 0.99 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 77 V 9.45 4.09 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 0.82 0.00 0.00 0.93 0.00 0.00 78 E 7.68 4.71 0.00 2.05 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 2.27 2.29 0.00 79 S 8.64 5.20 0.00 3.87 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 80 G 8.34 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 0.00 0.00 0.00 81 R 7.02 5.47 0.00 2.24 2.13 0.00 2.97 0.00 0.00 3.17 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.34 0.00 82 M 7.54 4.28 0.00 2.06 2.16 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.55 0.00 83 D 8.21 4.30 0.00 2.87 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 84 L 7.75 4.16 0.00 1.83 1.74 0.92 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 85 V 7.80 3.68 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 1.22 0.00 0.00 0.93 0.00 0.00 86 E 9.61 3.96 0.00 2.07 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 2.48 2.52 0.00 87 K 8.02 4.08 0.00 2.07 1.90 0.00 1.71 0.00 0.00 1.59 0.00 0.00 2.92 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.49 1.67 7.81 88 Y 8.04 4.07 0.00 3.02 3.14 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 0.00 0.00 0.00 0.00 89 L 8.70 3.68 0.00 1.83 1.69 0.96 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 90 I 7.85 3.59 1.83 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.78 0.89 0.00 0.00 91 R 7.70 3.80 0.00 1.93 1.75 0.00 3.25 0.00 0.00 3.31 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.70 0.00 92 R 7.41 2.97 0.00 1.48 1.60 0.00 2.99 0.00 0.00 2.89 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.81 0.00 93 Q 8.17 3.92 0.00 2.11 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.80 0.00 0.00 0.00 0.00 0.00 2.55 2.38 0.00 94 N 8.40 4.37 0.00 3.08 2.94 0.00 0.00 6.98 7.59 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 95 Y 8.13 4.18 0.00 3.20 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 96 Q 7.38 4.16 0.00 2.02 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.77 0.00 0.00 0.00 0.00 0.00 2.39 2.48 0.00 97 S 10.77 4.52 0.00 4.13 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 98 L 5.87 4.01 0.00 1.71 1.75 0.80 0.83 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 99 S 7.78 4.62 0.00 3.92 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 0.00 100 K 7.88 4.42 0.00 1.69 1.82 0.00 1.66 0.00 0.00 1.70 0.00 0.00 2.83 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.35 1.37 7.81 101 R 8.92 4.28 0.00 1.77 1.76 0.00 3.43 0.00 0.00 3.23 7.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.53 0.00 102 G 7.19 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 0.00 0.00 0.00 0.00 103 G 7.77 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 0.00 0.00 0.00 0.00 104 K 8.73 3.71 0.00 1.75 1.81 0.00 1.76 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.46 1.43 7.81 105 A 8.51 4.27 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