NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 V 3.9827 8.0549 114.0551 59.9801 33.0142 174.9023 3 P 3.0498 0.0000 0.0000 61.9461 31.5060 175.6590 4 D 4.4249 8.6628 122.3063 52.7426 42.1441 176.7992 5 W 4.4849 8.3303 128.0411 59.2787 29.1619 177.8596 6 E 4.0355 8.4374 119.8340 59.2963 29.0724 178.6975 7 E 4.0072 8.3355 118.1673 59.3695 29.6612 179.3147 8 V 3.7002 7.8128 118.2421 66.1609 31.6480 178.1407 9 L 4.3795 8.8083 118.9579 57.2343 41.3990 179.7829 10 G 3.6542 7.9754 105.8819 47.7390 0.0000 175.8244 11 L 4.0303 8.0401 121.7701 57.1822 41.6826 179.3523 12 W 4.0638 8.4359 128.2709 60.7523 30.4640 178.2836 13 R 4.1821 8.5985 116.8890 58.8271 29.5469 177.9151 14 A 4.4133 7.7178 118.1256 51.4953 18.6770 177.6949 15 G 3.0665 7.4428 105.4945 46.8730 0.0000 176.4579 16 R 4.2236 7.4488 120.3759 54.8115 26.7525 176.6521 17 Y 4.2039 6.8611 120.2882 61.4161 38.5588 177.9646 18 Y 4.3707 8.0666 119.9480 60.5948 38.8517 177.3450 19 E 3.9454 8.2536 120.1098 59.0615 29.8913 178.6625 20 V 3.7362 7.9629 118.4272 66.2770 31.4754 177.4220 21 H 4.2223 8.3511 117.5411 59.4743 29.5583 176.8537 22 E 3.9613 8.2152 119.6790 59.3470 29.5322 178.6563 23 V 3.8098 8.1353 117.7920 65.6373 31.9283 177.4303 24 L 4.5649 8.1245 117.8480 56.2103 41.6793 178.3914 25 E 4.1540 8.0337 120.2848 59.2206 29.6931 177.1089 26 P 4.2298 0.0000 0.0000 65.6758 31.2843 178.2963 27 Y 4.1169 7.7284 115.2125 60.7318 37.7275 177.8085 28 W 4.2962 8.3916 128.2528 60.5660 30.8875 177.7234 29 L 3.5891 8.1959 118.0667 56.9282 41.1114 178.7083 30 K 4.2409 7.3738 114.6115 55.7436 32.7932 176.7704 31 A 4.3363 6.7654 121.8184 51.8333 19.4925 176.0974 32 T 4.6588 7.8374 112.5961 60.4504 72.1212 177.0264 33 G 3.8533 8.2921 114.1665 46.0370 0.0000 175.5110 34 E 3.9622 8.9532 122.3504 59.2342 29.0563 178.2457 35 E 4.0118 8.1528 118.0653 59.4759 29.6264 179.2569 36 R 4.0342 7.9930 118.7667 59.4164 30.0528 178.8138 37 R 3.9734 8.1434 117.9809 59.0498 30.0780 178.6644 38 L 3.7139 8.1114 120.2920 58.1631 42.0607 178.9920 39 L 4.2197 8.2375 118.9108 58.1044 41.5714 179.4313 40 Q 3.8347 8.5772 119.5783 58.7766 28.9154 178.4816 41 G 3.4666 8.2915 107.2012 47.7537 0.0000 175.9191 42 V 3.6768 7.9255 121.0935 65.6456 31.4627 178.0870 43 I 3.7151 7.9883 119.6681 64.5356 36.9565 178.4786 44 L 3.9550 8.1363 119.7953 57.4226 41.3957 179.6447 45 L 4.0396 8.1232 119.0897 57.6539 41.6420 179.2007 46 A 3.7956 8.4740 120.6185 55.1853 18.3175 179.4878 47 A 3.8768 8.3699 119.3709 55.1179 18.3726 179.7271 48 A 3.8301 7.9244 119.2017 55.4227 18.5749 179.9627 49 L 3.6384 7.4808 117.3757 57.7482 40.8879 179.2925 50 H 4.1487 8.0485 118.3160 59.3372 29.7566 177.2936 51 Q 3.8636 8.0817 119.9543 59.1545 28.5394 179.2485 52 R 4.2086 7.8207 120.1630 58.5933 29.8006 179.2914 53 R 3.9926 7.6073 117.0880 58.3907 30.0497 177.8795 54 L 4.4739 7.1437 116.0215 53.8051 41.8014 176.8231 55 G 3.8542 7.9301 106.7320 46.4734 0.0000 173.9657 56 R 4.6655 7.7350 117.6483 52.7507 32.9530 173.9761 57 P 4.3041 0.0000 0.0000 63.2846 31.8661 177.2792 58 G 4.0177 8.4194 106.9518 44.6623 0.0000 175.3216 59 L 4.0242 7.8218 120.9712 57.5522 41.6251 179.1556 60 R 3.8563 7.8739 118.4505 59.4793 30.0467 178.1684 61 N 4.3097 8.0309 115.8113 56.1454 38.5244 176.9322 62 L 3.9242 8.0225 121.7756 58.1145 42.1871 178.9622 63 R 4.0321 8.2712 118.8984 59.5345 30.1433 178.6814 64 K 3.9770 8.1847 118.0020 59.2500 31.9593 179.2161 65 A 3.9485 8.3122 121.4369 55.2688 18.3392 179.5146 66 E 3.8739 8.5401 117.2078 59.4959 29.2791 179.4448 67 A 3.9971 7.8178 119.9038 55.2563 18.4812 179.6150 68 R 3.9989 7.5625 115.4304 59.1281 30.5270 178.7701 69 L 3.6675 7.9570 118.3414 55.1408 41.4693 176.6437 70 E 4.0601 7.4166 120.2524 57.9635 29.6263 177.1040 71 G 4.0246 9.0985 114.4809 45.2628 0.0000 173.2606 72 L 4.2966 7.4918 119.6468 53.4582 42.3286 175.1808 73 P 4.6865 0.0000 0.0000 62.8100 32.2612 175.2803 74 C 4.7265 8.1870 118.6071 56.9447 34.2195 172.1192 75 P 4.5808 0.0000 0.0000 62.6508 32.7636 176.0341 76 L 4.5956 8.3883 117.8437 54.0840 41.9706 176.6886 *78 G 3.9466 7.7857 104.3428 44.7690 0.0000 170.7491 79 L 4.2620 7.6850 121.9950 52.6962 43.7445 175.6415 80 D 4.7226 8.0137 125.9583 52.7026 39.2487 176.4569 81 W 4.1206 7.7346 122.1721 58.7049 28.5800 178.4032 82 R 3.4830 6.7180 118.8060 59.0215 29.2932 178.6751 83 S 3.9531 7.6688 112.9289 61.1434 62.3115 175.9486 84 L 3.6311 7.3433 121.9040 57.9418 41.6862 178.7220 85 L 3.9897 8.4128 120.7960 58.0597 42.0484 178.6449 86 Q 3.9370 8.2023 119.6355 59.1176 28.9022 177.9808 87 E 3.9460 8.4517 120.2051 59.2179 29.7712 178.4525 88 A 4.1551 8.3479 120.9889 55.4189 18.3916 179.6791 89 R 3.9072 8.3053 116.6825 59.6149 30.1667 179.5533 90 R 3.9345 8.0703 117.6256 59.4455 29.8777 179.4261 91 R 4.0101 8.2043 116.8777 58.7613 30.1216 178.2625 92 L 4.3638 7.8608 116.5964 54.2323 41.9705 177.4128 93 G 3.8051 7.7247 106.6612 46.1342 0.0000 173.7392 94 A 4.2551 8.2105 128.3780 51.9441 18.9511 178.0668 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 V 8.05 3.98 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 0.92 0.00 0.00 0.86 0.00 0.00 3 P 0.00 3.05 0.00 0.49 0.79 0.00 3.05 0.00 0.00 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.64 0.00 4 D 8.66 4.42 0.00 2.61 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 W 8.33 4.48 0.00 3.42 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 6 E 8.44 4.04 0.00 2.16 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 2.34 2.43 0.00 7 E 8.34 4.01 0.00 2.19 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 2.40 2.31 0.00 8 V 7.81 3.70 2.40 0.00 0.00 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 0.81 0.00 0.00 9 L 8.81 4.38 0.00 1.82 1.74 0.88 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 10 G 7.98 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 0.00 0.00 0.00 11 L 8.04 4.03 0.00 2.03 1.80 1.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 12 W 8.44 4.06 0.00 3.64 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 13 R 8.60 4.18 0.00 2.09 2.06 0.00 3.27 0.00 0.00 3.29 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.99 0.00 14 A 7.72 4.41 1.34 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 15 G 7.44 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 0.00 0.00 0.00 16 R 7.45 4.22 0.00 1.92 1.86 0.00 3.11 0.00 0.00 3.14 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.60 0.00 17 Y 6.86 4.20 0.00 2.96 2.98 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 0.00 18 Y 8.07 4.37 0.00 2.82 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 19 E 8.25 3.95 0.00 2.14 2.07 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 2.39 2.45 0.00 20 V 7.96 3.74 2.54 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 1.30 0.00 0.00 1.24 0.00 0.00 21 H 8.35 4.22 0.00 3.44 3.74 0.00 5.66 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 22 E 8.22 3.96 0.00 1.91 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 0.00 2.30 2.25 0.00 23 V 8.14 3.81 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 0.99 0.00 0.00 1.04 0.00 0.00 24 L 8.12 4.56 0.00 1.93 1.88 1.22 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 25 E 8.03 4.15 0.00 2.11 2.05 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 2.53 2.56 0.00 26 P 0.00 4.23 0.00 1.71 1.89 0.00 3.80 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.13 0.00 27 Y 7.73 4.12 0.00 3.26 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 28 W 8.39 4.30 0.00 3.34 3.53 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 0.00 0.00 0.00 29 L 8.20 3.59 0.00 1.82 1.62 0.99 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 30 K 7.37 4.24 0.00 1.78 1.81 0.00 1.66 0.00 0.00 1.63 0.00 0.00 2.98 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.49 1.51 7.81 31 A 6.77 4.34 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 32 T 7.84 4.66 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 1.20 0.00 0.00 33 G 8.29 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 0.00 0.00 0.00 34 E 8.95 3.96 0.00 2.04 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 2.40 2.41 0.00 35 E 8.15 4.01 0.00 2.27 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 0.00 2.46 2.50 0.00 36 R 7.99 4.03 0.00 1.79 2.07 0.00 3.06 0.00 0.00 3.09 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.54 0.00 37 R 8.14 3.97 0.00 2.05 2.07 0.00 3.18 0.00 0.00 3.08 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.75 0.00 38 L 8.11 3.71 0.00 1.62 1.86 0.64 1.09 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 39 L 8.24 4.22 0.00 2.18 2.00 1.21 0.99 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 40 Q 8.58 3.83 0.00 2.31 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.81 0.00 0.00 0.00 0.00 0.00 2.20 1.89 0.00 41 G 8.29 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 V 7.93 3.68 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 1.23 0.00 0.00 0.92 0.00 0.00 43 I 7.99 3.72 1.91 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.71 0.44 0.00 0.00 44 L 8.14 3.95 0.00 1.78 1.84 0.87 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 45 L 8.12 4.04 0.00 2.12 2.03 0.97 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 46 A 8.47 3.80 1.66 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 0.00 0.00 47 A 8.37 3.88 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.92 3.83 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 49 L 7.48 3.64 0.00 0.41 0.35 0.00 0.76 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 50 H 8.05 4.15 0.00 3.20 3.31 0.00 5.79 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 51 Q 8.08 3.86 0.00 2.16 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.57 0.00 0.00 0.00 0.00 0.00 2.46 2.48 0.00 52 R 7.82 4.21 0.00 1.72 1.91 0.00 3.33 0.00 0.00 3.22 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.60 0.00 53 R 7.61 3.99 0.00 1.99 1.98 0.00 3.32 0.00 0.00 3.28 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.86 0.00 54 L 7.14 4.47 0.00 1.67 1.62 0.76 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 55 G 7.93 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 0.00 0.00 0.00 56 R 7.73 4.67 0.00 1.99 1.76 0.00 3.11 0.00 0.00 3.10 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.68 0.00 57 P 0.00 4.30 0.00 2.01 1.97 0.00 3.59 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 2.01 2.07 0.00 58 G 8.42 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 59 L 7.82 4.02 0.00 1.65 1.72 0.91 0.83 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 60 R 7.87 3.86 0.00 1.85 1.89 0.00 3.17 0.00 0.00 3.32 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.71 0.00 61 N 8.03 4.31 0.00 2.92 3.03 0.00 0.00 6.73 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 62 L 8.02 3.92 0.00 1.75 1.81 0.95 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 63 R 8.27 4.03 0.00 1.89 2.15 0.00 3.14 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.67 0.00 64 K 8.18 3.98 0.00 1.96 1.81 0.00 1.70 0.00 0.00 1.62 0.00 0.00 2.92 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.44 1.58 7.81 65 A 8.31 3.95 1.42 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 66 E 8.54 3.87 0.00 2.15 2.03 0.00 0.00 0.00 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 2.58 0.00 67 A 7.82 4.00 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 68 R 7.56 4.00 0.00 1.86 2.05 0.00 3.39 0.00 0.00 3.23 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.77 0.00 69 L 7.96 3.67 0.00 1.36 0.43 0.84 -0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 70 E 7.42 4.06 0.00 2.06 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 2.34 2.33 0.00 71 G 9.10 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 72 L 7.49 4.30 0.00 1.53 1.61 0.49 0.92 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 73 P 0.00 4.69 0.00 2.25 2.11 0.00 3.78 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 2.08 2.01 0.00 74 C 8.19 4.73 0.00 2.39 2.44 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.58 0.00 2.17 1.95 0.00 3.74 0.00 0.00 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.90 0.00 76 L 8.39 4.60 0.00 2.09 1.69 0.99 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 *78 G 7.79 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 79 L 7.69 4.26 0.00 0.27 0.97 0.29 -0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 80 D 8.01 4.72 0.00 2.58 2.35 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 81 W 7.73 4.12 0.00 3.50 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 82 R 6.72 3.48 0.00 1.46 1.62 0.00 2.92 0.00 0.00 2.47 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.92 0.00 83 S 7.67 3.95 0.00 3.70 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 84 L 7.34 3.63 0.00 1.50 1.61 -0.70 0.05 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 85 L 8.41 3.99 0.00 1.99 2.02 0.99 1.07 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 86 Q 8.20 3.94 0.00 2.21 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.59 0.00 0.00 0.00 0.00 0.00 2.35 2.36 0.00 87 E 8.45 3.95 0.00 2.11 2.15 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 2.56 2.47 0.00 88 A 8.35 4.16 1.55 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 0.00 0.00 0.00 0.00 0.00 0.00 89 R 8.31 3.91 0.00 2.11 2.02 0.00 3.16 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.81 0.00 90 R 8.07 3.93 0.00 2.04 2.00 0.00 3.15 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.81 0.00 91 R 8.20 4.01 0.00 1.92 1.97 0.00 3.26 0.00 0.00 3.26 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.90 0.00 92 L 7.86 4.36 0.00 1.74 1.69 0.90 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 93 G 7.72 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 0.00 0.00 0.00 94 A 8.21 4.26 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 * Residues marked with a * may have inaccurate shift predictions.