NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1I P 4.2358 0.0000 0.0000 61.4480 32.7598 176.2018 1H P 3.9952 0.0000 0.0000 61.6932 31.9142 171.1513 1G V 3.9428 8.7249 121.2235 61.5316 31.6878 176.7754 1F W 4.8761 8.4131 127.2995 57.8786 29.5896 176.6454 1E Y 4.9693 7.6444 119.4395 54.7473 37.9217 173.4505 1D P 4.3325 0.0000 0.0000 63.8703 32.0006 178.5687 1C G 3.4755 7.4246 107.3243 46.1579 0.0000 174.1950 1B G 3.7618 5.3800 104.3944 46.1564 0.0000 171.3392 1A Q 4.3135 8.7175 122.0951 55.3484 29.9377 176.2632 1 C 4.6302 8.6830 119.9153 57.5035 31.6444 172.7622 2 G 3.9137 8.4807 105.7801 46.6286 0.0000 173.4350 3 V 4.2497 7.8464 118.4013 60.7410 32.9850 174.7338 4 S 4.8451 8.2957 120.9405 56.1046 64.7472 174.0087 5 Q 3.9699 8.5496 123.9842 58.2128 29.0332 175.6200 6 Y 4.5651 7.4621 118.2938 56.3370 38.8588 176.7918 7 S 4.2635 8.9626 120.2572 60.5061 63.2387 174.4431 8 D 5.1035 8.1702 119.6623 51.4413 39.7709 175.6689 9 A 3.9931 7.8400 122.7425 54.8003 18.7080 178.4932 10 G 3.9652 8.6358 110.1624 46.9326 0.0000 173.5092 11 D 4.7072 7.7007 117.1597 53.8925 40.8040 176.1351 12 M 4.0835 7.9718 119.1207 55.8005 32.4715 176.0806 13 E 4.0422 8.6386 124.9370 56.5461 30.1963 176.7356 13A L 4.5608 8.0491 122.6669 52.0764 43.2419 174.2568 13B P 4.4204 0.0000 0.0000 61.9546 31.7159 175.3622 13C P 4.2152 0.0000 0.0000 63.6938 31.7785 176.5539 13D G 4.1413 8.0736 112.0892 45.9106 0.0000 173.1691 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 1I P 0.00 4.24 0.00 1.89 1.84 0.00 3.57 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.99 0.00 1H P 0.00 4.00 0.00 2.07 1.97 0.00 3.35 0.00 0.00 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 1.81 0.00 1G V 8.72 3.94 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 0.83 0.00 0.00 0.87 0.00 0.00 1F W 8.41 4.88 0.00 3.53 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 1E Y 7.64 4.97 0.00 2.99 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 1D P 0.00 4.33 0.00 2.16 2.14 0.00 3.99 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.98 0.00 1C G 7.42 3.48 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 0.00 0.00 0.00 1B G 5.38 3.76 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 0.00 0.00 0.00 1A Q 8.72 4.31 0.00 2.04 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.02 6.82 0.00 0.00 0.00 0.00 0.00 2.35 2.46 0.00 1 C 8.68 4.63 0.00 3.20 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 2 G 8.48 3.91 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 0.00 0.00 0.00 0.00 0.00 0.00 3 V 7.85 4.25 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 0.82 0.00 0.00 1.00 0.00 0.00 4 S 8.30 4.85 0.00 3.89 3.75 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 0.00 0.00 0.00 5 Q 8.55 3.97 0.00 1.93 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.57 0.00 0.00 0.00 0.00 0.00 1.77 1.16 0.00 6 Y 7.46 4.57 0.00 3.06 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 7 S 8.96 4.26 0.00 4.00 4.03 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 0.00 0.00 0.00 8 D 8.17 5.10 0.00 2.94 2.91 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 0.00 0.00 0.00 9 A 7.84 3.99 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 10 G 8.64 3.97 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 0.00 0.00 0.00 11 D 7.70 4.71 0.00 2.83 2.67 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 12 M 7.97 4.08 0.00 1.96 1.97 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.57 0.00 13 E 8.64 4.04 0.00 1.99 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 2.31 2.24 0.00 13A L 8.05 4.56 0.00 1.52 1.54 0.92 0.95 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 13B P 0.00 4.42 0.00 2.21 2.04 0.00 3.82 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.96 0.00 13C P 0.00 4.22 0.00 2.20 2.22 0.00 3.85 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.96 0.00 13D G 8.07 4.14 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 0.00 0.00 0.00