NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -2 R 4.3137 8.3545 119.0730 55.9774 31.1664 175.0640 -1 K 4.6702 7.9448 123.2423 51.4222 37.1777 173.7872 0 L 3.4563 8.9440 119.5634 56.9527 41.5279 179.6213 1 C 4.3592 9.3544 125.5271 60.7054 39.8759 175.1412 2 S 4.0771 8.0697 114.0571 59.0465 62.9179 173.9132 3 L 4.2869 8.1027 124.1481 53.6367 41.7158 175.5697 4 D 4.4030 9.3324 129.6323 55.5894 39.8271 173.1545 5 N 4.3517 8.2346 109.4351 53.3857 37.7679 174.2934 6 G 3.7609 8.8566 101.1934 45.6103 0.0000 174.4918 7 D 4.4584 8.2812 115.6887 54.5964 40.3272 173.2366 8 C 4.7239 7.8671 114.4132 56.3934 41.0379 173.7732 9 D 4.5117 8.7697 123.6611 57.0589 42.1326 177.2594 10 Q 4.4470 7.5773 111.8220 55.8397 30.5782 179.2574 11 F 4.6805 6.4213 127.0666 58.5323 40.3535 172.9632 12 C 5.5020 8.7337 121.7698 55.2469 44.4012 172.6309 13 H 5.1679 9.2574 121.9133 54.0669 32.9910 171.9789 14 E 5.1196 8.8123 119.9632 54.7788 31.3851 175.3883 15 E 4.5185 9.2081 124.3312 55.8848 32.8086 176.2229 16 Q 3.2202 9.6877 123.3653 57.4744 26.2551 173.5497 17 N 4.2928 8.1750 106.9780 53.9548 36.9715 174.6615 18 S 4.6350 8.0788 111.7889 56.1278 65.6430 173.1744 19 V 4.2261 8.3390 126.8363 62.9663 32.3788 175.2209 20 V 4.4139 9.0124 127.4405 61.4428 34.0575 173.9791 21 C 5.3886 8.9227 125.4755 56.6527 37.3941 172.6401 22 S 4.7244 8.7193 114.8269 57.9364 66.6732 171.7725 23 C 4.9433 8.5379 115.6959 54.5948 39.1757 174.2629 24 A 4.5369 8.7768 123.6962 51.7186 18.6845 177.6136 25 R 4.2004 8.4444 118.9057 58.0775 30.6335 177.7681 26 G 3.9595 9.3717 109.8992 45.1216 0.0000 172.0061 27 Y 5.2922 7.6862 116.1744 56.1429 41.3739 175.1054 28 T 4.7435 8.9235 112.4342 59.5140 71.9071 173.2385 29 L 4.5392 8.5161 126.0297 55.0661 42.9435 176.4659 30 A 4.3183 9.2232 128.3360 51.4811 19.4518 178.1432 31 D 4.2738 8.7816 118.9028 57.5424 40.8798 177.9468 32 N 4.4478 8.1760 113.6420 52.9486 37.5437 175.4484 33 G 3.9949 8.3108 106.9904 46.4335 0.0000 174.0489 34 K 4.4850 8.6822 118.0332 57.6489 35.4792 176.8848 35 A 4.7742 8.2689 120.7213 51.9499 20.0531 176.6147 36 C 5.3364 9.1513 117.6550 55.2409 39.4949 173.6170 37 I 4.6192 9.0118 125.1873 58.6726 39.1103 173.5311 38 P 4.1917 0.0000 0.0000 62.9211 31.0330 176.9097 39 T 3.9753 8.7654 115.7851 64.3884 69.5368 174.3160 40 G 3.9890 7.2097 108.5001 44.2135 0.0000 170.5855 41 P 4.1202 0.0000 0.0000 63.2359 32.5773 175.1446 42 Y 3.6168 7.6113 114.7838 58.5832 35.3919 169.1145 43 P 4.3098 0.0000 0.0000 62.1974 32.6400 176.2988 44 C 4.3472 8.3836 114.9480 59.7795 29.9925 174.1191 45 G 3.9522 8.9372 109.1759 45.7195 0.0000 173.0025 46 K 4.5823 7.3864 118.2177 54.0221 33.7152 176.5654 47 Q 4.1877 8.7029 123.0809 56.6886 29.3955 177.3233 48 T 4.4690 8.1821 112.1176 60.0172 67.7049 174.7542 49 L 4.3327 7.8144 128.1993 55.6161 42.0606 176.5873 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 R 8.35 4.31 0.00 1.85 1.81 0.00 3.18 0.00 0.00 3.22 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.20 0.00 -1 K 7.94 4.67 0.00 1.69 1.64 0.00 1.90 0.00 0.00 1.82 0.00 0.00 2.88 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.33 1.09 7.81 0 L 8.94 3.46 0.00 1.97 0.99 0.95 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 1 C 9.35 4.36 0.00 3.14 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 S 8.07 4.08 0.00 4.01 3.90 0.00 0.00 0.00 0.00 0.00 0.00 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 8.10 4.29 0.00 1.69 1.76 0.92 1.26 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 4 D 9.33 4.40 0.00 2.87 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 5 N 8.23 4.35 0.00 2.98 2.79 0.00 0.00 7.57 7.90 0.00 0.00 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 G 8.86 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 7 D 8.28 4.46 0.00 2.81 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 8 C 7.87 4.72 0.00 3.07 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 9 D 8.77 4.51 0.00 2.64 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 Q 7.58 4.45 0.00 1.46 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.83 6.95 0.00 0.00 0.00 0.00 0.00 1.85 1.96 0.00 11 F 6.42 4.68 0.00 3.08 2.75 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 12 C 8.73 5.50 0.00 3.03 2.90 0.00 0.00 0.00 0.00 0.00 0.00 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 H 9.26 5.17 0.00 3.10 3.13 0.00 5.63 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 14 E 8.81 5.12 0.00 1.84 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 2.23 2.32 0.00 15 E 9.21 4.52 0.00 1.95 1.81 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 2.21 2.24 0.00 16 Q 9.69 3.22 0.00 2.13 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.83 0.00 0.00 0.00 0.00 0.00 2.29 2.36 0.00 17 N 8.17 4.29 0.00 2.87 2.90 0.00 0.00 6.89 7.57 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 18 S 8.08 4.64 0.00 3.78 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 19 V 8.34 4.23 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.94 0.00 0.00 20 V 9.01 4.41 2.13 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 0.96 0.00 0.00 1.01 0.00 0.00 21 C 8.92 5.39 0.00 3.06 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 22 S 8.72 4.72 0.00 4.03 4.06 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 23 C 8.54 4.94 0.00 2.81 2.78 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 24 A 8.78 4.54 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 25 R 8.44 4.20 0.00 1.90 1.95 0.00 3.25 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 1.73 1.74 0.00 26 G 9.37 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 0.00 0.00 0.00 27 Y 7.69 5.29 0.00 2.94 2.78 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 28 T 8.92 4.74 4.27 0.00 0.00 0.00 0.00 0.00 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 29 L 8.52 4.54 0.00 1.68 1.63 1.04 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 30 A 9.22 4.32 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 31 D 8.78 4.27 0.00 2.68 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 32 N 8.18 4.45 0.00 2.81 2.93 0.00 0.00 6.01 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 33 G 8.31 3.99 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 0.00 0.00 0.00 0.00 0.00 0.00 34 K 8.68 4.48 0.00 1.77 1.93 0.00 1.66 0.00 0.00 1.88 0.00 0.00 2.87 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.34 1.57 7.81 35 A 8.27 4.77 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 36 C 9.15 5.34 0.00 2.58 2.82 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 37 I 9.01 4.62 1.90 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 1.38 0.91 0.91 0.00 0.00 38 P 0.00 4.19 0.00 1.77 1.65 0.00 3.67 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.09 0.00 39 T 8.77 3.98 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 40 G 7.21 3.99 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 0.00 0.00 0.00 0.00 0.00 0.00 41 P 0.00 4.12 0.00 2.07 1.81 0.00 3.91 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.94 0.00 42 Y 7.61 3.62 0.00 3.17 3.02 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 43 P 0.00 4.31 0.00 1.78 1.67 0.00 3.58 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.80 0.00 44 C 8.38 4.35 0.00 3.20 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 45 G 8.94 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 46 K 7.39 4.58 0.00 1.90 1.78 0.00 1.79 0.00 0.00 1.77 0.00 0.00 2.99 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.70 1.60 7.81 47 Q 8.70 4.19 0.00 2.06 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 7.30 0.00 0.00 0.00 0.00 0.00 2.39 2.38 0.00 48 T 8.18 4.47 4.42 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 1.40 0.00 0.00 49 L 7.81 4.33 0.00 1.64 1.59 0.98 0.94 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