NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 N 4.7693 8.4093 118.1273 52.9223 40.0583 174.2682 2 S 4.1059 8.8265 116.7045 60.0418 63.2574 173.0597 3 K 4.7329 8.5853 118.9122 54.2238 36.1462 176.2975 4 R 4.6155 8.1840 118.5034 53.5934 33.4717 175.9395 5 A 4.2506 8.3460 121.3486 51.9209 19.1866 179.1721 6 C 4.8584 8.8395 126.0834 59.5993 38.2480 174.9463 7 Y 4.0979 8.0455 121.1294 60.8067 38.2916 177.8625 8 R 3.8344 8.0343 117.3631 59.2546 30.5046 178.4664 9 E 4.1293 7.9484 117.9887 57.1326 29.1921 177.9262 10 G 3.9259 7.7222 105.9604 46.2219 0.0000 173.8162 11 G 4.0883 7.3005 107.3139 45.1157 0.0000 173.4430 12 E 4.9037 8.5929 117.6649 54.6710 33.0595 174.9151 13 C 5.7416 8.4896 119.8719 55.0242 37.6728 173.0180 14 L 4.9155 8.3279 123.5256 52.8147 43.8698 178.0297 15 Q 3.8693 9.0555 121.8164 58.6673 29.5104 177.0973 16 R 4.5812 7.4148 115.1579 54.4830 30.8913 175.8678 17 C 3.6249 7.9432 115.7234 57.2361 38.6935 173.5567 18 I 4.3349 8.3428 127.5464 59.7125 38.6794 176.9185 19 G 3.6700 8.8538 110.0270 49.0003 0.0000 174.5925 20 L 3.7575 8.0986 120.8471 57.3333 42.0047 176.9842 21 F 4.5285 7.9895 116.9389 56.5830 39.5658 176.1180 22 H 4.4226 8.6359 120.3856 55.7691 30.0408 174.2638 23 K 4.9383 8.6277 122.5255 55.3658 32.9384 175.5833 24 I 4.1634 8.5862 128.4564 63.0830 38.6576 175.9538 25 G 4.1854 7.3011 109.0499 46.7886 0.0000 172.6725 26 T 5.0981 8.7578 112.6386 59.9473 71.9222 175.1235 27 C 4.8250 8.5683 120.3042 56.3024 42.5554 173.1246 28 N 4.4909 9.0552 116.8196 56.7048 38.5790 175.4507 29 F 4.5606 8.4402 115.5724 58.9436 41.9061 173.4241 30 R 3.2689 7.9691 123.9859 56.4730 27.6815 175.6290 31 F 4.9865 7.4710 113.3924 56.1342 43.9356 173.6221 32 K 5.0018 8.6786 120.1815 54.7932 36.0985 174.2974 33 C 4.9527 9.0641 123.1403 55.9051 39.3515 171.9637 34 C 6.3000 8.8296 122.2414 54.4388 43.4318 172.9955 35 K 5.1366 8.7090 118.2033 54.7655 35.6911 175.0249 36 F 4.9924 9.0911 125.9073 56.3963 41.5188 175.3977 37 Q 3.8650 7.1149 121.9473 56.2474 28.6093 174.7938 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 1 N 8.41 4.77 0.00 2.74 2.96 0.00 0.00 6.97 6.69 0.00 0.00 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 8.83 4.11 0.00 4.07 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 3 K 8.59 4.73 0.00 1.74 1.73 0.00 1.70 0.00 0.00 1.73 0.00 0.00 2.99 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.34 1.43 7.81 4 R 8.18 4.62 0.00 1.77 1.81 0.00 3.22 0.00 0.00 3.24 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.60 0.00 5 A 8.35 4.25 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 C 8.84 4.86 0.00 3.06 3.17 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 0.00 0.00 0.00 7 Y 8.05 4.10 0.00 3.11 3.03 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 R 8.03 3.83 0.00 2.00 1.98 0.00 3.47 0.00 0.00 3.29 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.73 0.00 9 E 7.95 4.13 0.00 2.23 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 2.33 2.48 0.00 10 G 7.72 3.93 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 0.00 0.00 0.00 0.00 0.00 0.00 11 G 7.30 4.09 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 E 8.59 4.90 0.00 1.96 1.77 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 2.20 2.28 0.00 13 C 8.49 5.74 0.00 2.55 2.73 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 14 L 8.33 4.92 0.00 1.43 1.39 0.74 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 15 Q 9.06 3.87 0.00 2.02 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.61 7.52 0.00 0.00 0.00 0.00 0.00 2.25 2.66 0.00 16 R 7.41 4.58 0.00 1.70 1.79 0.00 3.23 0.00 0.00 3.11 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.54 0.00 17 C 7.94 3.62 0.00 2.92 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 18 I 8.34 4.33 2.19 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.98 1.00 0.00 0.00 19 G 8.85 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 0.00 0.00 0.00 20 L 8.10 3.76 0.00 1.58 1.65 0.10 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 21 F 7.99 4.53 0.00 3.22 3.09 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 0.00 0.00 0.00 0.00 22 H 8.64 4.42 0.00 3.19 3.24 0.00 5.59 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 K 8.63 4.94 0.00 1.80 1.74 0.00 1.79 0.00 0.00 1.73 0.00 0.00 2.93 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.37 1.59 7.81 24 I 8.59 4.16 1.91 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 1.04 1.03 0.00 0.00 25 G 7.30 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 0.00 0.00 0.00 0.00 26 T 8.76 5.10 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 1.24 0.00 0.00 27 C 8.57 4.83 0.00 3.26 3.24 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 0.00 0.00 0.00 0.00 28 N 9.06 4.49 0.00 2.85 2.99 0.00 0.00 6.60 7.45 0.00 0.00 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 F 8.44 4.56 0.00 3.05 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 30 R 7.97 3.27 0.00 1.23 1.13 0.00 2.94 0.00 0.00 2.54 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.73 0.00 31 F 7.47 4.99 0.00 3.03 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 32 K 8.68 5.00 0.00 1.66 1.70 0.00 1.64 0.00 0.00 1.58 0.00 0.00 2.76 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.34 1.33 7.81 33 C 9.06 4.95 0.00 3.02 3.15 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 0.00 0.00 0.00 34 C 8.83 6.30 0.00 2.89 3.15 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 0.00 0.00 0.00 35 K 8.71 5.14 0.00 1.71 1.72 0.00 1.70 0.00 0.00 1.81 0.00 0.00 2.82 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.48 1.39 7.81 36 F 9.09 4.99 0.00 3.32 3.09 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 0.00 0.00 0.00 0.00 37 Q 7.11 3.87 0.00 1.96 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.78 6.34 0.00 0.00 0.00 0.00 0.00 1.95 2.00 0.00