NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.3014 8.2649 123.5809 51.6379 19.9524 176.3152 2 T 3.6453 8.2425 117.7467 63.5778 69.0057 171.6651 3 L 4.7515 7.9043 124.6502 52.5880 45.7288 176.5341 4 T 4.0699 8.0964 110.2532 61.4288 70.6019 174.9164 5 A 3.9462 8.5551 123.6374 55.5565 18.2450 179.6687 6 E 3.8755 8.1101 116.9337 59.7531 29.8525 178.9759 7 Q 3.9990 7.8791 117.5584 58.6470 28.7200 178.5570 8 S 4.1107 8.6151 114.8479 61.4957 62.4841 176.1441 9 E 4.0421 8.1877 121.2806 59.3292 28.9537 179.1728 10 E 4.0411 8.2546 118.0252 59.3700 29.9016 178.8141 11 L 4.1511 8.0815 120.3631 58.5230 42.1141 178.5560 12 H 4.2829 8.4586 118.0644 58.9146 29.7000 177.2332 13 K 3.9262 8.0361 120.2427 59.8410 31.8171 178.7603 14 Y 3.8343 8.1467 116.7995 60.7013 37.7373 178.5053 15 V 3.6129 7.6904 118.9863 65.9353 31.7414 178.0444 16 I 3.6661 8.0059 119.9985 64.5020 36.9730 178.1869 17 D 4.4339 8.2958 119.9597 57.2221 40.6057 179.1355 18 G 3.6498 8.3354 106.3864 48.1243 0.0000 175.8495 19 T 3.9443 8.0790 118.2928 66.5619 68.3864 176.9540 20 R 3.9870 8.0923 120.0116 58.9440 30.0668 179.2404 21 V 3.5646 7.9292 118.1749 65.9310 31.5126 177.6253 22 F 3.9085 8.3178 120.3621 61.3032 39.0974 176.6316 23 L 4.1621 8.5633 120.2818 58.2379 41.8554 179.1432 24 G 3.6303 8.2723 105.5005 47.9510 0.0000 175.6055 25 L 3.9598 7.9576 121.6792 57.3491 41.5205 179.5560 26 A 3.9546 8.2620 121.0678 54.9766 18.2715 179.7799 27 L 3.9976 8.2321 118.0850 57.8358 41.6979 179.7025 28 V 3.6832 7.8787 118.0231 66.0722 31.4351 177.7924 29 A 4.0307 8.2737 120.6241 55.7382 18.1271 179.4033 30 H 4.2403 8.7170 114.8498 58.7812 28.7992 177.7595 31 F 4.2989 8.5514 122.5997 61.3939 39.2595 177.1541 32 L 3.8630 8.3227 118.3540 57.7518 41.1922 179.4435 33 A 4.0183 8.3246 120.8082 55.1383 18.1228 179.3444 34 F 4.2597 8.6762 118.5656 61.7839 39.4853 177.2832 35 S 3.7988 7.8192 113.4644 60.0714 62.7040 174.7829 36 A 4.5632 7.6513 121.1933 51.8984 19.8484 175.6439 37 T 4.7705 7.2736 111.3535 60.8054 72.2163 172.6088 38 P 4.4119 0.0000 0.0000 63.6326 31.7783 176.6841 39 W 4.5475 8.2692 128.4876 59.0980 30.7471 175.0619 40 L 3.1518 8.4854 122.8519 55.1783 38.8889 174.2174 41 H 4.4844 8.3346 121.8044 56.3902 29.2558 174.3730 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 A 8.26 4.30 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 2 T 8.24 3.65 4.24 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 1.21 0.00 0.00 3 L 7.90 4.75 0.00 1.60 1.56 0.95 0.88 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 4 T 8.10 4.07 4.24 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 1.21 0.00 0.00 5 A 8.56 3.95 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 6 E 8.11 3.88 0.00 2.05 1.96 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 2.39 2.42 0.00 7 Q 7.88 4.00 0.00 2.27 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.58 0.00 0.00 0.00 0.00 0.00 2.38 2.36 0.00 8 S 8.62 4.11 0.00 3.89 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 9 E 8.19 4.04 0.00 2.18 2.01 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 2.50 2.50 0.00 10 E 8.25 4.04 0.00 2.12 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 2.40 2.48 0.00 11 L 8.08 4.15 0.00 1.78 1.93 0.91 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 12 H 8.46 4.28 0.00 3.48 3.33 0.00 5.85 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 K 8.04 3.93 0.00 2.09 1.78 0.00 1.74 0.00 0.00 1.63 0.00 0.00 2.96 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.46 1.68 7.81 14 Y 8.15 3.83 0.00 3.31 3.04 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 15 V 7.69 3.61 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 1.03 0.00 0.00 1.01 0.00 0.00 16 I 8.01 3.67 1.82 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.61 0.89 0.00 0.00 17 D 8.30 4.43 0.00 2.61 2.62 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 18 G 8.34 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 19 T 8.08 3.94 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 1.20 0.00 0.00 20 R 8.09 3.99 0.00 2.05 1.98 0.00 3.11 0.00 0.00 3.08 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.72 0.00 21 V 7.93 3.56 2.28 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 1.02 0.00 0.00 1.02 0.00 0.00 22 F 8.32 3.91 0.00 3.23 3.19 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 23 L 8.56 4.16 0.00 1.94 1.92 0.97 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 24 G 8.27 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.96 3.96 0.00 1.62 1.59 0.84 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 26 A 8.26 3.95 1.38 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 0.00 0.00 0.00 0.00 0.00 0.00 27 L 8.23 4.00 0.00 1.89 1.76 0.93 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 28 V 7.88 3.68 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 1.08 0.00 0.00 0.99 0.00 0.00 29 A 8.27 4.03 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 30 H 8.72 4.24 0.00 3.38 3.64 0.00 5.83 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 F 8.55 4.30 0.00 3.25 3.34 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 32 L 8.32 3.86 0.00 1.94 1.71 0.97 0.95 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 33 A 8.32 4.02 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 34 F 8.68 4.26 0.00 2.96 3.33 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.82 3.80 0.00 3.72 3.64 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.65 4.56 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.27 4.77 4.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 38 P 0.00 4.41 0.00 2.24 2.11 0.00 3.67 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.07 0.00 39 W 8.27 4.55 0.00 3.16 3.23 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 40 L 8.49 3.15 0.00 1.53 1.49 -0.16 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 41 H 8.33 4.48 0.00 3.17 3.33 0.00 5.70 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00