NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 R 4.2265 8.2431 119.7027 56.0507 31.5284 175.0335 2 G 3.7490 7.7448 106.2873 44.8696 0.0000 172.6388 3 F 4.3798 8.6726 117.9651 57.2088 39.3946 175.9002 4 R 4.4243 7.9349 117.2526 57.5424 29.4023 177.6049 5 K 4.0425 7.8892 121.4458 60.6211 32.4739 178.6355 6 H 4.5377 8.3201 115.5928 57.5546 28.7360 177.2088 7 F 4.3096 8.3113 123.7069 61.3284 39.3942 176.4725 8 N 4.0869 8.7721 117.1228 56.3107 38.1548 176.6766 9 K 3.8922 7.7037 119.8975 59.4812 32.2249 178.8075 10 L 3.8005 7.3307 118.8532 57.6996 41.5328 179.4929 11 V 3.3575 7.4825 118.2136 65.9177 30.8075 178.1462 12 K 4.0074 8.0192 118.2712 59.2745 31.7460 179.1369 13 K 3.7946 7.4916 119.6266 59.1865 32.0914 179.0450 14 V 3.5506 7.8606 119.0258 65.8118 31.4102 178.0786 15 K 3.9494 8.5184 118.9847 60.3140 32.2571 178.6572 16 H 4.1788 7.8308 119.0484 59.1328 29.8106 177.2744 17 T 3.7796 8.0467 117.8185 66.6981 68.4037 176.5576 18 I 3.6789 8.0614 121.9235 64.8774 37.0523 178.2673 19 S 4.0656 8.0427 116.1547 61.0525 62.4070 175.9477 20 E 3.0095 8.3745 123.0046 59.8217 29.3842 179.5928 21 T 3.9936 7.5001 113.8522 66.2604 68.9251 176.1301 22 A 4.5244 7.7578 120.5745 52.7562 19.6900 178.0851 23 H 4.4185 8.9757 114.5077 57.3974 28.6128 177.8271 24 V 3.7759 7.9134 115.4322 64.4113 31.1597 177.7883 25 A 3.9961 7.7386 119.6531 54.0953 18.2383 178.8766 26 K 4.2680 7.6132 115.8808 58.6391 33.3302 178.2830 27 D 4.2980 8.4056 118.0744 56.9323 41.0036 177.7919 28 T 3.8160 8.0965 114.0053 64.5953 66.9213 174.6411 29 A 4.7149 7.3231 120.8419 51.9760 19.4018 177.6713 30 V 3.9500 7.9008 120.4017 66.0957 32.3056 176.9265 31 I 4.3008 7.5889 116.9021 62.7966 39.3895 176.7186 32 A 3.9958 7.6583 122.6834 55.0531 18.5559 178.5155 33 G 4.2367 8.7346 104.4305 45.3315 0.0000 174.5144 34 S 4.4796 7.0454 110.7844 56.3758 62.7087 175.8999 35 G 4.2257 7.6333 116.7593 45.3398 0.0000 175.8870 36 A 3.9550 8.2967 122.8319 54.3800 18.4527 179.6461 37 A 3.9651 8.3365 119.5066 54.8390 18.3819 180.2132 38 V 3.4957 7.5556 116.4885 66.3924 31.6272 178.4943 39 V 3.6532 7.9074 110.8489 64.4471 31.4264 178.1352 40 A 4.1505 7.6516 119.1273 54.3755 18.3113 179.2692 41 A 4.1480 7.4956 118.7830 54.4706 18.8807 177.5895 42 T 4.0762 8.2809 117.5551 64.1804 70.0313 173.7778 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 R 8.24 4.23 0.00 1.77 1.91 0.00 3.30 0.00 0.00 3.16 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.54 0.00 2 G 7.74 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 0.00 0.00 0.00 3 F 8.67 4.38 0.00 2.90 2.93 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 4 R 7.93 4.42 0.00 2.28 2.31 0.00 3.06 0.00 0.00 3.44 7.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.97 0.00 5 K 7.89 4.04 0.00 2.02 2.13 0.00 1.40 0.00 0.00 1.74 0.00 0.00 2.95 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.48 1.54 7.81 6 H 8.32 4.54 0.00 3.44 3.66 0.00 5.47 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 F 8.31 4.31 0.00 3.19 3.30 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.77 4.09 0.00 2.95 2.96 0.00 0.00 6.87 6.60 0.00 0.00 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 K 7.70 3.89 0.00 1.93 2.02 0.00 1.71 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.43 1.48 7.81 10 L 7.33 3.80 0.00 1.69 1.65 1.07 0.78 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 11 V 7.48 3.36 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 0.78 0.00 0.00 0.31 0.00 0.00 12 K 8.02 4.01 0.00 1.96 1.82 0.00 1.70 0.00 0.00 1.53 0.00 0.00 2.89 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.68 1.57 7.81 13 K 7.49 3.79 0.00 1.60 1.96 0.00 1.64 0.00 0.00 1.57 0.00 0.00 2.89 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.43 1.57 7.81 14 V 7.86 3.55 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 1.02 0.00 0.00 0.88 0.00 0.00 15 K 8.52 3.95 0.00 2.00 2.03 0.00 1.27 0.00 0.00 1.57 0.00 0.00 3.00 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.40 1.65 7.81 16 H 7.83 4.18 0.00 3.12 3.49 0.00 5.79 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 T 8.05 3.78 4.36 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 1.19 0.00 0.00 18 I 8.06 3.68 1.98 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.37 0.89 0.00 0.00 19 S 8.04 4.07 0.00 3.89 3.78 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 20 E 8.37 3.01 0.00 1.49 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.33 0.00 21 T 7.50 3.99 4.21 0.00 0.00 0.00 0.00 0.00 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 22 A 7.76 4.52 1.31 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 0.00 0.00 23 H 8.98 4.42 0.00 3.31 3.53 0.00 5.29 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 V 7.91 3.78 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 0.91 0.00 0.00 1.02 0.00 0.00 25 A 7.74 4.00 1.28 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 0.00 0.00 0.00 26 K 7.61 4.27 0.00 1.88 1.83 0.00 1.68 0.00 0.00 1.76 0.00 0.00 2.90 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.45 1.47 7.81 27 D 8.41 4.30 0.00 2.52 2.51 0.00 0.00 0.00 0.00 0.00 0.00 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 8.10 3.82 4.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 29 A 7.32 4.71 1.24 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 0.00 0.00 30 V 7.90 3.95 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 0.88 0.00 0.00 0.98 0.00 0.00 31 I 7.59 4.30 1.86 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.55 0.91 0.00 0.00 32 A 7.66 4.00 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 33 G 8.73 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 0.00 0.00 0.00 0.00 34 S 7.05 4.48 0.00 3.91 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 35 G 7.63 4.23 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 0.00 36 A 8.30 3.96 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 37 A 8.34 3.97 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 38 V 7.56 3.50 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.96 0.00 0.00 39 V 7.91 3.65 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 0.77 0.00 0.00 1.00 0.00 0.00 40 A 7.65 4.15 1.31 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 0.00 0.00 41 A 7.50 4.15 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.28 4.08 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