NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 G 3.7759 8.3549 109.7341 46.6308 0.0000 173.7703 3 R 3.4140 8.4439 121.0720 56.3020 27.0096 173.8237 4 P 4.4511 0.0000 0.0000 64.9599 33.2242 175.9545 5 Y 4.7106 6.9080 113.5939 56.1175 40.7090 172.5204 6 K 4.1035 8.5423 122.2068 57.6301 31.6912 176.4406 7 L 4.6461 7.3636 116.7605 55.1239 41.9769 178.1846 8 L 4.1435 7.8142 120.9632 56.0935 42.3938 177.3106 9 N 4.0523 8.1629 113.6838 53.1447 35.9834 176.1462 10 G 3.8750 7.4465 102.8008 45.4608 0.0000 172.5168 11 I 4.5710 8.1462 126.1958 58.6650 40.5497 175.1446 12 K 4.5119 8.4252 123.5658 54.6521 33.3937 175.7383 13 L 4.6726 8.3521 125.4103 53.7246 43.0328 176.0004 14 G 3.8513 8.6692 111.3894 44.0394 0.0000 172.8012 15 V 4.3111 7.9571 125.3257 60.8440 33.4521 174.5922 16 Y 4.6388 8.4058 122.6049 56.1265 40.4338 174.9692 17 I 4.5632 8.1962 117.0658 57.3312 41.1479 173.8849 18 P 4.4231 0.0000 0.0000 62.5090 33.0173 177.4575 19 Q 4.0224 8.6119 120.5514 59.7358 29.2809 178.6931 20 E 4.1222 8.3181 118.5919 58.5068 29.4163 179.1016 21 W 4.1344 8.0870 128.4933 60.6766 31.1059 177.3480 22 H 4.1453 8.6415 118.2907 59.2411 29.2288 176.5737 23 D 4.3158 8.6089 120.1963 57.6936 41.1758 178.5961 24 R 3.9828 7.8972 117.9640 58.8561 29.9793 179.1304 25 L 3.7870 7.8787 118.9456 58.1278 41.4235 179.5358 26 M 3.9907 7.7220 117.1201 57.8815 32.0390 178.3133 27 E 4.0378 7.8524 119.3136 59.5051 29.9419 179.0011 28 I 3.6983 7.7366 119.5566 64.2207 37.0967 178.3222 29 A 4.0233 8.2342 121.9688 54.8318 17.8869 179.8265 30 K 4.0194 7.9371 117.4608 59.4185 31.9401 179.1274 31 E 3.9280 8.1333 118.3940 58.5498 29.7335 177.8882 32 K 4.2588 7.7103 115.6989 55.0701 32.8927 175.6997 33 N 4.1676 7.7603 116.6847 54.7354 37.6501 173.0173 34 L 4.8688 8.3976 114.8884 52.8680 46.0314 176.0378 35 T 4.5942 9.0753 110.1953 59.6403 70.9861 175.7389 36 L 3.9377 8.2833 122.8469 59.1363 40.1609 179.4731 37 S 4.1221 8.0665 115.5163 61.6858 62.7347 176.2720 38 D 4.3414 8.0130 121.4648 57.3838 40.5993 179.0237 39 V 3.6154 7.5934 118.3127 65.8195 31.6294 177.5409 40 C 4.0601 8.4349 118.9672 62.4558 31.5401 175.1547 41 R 3.8879 7.9302 120.3215 59.8792 29.7006 178.4097 42 L 4.0754 8.3689 118.3120 57.2524 41.4078 179.5251 43 A 4.0144 7.9704 121.4486 55.2020 18.3959 179.7870 44 I 3.7418 7.7313 111.3910 63.6215 37.7226 178.2875 45 K 3.9006 7.9053 121.2677 59.6354 32.0274 178.3997 46 E 4.0716 8.1745 118.7307 58.8602 29.4251 177.9761 47 Y 4.0197 8.2474 120.2867 60.5357 38.7890 178.0422 48 L 3.9869 8.5078 120.2174 58.1510 41.6412 179.3437 49 D 4.5169 7.8058 116.8035 57.0503 40.7113 178.0445 50 N 4.4700 8.1591 117.1126 56.3771 39.2780 176.1560 51 H 4.4096 8.1129 115.3815 55.6033 29.3945 174.9168 52 D 4.6971 8.0093 120.2347 52.5444 43.8612 174.9286 53 K 4.4374 8.6205 124.0729 56.6076 33.1921 177.4606 54 Q 4.0361 8.2981 118.2600 58.0809 29.3368 175.9462 55 K 3.7822 8.6646 116.2319 57.1599 29.3465 175.6600 56 K 4.1789 7.8741 119.9097 56.4345 32.1528 177.1120 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 G 8.35 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 0.00 0.00 0.00 3 R 8.44 3.41 0.00 1.96 1.87 0.00 3.43 0.00 0.00 3.18 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.65 0.00 4 P 0.00 4.45 0.00 2.33 2.20 0.00 3.30 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.09 0.00 5 Y 6.91 4.71 0.00 3.04 2.89 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.54 4.10 0.00 2.23 1.77 0.00 1.64 0.00 0.00 1.89 0.00 0.00 3.02 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.43 1.50 7.81 7 L 7.36 4.65 0.00 1.57 1.60 0.84 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 8 L 7.81 4.14 0.00 1.66 1.71 0.97 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 9 N 8.16 4.05 0.00 2.80 2.83 0.00 0.00 6.66 7.65 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 10 G 7.45 3.88 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 0.00 0.00 0.00 11 I 8.15 4.57 1.88 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 1.31 1.01 0.92 0.00 0.00 12 K 8.43 4.51 0.00 1.68 1.69 0.00 1.59 0.00 0.00 1.75 0.00 0.00 3.07 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.34 1.46 7.81 13 L 8.35 4.67 0.00 1.72 1.57 0.92 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 14 G 8.67 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.96 4.31 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 0.98 0.00 0.00 0.92 0.00 0.00 16 Y 8.41 4.64 0.00 2.97 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 17 I 8.20 4.56 1.95 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.93 1.01 0.00 0.00 18 P 0.00 4.42 0.00 2.26 2.02 0.00 3.14 0.00 0.00 3.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.96 0.00 19 Q 8.61 4.02 0.00 2.20 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.93 0.00 0.00 0.00 0.00 0.00 2.46 2.57 0.00 20 E 8.32 4.12 0.00 2.13 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 2.46 2.37 0.00 21 W 8.09 4.13 0.00 3.44 3.32 0.00 0.00 0.00 0.00 0.00 0.00 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 4.15 0.00 3.35 3.49 0.00 5.64 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 23 D 8.61 4.32 0.00 2.87 2.89 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.90 3.98 0.00 1.78 1.89 0.00 3.33 0.00 0.00 3.17 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.80 0.00 25 L 7.88 3.79 0.00 1.64 1.53 0.62 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 26 M 7.72 3.99 0.00 1.96 2.17 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.51 0.00 27 E 7.85 4.04 0.00 2.20 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 0.00 2.29 2.37 0.00 28 I 7.74 3.70 1.90 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.80 0.86 0.00 0.00 29 A 8.23 4.02 1.37 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 0.00 0.00 0.00 30 K 7.94 4.02 0.00 1.94 1.85 0.00 1.68 0.00 0.00 1.56 0.00 0.00 2.89 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.76 1.57 7.81 31 E 8.13 3.93 0.00 1.94 2.16 0.00 0.00 0.00 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 2.38 0.00 32 K 7.71 4.26 0.00 1.86 1.80 0.00 1.77 0.00 0.00 1.77 0.00 0.00 3.04 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.38 1.45 7.81 33 N 7.76 4.17 0.00 2.81 2.86 0.00 0.00 6.89 7.59 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 34 L 8.40 4.87 0.00 1.53 1.49 0.90 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 35 T 9.08 4.59 4.22 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 1.20 0.00 0.00 36 L 8.28 3.94 0.00 1.79 1.86 0.87 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 37 S 8.07 4.12 0.00 3.87 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 38 D 8.01 4.34 0.00 2.82 2.69 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 0.00 0.00 0.00 0.00 39 V 7.59 3.62 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.95 0.00 0.00 40 C 8.43 4.06 0.00 3.21 3.01 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 41 R 7.93 3.89 0.00 1.89 2.15 0.00 3.31 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.84 0.00 42 L 8.37 4.08 0.00 1.86 1.70 0.90 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 43 A 7.97 4.01 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 I 7.73 3.74 1.89 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.31 0.76 0.00 0.00 45 K 7.91 3.90 0.00 2.02 2.07 0.00 1.54 0.00 0.00 1.59 0.00 0.00 2.99 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.45 1.52 7.81 46 E 8.17 4.07 0.00 2.14 1.98 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 2.33 2.33 0.00 47 Y 8.25 4.02 0.00 3.25 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 L 8.51 3.99 0.00 1.89 1.74 0.97 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 49 D 7.81 4.52 0.00 2.68 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 N 8.16 4.47 0.00 2.86 2.91 0.00 0.00 7.21 8.34 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 51 H 8.11 4.41 0.00 2.85 3.13 0.00 5.67 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 D 8.01 4.70 0.00 2.51 2.57 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 0.00 0.00 0.00 0.00 53 K 8.62 4.44 0.00 1.76 1.81 0.00 1.92 0.00 0.00 1.67 0.00 0.00 2.79 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.34 1.36 7.81 54 Q 8.30 4.04 0.00 2.19 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.69 0.00 0.00 0.00 0.00 0.00 2.34 2.45 0.00 55 K 8.66 3.78 0.00 1.85 1.84 0.00 1.69 0.00 0.00 1.87 0.00 0.00 2.99 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.38 1.51 7.81 56 K 7.87 4.18 0.00 1.75 1.72 0.00 1.78 0.00 0.00 1.75 0.00 0.00 3.05 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.41 1.43 7.81