NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.3222 8.2649 123.5820 51.7182 20.6048 176.3103 2 V 4.3568 7.2605 106.0668 57.0684 35.8450 172.9440 3 Q 3.7978 8.7393 118.1168 57.4254 28.9605 176.7764 4 Q 4.3701 8.6070 122.1814 55.7712 29.5558 174.4350 5 N 4.8309 7.5457 114.1948 52.5081 41.9488 173.6744 6 K 4.0142 8.6035 127.1803 55.6310 32.8052 174.6603 7 P 4.4027 0.0000 0.0000 63.0110 31.5543 175.1798 8 T 4.5265 8.0189 109.9244 60.2163 71.1669 175.4177 9 R 4.1219 8.2341 117.1215 58.7703 29.6388 178.5562 10 S 4.1032 7.8985 113.7458 61.0895 62.4674 175.7386 11 K 4.0846 8.7178 122.5366 58.9741 31.6709 178.8586 12 R 3.9752 7.5517 117.9454 59.1327 30.2528 178.5024 13 G 3.6954 8.1218 105.5311 48.1842 0.0000 175.3989 14 M 4.0763 8.3623 122.2056 58.3228 31.7899 178.8267 15 R 3.7357 8.2408 117.3265 58.4936 30.4580 177.7711 16 R 4.8452 8.6964 119.1860 57.2051 30.5964 179.4610 17 S 4.1106 7.4660 114.4300 61.7186 63.1069 176.0150 18 H 4.4886 8.0339 115.6786 56.0720 28.3834 175.3895 19 D 4.7517 8.8585 119.5786 53.4921 41.3475 176.1000 20 A 4.3129 7.4316 122.8432 52.7821 19.6055 178.5695 21 L 4.6687 8.0613 127.8469 54.0737 40.8900 177.7105 22 T 4.3630 7.9977 119.5029 62.0541 69.8195 173.2342 23 A 4.4030 8.2817 128.9585 51.6342 20.3370 176.6308 24 V 4.0767 8.1955 114.4339 62.7264 33.6214 175.7648 25 T 3.0532 7.9648 113.3479 64.6352 64.2356 171.0049 26 S 3.7122 7.9644 119.1117 58.0274 62.7233 171.4756 27 L 4.9761 8.0154 119.4504 53.3135 45.7848 176.4531 28 S 4.9006 8.2042 115.3964 57.5457 66.2429 172.9176 29 V 5.1537 7.9309 117.4976 60.4613 33.9068 174.1703 30 D 4.4230 8.7677 123.9318 54.0631 41.7703 176.0737 31 K 3.9496 8.7871 125.5848 59.9215 31.6218 177.7265 32 T 3.7376 7.5127 113.2082 66.9865 69.5335 178.3878 33 S 4.4915 7.2658 130.0509 58.8412 62.8815 176.2771 34 G 4.1109 8.2181 113.8789 46.1523 0.0000 171.4005 35 E 4.5442 8.1940 120.4306 54.2441 31.2527 175.7312 36 K 4.7973 8.8205 125.1481 57.2369 33.2515 175.8789 37 H 5.2164 9.1763 120.9038 52.9495 32.1588 173.2623 38 L 4.2275 8.6482 119.4736 54.7428 41.9902 177.3765 39 R 3.7504 8.3667 123.7475 58.0338 30.5369 175.6276 40 H 4.3424 9.8399 120.7968 56.6764 25.4692 173.8001 41 H 4.9006 8.2909 113.3895 54.9601 31.1718 171.7896 42 I 4.2190 7.8353 120.1054 59.9526 38.4110 176.3046 43 T 4.2253 8.0938 114.9888 60.7812 69.6177 175.5037 44 A 4.0389 8.4658 124.1887 54.8162 18.4321 178.1474 45 D 4.8756 7.6474 112.6563 53.7361 41.2447 177.3087 46 G 3.7907 8.1663 108.7182 45.2472 0.0000 173.3971 47 Y 4.3739 7.8162 117.8846 57.7907 38.1783 173.5884 48 Y 5.3392 7.9451 121.0773 57.8726 44.3743 175.8482 49 R 4.6178 7.8327 121.1974 56.0670 30.5127 174.7253 50 G 4.0629 9.4043 116.7497 46.8533 0.0000 171.3721 51 R 4.6647 7.7593 116.3190 54.0599 34.2115 174.1928 52 K 4.3988 8.5288 122.1485 54.7239 34.8083 175.2610 53 V 4.2720 7.9753 119.7283 61.6125 32.6824 179.3844 54 I 3.2567 7.8860 114.9327 61.8085 39.9871 174.5211 55 A 4.5349 8.6985 129.1922 52.8750 20.7311 177.5307 56 K 4.1634 7.3650 119.5340 56.7903 32.2024 176.9236 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 4.32 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 2 V 7.26 4.36 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 0.93 0.00 0.00 3 Q 8.74 3.80 0.00 2.29 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.62 6.98 0.00 0.00 0.00 0.00 0.00 2.34 2.39 0.00 4 Q 8.61 4.37 0.00 2.03 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.66 0.00 0.00 0.00 0.00 0.00 2.28 2.33 0.00 5 N 7.55 4.83 0.00 2.67 2.62 0.00 0.00 7.02 6.68 0.00 0.00 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 8.60 4.01 0.00 1.75 1.70 0.00 1.84 0.00 0.00 1.70 0.00 0.00 2.78 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.42 1.46 7.81 7 P 0.00 4.40 0.00 2.08 1.99 0.00 3.71 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.08 0.00 8 T 8.02 4.53 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 9 R 8.23 4.12 0.00 2.06 2.22 0.00 2.96 0.00 0.00 3.26 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.68 0.00 10 S 7.90 4.10 0.00 3.91 3.89 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 11 K 8.72 4.08 0.00 1.85 1.78 0.00 1.58 0.00 0.00 1.58 0.00 0.00 2.97 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.43 1.48 7.81 12 R 7.55 3.98 0.00 1.98 2.07 0.00 3.32 0.00 0.00 3.23 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.65 0.00 13 G 8.12 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 M 8.36 4.08 0.00 2.05 2.32 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.74 2.58 0.00 15 R 8.24 3.74 0.00 1.86 2.18 0.00 3.24 0.00 0.00 3.22 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.66 0.00 16 R 8.70 4.85 0.00 2.02 1.95 0.00 3.27 0.00 0.00 3.32 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.62 0.00 17 S 7.47 4.11 0.00 3.87 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 18 H 8.03 4.49 0.00 3.16 3.38 0.00 5.67 0.00 0.00 0.00 0.00 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 D 8.86 4.75 0.00 2.70 2.66 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.43 4.31 1.23 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 21 L 8.06 4.67 0.00 1.65 1.25 0.92 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 22 T 8.00 4.36 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 23 A 8.28 4.40 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 24 V 8.20 4.08 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 0.87 0.00 0.00 0.93 0.00 0.00 25 T 7.96 3.05 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 1.21 0.00 0.00 26 S 7.96 3.71 0.00 4.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 L 8.02 4.98 0.00 1.48 1.77 0.91 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 28 S 8.20 4.90 0.00 3.91 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 V 7.93 5.15 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.94 0.00 0.00 30 D 8.77 4.42 0.00 2.65 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 31 K 8.79 3.95 0.00 1.77 1.86 0.00 1.81 0.00 0.00 1.69 0.00 0.00 2.94 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.43 1.46 7.81 32 T 7.51 3.74 4.26 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 1.15 0.00 0.00 33 S 7.27 4.49 0.00 3.55 3.43 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 34 G 8.22 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.19 4.54 0.00 1.93 1.90 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 2.33 2.23 0.00 36 K 8.82 4.80 0.00 1.79 1.88 0.00 1.52 0.00 0.00 1.77 0.00 0.00 3.01 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.42 1.46 7.81 37 H 9.18 5.22 0.00 3.38 3.47 0.00 5.27 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 38 L 8.65 4.23 0.00 0.81 1.43 0.94 0.86 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 39 R 8.37 3.75 0.00 1.71 1.81 0.00 3.27 0.00 0.00 3.17 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.55 0.00 40 H 9.84 4.34 0.00 3.39 3.53 0.00 5.95 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 H 8.29 4.90 0.00 3.24 3.30 0.00 5.51 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 I 7.84 4.22 1.70 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.60 0.81 0.00 0.00 43 T 8.09 4.23 4.29 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 1.15 0.00 0.00 44 A 8.47 4.04 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 D 7.65 4.88 0.00 3.16 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 46 G 8.17 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 Y 7.82 4.37 0.00 3.14 3.27 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 0.00 48 Y 7.95 5.34 0.00 2.75 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 49 R 7.83 4.62 0.00 1.77 1.59 0.00 2.30 0.00 0.00 2.85 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 1.51 0.00 50 G 9.40 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 0.00 0.00 0.00 51 R 7.76 4.66 0.00 1.96 1.85 0.00 3.15 0.00 0.00 3.40 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.85 0.00 52 K 8.53 4.40 0.00 1.71 1.59 0.00 1.56 0.00 0.00 1.43 0.00 0.00 2.67 0.00 0.00 3.06 0.00 0.00 0.00 0.00 0.38 0.80 7.81 53 V 7.98 4.27 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 0.71 0.00 0.00 0.89 0.00 0.00 54 I 7.89 3.26 1.81 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.39 0.85 0.00 0.00 55 A 8.70 4.53 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 56 K 7.37 4.16 0.00 1.78 1.71 0.00 1.70 0.00 0.00 1.84 0.00 0.00 3.11 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.50 1.36 7.81