NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 19 E 4.0507 8.2876 121.4505 55.4861 31.4553 176.8782 20 I 4.3001 7.5706 108.0960 58.7973 39.1404 173.0907 21 D 4.9675 7.6979 119.9487 52.4126 45.0497 175.8265 22 Y 4.4224 8.0745 121.8391 59.0317 38.9552 177.9289 23 K 3.7753 6.9629 119.1623 58.7420 33.0590 177.3106 24 D 4.6593 7.5342 120.4780 53.0372 39.4055 176.8120 25 I 3.7432 7.6710 115.0072 65.1190 37.8606 176.7792 26 A 3.9855 8.1400 121.9887 54.5939 18.1089 179.0039 27 T 3.9536 8.8497 112.1395 66.8150 69.0299 176.8475 28 L 4.3853 7.9725 119.8946 57.5777 41.4035 179.1424 29 K 4.2423 8.0862 118.5289 58.5311 32.1436 177.5592 30 N 4.4978 7.9439 114.9650 54.3730 39.1689 174.8665 31 Y 4.8193 8.2583 119.3517 57.0248 38.7733 175.3282 32 I 4.9470 7.4552 119.0671 60.0615 41.5255 175.5402 33 T 4.3681 8.4146 115.3402 60.7981 69.8250 175.1436 34 E 4.4952 8.4959 118.2458 57.0841 28.5729 177.8921 35 S 4.5859 8.8394 112.8399 57.8335 65.1673 174.7998 36 G 4.3396 8.9235 112.2092 46.6208 0.0000 174.7285 37 K 3.9395 7.8909 119.5473 56.4876 32.8330 176.2466 38 I 4.3706 8.1171 115.3692 61.1400 38.5721 175.4639 39 V 4.1508 8.0114 116.8622 59.9299 32.1056 174.8283 40 P 4.4128 0.0000 0.0000 62.9278 32.3242 177.3455 41 S 4.4742 8.9967 116.4873 60.6648 62.1480 176.4361 42 R 4.0541 8.0159 117.8203 58.5426 29.2415 177.5257 43 I 4.4360 6.9620 118.9834 61.0568 37.9658 176.3786 44 T 4.5933 7.5636 108.1922 60.2782 71.5578 176.2859 45 G 4.0865 8.0489 111.5784 46.5746 0.0000 174.0599 46 T 3.8191 7.9862 112.8910 61.7353 68.0942 174.0005 47 R 3.9406 8.5873 126.7632 56.0291 31.9364 177.5473 48 A 3.9441 8.5785 124.6525 55.2815 18.2798 179.7048 49 K 3.7295 7.9725 117.4363 60.2480 32.0908 178.3085 50 Y 4.4238 7.6100 116.0089 61.0874 37.9880 177.3907 51 Q 3.9525 8.6814 120.8868 59.5241 29.0979 179.2073 52 R 3.8625 8.1083 118.5615 59.4768 29.8856 178.8199 53 Q 3.9807 7.7264 117.7860 58.9529 29.0021 178.3591 54 L 4.1580 8.6569 122.9156 57.6132 42.1541 178.5120 55 A 3.9579 7.9385 120.6525 55.3051 18.2000 179.5840 56 R 3.7384 7.8424 115.8072 59.6001 30.2134 178.9468 57 A 4.0387 7.6136 119.7984 55.2991 18.2159 179.6649 58 I 3.5852 7.4628 117.5852 64.4924 37.0113 178.4327 59 K 3.5180 7.7463 118.1860 59.5449 32.3005 178.9894 60 R 3.3928 7.5609 115.6874 59.3730 29.0211 178.6373 61 A 4.0262 7.9893 121.2113 54.8284 18.1688 179.7578 62 R 4.2237 7.8016 117.3148 58.4321 30.1047 177.9079 63 Y 4.8084 7.5360 114.2271 58.7546 37.5229 176.4931 64 L 4.5520 7.9201 119.6565 53.5039 41.7819 176.5980 65 S 4.0401 7.9748 111.5079 59.4356 60.6259 172.1023 66 L 4.5672 7.4089 117.3784 54.5229 42.0779 176.7014 67 L 4.7086 7.3663 118.2048 52.5365 45.7064 172.7489 68 P 4.7907 0.0000 0.0000 62.1020 32.3316 175.5324 69 Y 4.1694 9.3058 120.8996 60.8755 37.6078 176.1907 70 T 4.9022 7.5887 105.4841 59.3871 72.0946 173.7816 71 D 4.4645 8.5587 119.5984 55.4188 41.2599 177.9004 72 R 4.0752 7.6281 119.4837 58.6076 30.4706 175.5465 73 H 4.3511 7.8035 122.6922 56.9547 31.1022 173.3424 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 19 E 8.29 4.05 0.00 1.88 1.86 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 2.01 1.94 0.00 20 I 7.57 4.30 1.79 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 1.19 0.88 0.73 0.00 0.00 21 D 7.70 4.97 0.00 2.51 2.42 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 22 Y 8.07 4.42 0.00 3.28 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 23 K 6.96 3.78 0.00 1.54 1.74 0.00 1.68 0.00 0.00 1.32 0.00 0.00 2.70 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.08 0.21 7.81 24 D 7.53 4.66 0.00 2.73 2.55 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.67 3.74 1.89 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.71 1.03 0.00 0.00 26 A 8.14 3.99 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 27 T 8.85 3.95 4.33 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 1.41 0.00 0.00 28 L 7.97 4.39 0.00 1.79 1.81 1.02 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 29 K 8.09 4.24 0.00 2.05 1.86 0.00 1.79 0.00 0.00 1.71 0.00 0.00 3.04 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.45 1.50 7.81 30 N 7.94 4.50 0.00 2.04 2.41 0.00 0.00 6.82 7.01 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 31 Y 8.26 4.82 0.00 3.02 2.94 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.46 4.95 1.90 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 1.52 0.69 1.00 0.00 0.00 33 T 8.41 4.37 4.25 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 0.00 0.00 0.00 1.31 0.00 0.00 34 E 8.50 4.50 0.00 1.97 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.39 0.00 35 S 8.84 4.59 0.00 3.80 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 G 8.92 4.34 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 0.00 37 K 7.89 3.94 0.00 1.97 2.00 0.00 1.53 0.00 0.00 1.89 0.00 0.00 3.02 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.52 1.47 7.81 38 I 8.12 4.37 1.99 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 1.37 0.88 0.91 0.00 0.00 39 V 8.01 4.15 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 0.70 0.00 0.00 1.06 0.00 0.00 40 P 0.00 4.41 0.00 2.09 2.00 0.00 3.61 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 2.13 2.11 0.00 41 S 9.00 4.47 0.00 3.98 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 42 R 8.02 4.05 0.00 2.01 2.06 0.00 3.08 0.00 0.00 3.23 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.73 0.00 43 I 6.96 4.44 1.89 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.60 0.92 0.00 0.00 44 T 7.56 4.59 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 1.29 0.00 0.00 45 G 8.05 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 46 T 7.99 3.82 4.39 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 1.32 0.00 0.00 47 R 8.59 3.94 0.00 1.32 1.52 0.00 3.03 0.00 0.00 2.85 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.55 0.00 48 A 8.58 3.94 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 49 K 7.97 3.73 0.00 1.68 1.47 0.00 1.66 0.00 0.00 1.68 0.00 0.00 3.00 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.61 1.57 7.81 50 Y 7.61 4.42 0.00 3.12 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 51 Q 8.68 3.95 0.00 2.20 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.82 0.00 0.00 0.00 0.00 0.00 2.37 2.47 0.00 52 R 8.11 3.86 0.00 2.05 1.95 0.00 3.18 0.00 0.00 3.08 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.82 0.00 53 Q 7.73 3.98 0.00 2.19 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.82 0.00 0.00 0.00 0.00 0.00 2.32 2.36 0.00 54 L 8.66 4.16 0.00 1.58 1.73 -0.53 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 55 A 7.94 3.96 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 56 R 7.84 3.74 0.00 2.12 1.95 0.00 3.12 0.00 0.00 3.14 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.61 0.00 57 A 7.61 4.04 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 I 7.46 3.59 2.00 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 1.53 0.79 0.86 0.00 0.00 59 K 7.75 3.52 0.00 1.40 1.45 0.00 1.63 0.00 0.00 1.70 0.00 0.00 3.04 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.35 1.57 7.81 60 R 7.56 3.39 0.00 1.66 1.90 0.00 2.78 0.00 0.00 2.84 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.48 0.00 61 A 7.99 4.03 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 R 7.80 4.22 0.00 1.59 1.46 0.00 2.60 0.00 0.00 2.61 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.49 0.00 63 Y 7.54 4.81 0.00 3.00 2.97 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 64 L 7.92 4.55 0.00 1.90 1.74 0.93 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 65 S 7.97 4.04 0.00 4.05 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 66 L 7.41 4.57 0.00 1.93 1.75 1.08 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 67 L 7.37 4.71 0.00 1.67 1.51 0.94 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 68 P 0.00 4.79 0.00 2.52 2.12 0.00 3.83 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 2.02 2.03 0.00 69 Y 9.31 4.17 0.00 3.06 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 T 7.59 4.90 4.30 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 1.31 0.00 0.00 71 D 8.56 4.46 0.00 2.72 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 72 R 7.63 4.08 0.00 1.77 1.97 0.00 3.32 0.00 0.00 3.14 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.55 0.00 73 H 7.80 4.35 0.00 3.31 3.00 0.00 5.69 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00