NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 T 4.1644 8.0327 110.9383 61.5787 71.2471 173.4324 6 C 4.1974 8.3738 133.3106 55.8525 43.3896 172.3675 7 G 4.3354 9.3627 118.1390 45.5615 0.0000 172.2115 8 G 4.2136 7.2267 113.8587 45.0916 0.0000 176.7751 9 E 4.2211 7.9170 115.6220 55.5379 30.7694 175.7263 10 T 5.1116 7.8796 113.7220 60.6710 71.3981 175.0858 11 C 4.6085 8.6546 123.8457 56.6703 40.9291 173.6959 12 S 4.4045 8.4340 117.9876 57.1216 64.3139 174.2612 13 A 3.9655 8.6612 122.3829 55.5217 17.9006 179.8905 14 A 4.4566 7.6098 117.7151 52.6762 18.7633 176.7509 15 Q 4.7463 7.6228 116.4873 55.8209 33.2647 175.0853 16 V 4.3489 8.8680 120.1589 61.1760 35.4975 174.1568 17 C 4.6950 8.3249 126.2738 54.6279 35.7487 172.0551 18 L 4.2540 7.7375 121.8483 54.9602 42.4506 177.6381 19 K 4.0662 9.3941 122.1065 57.4536 29.8199 175.3281 20 G 3.9114 8.4345 103.4698 45.8741 0.0000 173.8619 21 K 4.7967 7.7766 119.4987 54.6241 36.1652 174.3053 22 C 4.8517 8.9201 125.7732 57.2970 37.7795 173.4154 23 V 4.6798 9.0387 122.8270 59.7462 34.8153 174.2968 24 C 4.7183 8.8677 119.4346 57.4365 40.8912 172.9851 25 N 4.7078 8.2427 120.2365 53.2089 39.2786 174.9397 26 E 4.5474 8.5166 122.1925 56.1241 31.2547 176.1887 27 V 3.9872 7.6665 119.6872 62.2674 32.2890 174.7667 28 H 5.1138 8.2471 122.6525 54.1617 32.8162 171.8395 29 C 4.5873 8.4927 117.2113 55.2590 42.3002 175.2806 30 R 4.1493 8.3407 123.9131 56.1624 29.1542 176.5755 31 I 4.0227 7.5520 117.5469 60.3180 39.1469 174.2737 32 R 4.4639 8.2792 122.2389 54.6950 31.3003 175.3014 33 C 4.8451 8.4509 122.5450 55.1337 41.7620 173.0145 34 K 4.0430 7.8953 121.0541 58.0976 32.1097 176.4098 35 Y 4.1145 7.9579 124.5070 57.9172 39.7493 176.3838 36 G 3.8674 7.9577 107.9539 44.2719 0.0000 172.7352 37 L 4.6593 8.0118 117.9134 53.8580 42.7459 177.4762 38 K 4.0268 9.2372 124.4777 56.9253 32.9359 175.9733 39 K 5.1249 8.7924 127.1863 55.8274 33.7943 176.1048 40 D 4.9959 9.3478 124.1975 52.4364 41.9563 178.0827 41 E 3.8473 8.4508 115.9231 59.7495 30.1959 178.0812 42 N 4.5960 8.2498 115.3773 52.4709 38.3591 175.9561 43 G 3.9452 8.8040 106.1116 46.1695 0.0000 173.6388 44 C 4.5653 7.8934 117.7405 56.1256 40.9955 173.0310 45 E 4.8373 8.5136 123.0993 55.8824 30.0420 176.5194 46 Y 4.1373 9.3464 122.3767 57.0705 38.8465 174.6372 47 P 4.6138 0.0000 0.0000 66.2733 31.5044 178.4065 48 C 4.8233 7.9438 118.4860 55.5177 41.8044 173.7647 49 S 4.9036 8.3921 112.8037 56.5327 65.8448 174.5933 50 C 5.0760 8.7927 121.3990 55.9361 41.4855 173.3186 51 A 4.2186 8.8509 125.0324 51.9351 18.7067 178.0637 52 K 4.1115 8.5360 120.7309 56.4817 32.4833 176.3467 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 5 T 8.03 4.16 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 6 C 8.37 4.20 0.00 2.94 3.16 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 0.00 0.00 0.00 7 G 9.36 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 8 G 7.23 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 0.00 0.00 0.00 0.00 9 E 7.92 4.22 0.00 2.15 2.14 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 2.53 2.33 0.00 10 T 7.88 5.11 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 1.20 0.00 0.00 11 C 8.65 4.61 0.00 2.93 2.98 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 0.00 0.00 0.00 12 S 8.43 4.40 0.00 4.03 4.07 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 0.00 0.00 0.00 13 A 8.66 3.97 1.14 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 0.00 0.00 14 A 7.61 4.46 1.07 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 0.00 0.00 0.00 0.00 0.00 15 Q 7.62 4.75 0.00 2.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.64 0.00 0.00 0.00 0.00 0.00 2.24 2.23 0.00 16 V 8.87 4.35 2.05 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 0.92 0.00 0.00 0.89 0.00 0.00 17 C 8.32 4.70 0.00 3.00 2.98 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 0.00 0.00 0.00 18 L 7.74 4.25 0.00 1.78 1.56 0.90 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 19 K 9.39 4.07 0.00 1.89 1.88 0.00 1.87 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.34 1.41 7.81 20 G 8.43 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.78 4.80 0.00 1.79 1.76 0.00 1.64 0.00 0.00 1.64 0.00 0.00 2.86 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.33 1.42 7.81 22 C 8.92 4.85 0.00 2.88 3.16 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 0.00 0.00 0.00 23 V 9.04 4.68 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 0.94 0.00 0.00 0.92 0.00 0.00 24 C 8.87 4.72 0.00 2.87 3.07 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 0.00 0.00 0.00 25 N 8.24 4.71 0.00 2.55 2.62 0.00 0.00 7.01 7.53 0.00 0.00 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 E 8.52 4.55 0.00 1.96 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 2.22 2.25 0.00 27 V 7.67 3.99 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 0.72 0.00 0.00 0.91 0.00 0.00 28 H 8.25 5.11 0.00 3.15 3.21 0.00 5.75 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 C 8.49 4.59 0.00 3.13 3.12 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 0.00 0.00 0.00 0.00 30 R 8.34 4.15 0.00 1.81 2.00 0.00 3.39 0.00 0.00 3.16 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.68 0.00 31 I 7.55 4.02 1.88 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 1.31 0.75 0.97 0.00 0.00 32 R 8.28 4.46 0.00 1.76 1.78 0.00 3.44 0.00 0.00 3.22 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.54 0.00 33 C 8.45 4.85 0.00 2.99 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 34 K 7.90 4.04 0.00 1.80 1.79 0.00 1.82 0.00 0.00 1.67 0.00 0.00 3.00 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.47 1.40 7.81 35 Y 7.96 4.11 0.00 2.87 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 36 G 7.96 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 L 8.01 4.66 0.00 1.52 1.67 0.89 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 38 K 9.24 4.03 0.00 1.70 1.40 0.00 0.61 0.00 0.00 1.24 0.00 0.00 2.60 0.00 0.00 2.57 0.00 0.00 0.00 0.00 1.22 1.28 7.81 39 K 8.79 5.12 0.00 1.75 1.78 0.00 1.82 0.00 0.00 1.79 0.00 0.00 2.97 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.54 1.48 7.81 40 D 9.35 5.00 0.00 2.72 2.80 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.45 3.85 0.00 2.13 2.11 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 2.29 2.40 0.00 42 N 8.25 4.60 0.00 2.72 2.88 0.00 0.00 6.91 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 43 G 8.80 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 0.00 0.00 0.00 44 C 7.89 4.57 0.00 3.05 3.06 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 45 E 8.51 4.84 0.00 1.99 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 2.34 0.00 46 Y 9.35 4.14 0.00 2.95 2.96 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 0.00 0.00 0.00 47 P 0.00 4.61 0.00 2.23 2.27 0.00 3.71 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 1.95 0.00 48 C 7.94 4.82 0.00 3.01 3.08 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 0.00 0.00 0.00 49 S 8.39 4.90 0.00 3.57 3.55 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 50 C 8.79 5.08 0.00 2.85 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 51 A 8.85 4.22 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 52 K 8.54 4.11 0.00 1.69 1.68 0.00 1.63 0.00 0.00 1.92 0.00 0.00 3.03 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.33 1.44 7.81