NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.8547 8.3544 109.7459 45.6082 0.0000 172.6103 2 Y 4.3914 8.3613 127.1995 54.9258 39.6147 173.7785 3 I 4.1085 8.6828 130.7383 59.0783 38.2103 174.0670 4 P 4.2058 0.0000 0.0000 62.1176 31.7929 177.8075 5 E 4.1684 8.2535 121.4000 56.2143 27.3611 176.5440 6 A 3.9551 8.1244 125.8146 54.1278 18.9815 175.1487 7 P 4.1936 0.0000 0.0000 62.9738 31.0205 175.3186 8 R 4.6961 8.1701 122.0182 54.7061 33.4143 174.9157 9 D 4.5791 8.2358 118.2249 53.9853 43.0401 176.4943 10 G 3.9296 8.2936 104.0614 46.0577 0.0000 173.3781 11 Q 4.6981 7.5227 117.3286 54.3936 30.2087 175.1197 12 A 4.5771 8.5008 124.2086 50.2969 22.2186 174.3736 13 Y 5.1150 8.2986 120.4333 57.3808 39.2516 175.1949 14 V 4.7404 9.9120 123.9378 61.2992 35.5817 174.6167 15 R 4.2947 8.6169 125.2609 54.7629 29.7668 174.8639 16 K 4.4443 9.1917 126.0612 55.4687 34.2620 176.3889 17 D 4.3399 9.6600 120.9279 55.2574 39.5572 174.4410 18 G 3.8179 8.3722 102.9084 44.9040 0.0000 173.4713 19 E 4.6382 8.2953 119.0130 53.8256 33.7719 174.9472 20 W 5.1393 8.5126 121.4228 56.3871 30.0362 176.2603 21 V 4.6280 9.6966 124.9311 60.9976 34.6649 174.0240 22 L 4.9217 8.5492 127.4969 55.0324 41.9566 178.3988 23 L 4.2451 9.2888 122.3473 55.9238 43.0592 175.4332 24 S 3.4332 8.9587 116.0236 59.8933 60.8186 173.1638 25 T 4.2318 8.2280 123.0283 63.2363 69.0663 174.7397 26 F 4.5014 8.3807 126.1910 56.7070 41.4424 175.4938 27 L 4.1059 7.6005 122.1911 55.3074 41.8982 176.3754 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 G 8.35 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 2 Y 8.36 4.39 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 3 I 8.68 4.11 1.76 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 1.39 0.66 0.85 0.00 0.00 4 P 0.00 4.21 0.00 1.97 1.91 0.00 3.61 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.07 0.00 5 E 8.25 4.17 0.00 1.85 1.84 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 2.22 2.25 0.00 6 A 8.12 3.96 1.25 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 0.00 0.00 0.00 7 P 0.00 4.19 0.00 2.03 2.08 0.00 3.48 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.08 0.00 8 R 8.17 4.70 0.00 1.83 1.74 0.00 3.18 0.00 0.00 3.13 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.52 0.00 9 D 8.24 4.58 0.00 2.76 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 10 G 8.29 3.93 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 0.00 0.00 0.00 11 Q 7.52 4.70 0.00 2.19 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.01 6.64 0.00 0.00 0.00 0.00 0.00 2.70 2.55 0.00 12 A 8.50 4.58 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 8.30 5.11 0.00 2.74 2.95 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 14 V 9.91 4.74 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 0.99 0.00 0.00 1.07 0.00 0.00 15 R 8.62 4.29 0.00 1.21 1.40 0.00 2.59 0.00 0.00 2.69 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.50 0.00 16 K 9.19 4.44 0.00 1.73 1.65 0.00 1.87 0.00 0.00 1.60 0.00 0.00 2.85 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.38 1.50 7.81 17 D 9.66 4.34 0.00 2.71 2.65 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 0.00 0.00 0.00 0.00 18 G 8.37 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 0.00 0.00 0.00 19 E 8.30 4.64 0.00 1.89 1.78 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 2.14 2.35 0.00 20 W 8.51 5.14 0.00 3.13 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 21 V 9.70 4.63 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 0.97 0.00 0.00 0.99 0.00 0.00 22 L 8.55 4.92 0.00 1.84 2.00 0.49 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 23 L 9.29 4.25 0.00 1.48 1.75 1.04 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 24 S 8.96 3.43 0.00 3.99 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 25 T 8.23 4.23 4.28 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 1.27 0.00 0.00 26 F 8.38 4.50 0.00 2.93 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 27 L 7.60 4.11 0.00 1.41 1.29 0.96 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00