NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 D 4.5836 8.3601 120.5295 54.4303 42.2408 174.3036 3 A 4.4246 8.2774 118.8742 52.8314 20.6281 177.2427 4 Q 3.9186 8.7106 119.3332 59.8226 29.5795 176.2905 5 T 3.7452 7.9687 115.0645 66.9907 68.7180 176.2617 6 R 4.0478 7.8572 119.1592 59.2991 30.2177 178.7329 7 R 3.9015 8.5330 119.0872 59.4110 29.9498 178.2692 8 R 3.8453 8.6459 119.0996 59.6237 30.1081 178.3160 9 E 4.1572 8.2036 118.1599 59.3475 29.2148 179.2087 10 R 4.1572 8.0719 116.9031 57.9074 29.8836 177.9979 11 R 4.3028 8.2739 117.2776 56.3077 30.3020 177.7234 12 A 4.5415 7.7567 121.9631 55.3580 18.3478 179.6418 13 E 3.6664 8.1294 116.6320 59.2457 29.5920 179.2025 14 K 4.1517 7.8567 118.1351 59.0396 31.5526 179.3771 15 Q 4.0143 9.5068 118.6164 59.0809 28.7851 178.5508 16 A 4.8583 8.8818 122.5548 54.9645 18.1078 179.6304 17 Q 4.0440 7.9027 115.9506 58.4362 29.1358 178.1300 18 W 4.1511 8.4969 129.7970 60.4704 30.9903 178.3355 19 K 3.8792 10.1019 118.5130 59.5010 31.2633 179.1579 20 A 4.0710 8.0318 120.0222 53.8645 18.2492 177.8216 21 A 4.5838 7.4737 119.3106 51.5523 19.9599 176.8206 22 N 4.5166 7.1883 114.6669 52.6431 39.7791 175.1171 23 P 4.2822 0.0000 0.0000 65.1756 32.3289 178.6949 24 L 3.9379 7.8681 118.7067 58.1095 40.2441 177.5076 25 L 4.7288 7.2670 118.0551 53.7874 42.1346 177.0730 26 V 4.1080 8.1923 119.9752 62.0814 33.2604 174.2868 27 G 3.7959 9.0430 112.0965 45.8908 0.0000 171.7654 28 V 3.5264 8.1408 124.1014 64.0798 32.1551 175.6745 29 S 3.7304 8.7068 117.9178 59.7761 60.2846 172.2575 30 A 4.7291 7.7229 116.8671 51.6278 19.1924 177.2263 31 K 4.5165 7.8016 120.4214 53.9439 34.7504 175.5456 32 P 4.5464 0.0000 0.0000 62.6206 32.2486 175.2961 33 V 4.4943 7.7299 110.5931 60.5947 35.8313 175.2086 34 N 5.0938 8.3324 113.4422 51.9600 39.4404 176.8734 35 R 4.7264 7.2369 115.2257 54.6015 30.7511 174.0785 36 P 4.3984 0.0000 0.0000 63.7373 31.4218 177.2136 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 D 8.36 4.58 0.00 2.67 2.72 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.28 4.42 1.30 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 0.00 0.00 0.00 4 Q 8.71 3.92 0.00 2.12 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.72 0.00 0.00 0.00 0.00 0.00 2.40 2.43 0.00 5 T 7.97 3.75 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 1.20 0.00 0.00 6 R 7.86 4.05 0.00 1.83 1.98 0.00 3.13 0.00 0.00 3.44 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.67 0.00 7 R 8.53 3.90 0.00 1.87 2.04 0.00 3.10 0.00 0.00 3.08 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.64 0.00 8 R 8.65 3.85 0.00 2.03 1.99 0.00 3.13 0.00 0.00 3.12 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.69 0.00 9 E 8.20 4.16 0.00 2.19 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 2.32 2.49 0.00 10 R 8.07 4.16 0.00 1.78 1.94 0.00 3.15 0.00 0.00 3.22 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.66 0.00 11 R 8.27 4.30 0.00 1.85 1.92 0.00 3.29 0.00 0.00 3.17 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.75 0.00 12 A 7.76 4.54 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 13 E 8.13 3.67 0.00 2.01 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 2.41 2.35 0.00 14 K 7.86 4.15 0.00 1.91 1.87 0.00 1.70 0.00 0.00 1.85 0.00 0.00 2.94 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.54 1.48 7.81 15 Q 9.51 4.01 0.00 2.33 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.94 0.00 0.00 0.00 0.00 0.00 2.30 2.26 0.00 16 A 8.88 4.86 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 7.90 4.04 0.00 2.42 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.05 6.93 0.00 0.00 0.00 0.00 0.00 2.49 2.51 0.00 18 W 8.50 4.15 0.00 3.48 3.42 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 19 K 10.10 3.88 0.00 2.13 2.00 0.00 1.90 0.00 0.00 1.79 0.00 0.00 3.08 0.00 0.00 3.00 0.00 0.00 0.00 0.00 2.05 2.09 7.81 20 A 8.03 4.07 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.47 4.58 1.08 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 0.00 0.00 22 N 7.19 4.52 0.00 1.44 1.42 0.00 0.00 5.19 7.00 0.00 0.00 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 P 0.00 4.28 0.00 2.26 2.23 0.00 3.49 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 1.97 1.86 0.00 24 L 7.87 3.94 0.00 1.74 1.78 0.90 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 25 L 7.27 4.73 0.00 1.81 2.23 1.10 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 26 V 8.19 4.11 2.33 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 0.75 0.00 0.00 1.31 0.00 0.00 27 G 9.04 3.80 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 0.00 0.00 0.00 28 V 8.14 3.53 2.09 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 0.92 0.00 0.00 0.95 0.00 0.00 29 S 8.71 3.73 0.00 4.06 3.92 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.72 4.73 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 31 K 7.80 4.52 0.00 1.70 1.69 0.00 1.73 0.00 0.00 1.74 0.00 0.00 2.92 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.29 1.36 7.81 32 P 0.00 4.55 0.00 2.16 2.05 0.00 3.67 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.96 0.00 33 V 7.73 4.49 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 0.84 0.00 0.00 0.92 0.00 0.00 34 N 8.33 5.09 0.00 2.61 2.69 0.00 0.00 6.57 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 35 R 7.24 4.73 0.00 1.86 1.88 0.00 3.03 0.00 0.00 3.27 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.61 0.00 36 P 0.00 4.40 0.00 2.20 2.07 0.00 3.79 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.95 0.00