NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 29 E 4.3932 8.4449 120.1849 56.1772 30.9268 174.8365 30 F 4.6644 8.5880 120.6589 54.1442 43.0142 169.5767 31 V 3.8326 8.8043 123.6662 63.5625 33.2707 174.5361 32 V 4.1555 8.4491 127.8973 62.2542 32.0418 174.9111 33 E 4.3973 8.9899 129.5120 58.0299 30.5506 175.9130 34 K 4.2170 7.2739 115.2882 56.1966 35.5765 173.8315 35 V 4.3630 8.1607 121.2071 61.7259 32.0519 175.2563 36 L 4.6080 8.5345 127.2733 55.6689 43.8185 175.5498 37 D 4.6971 7.6930 116.2029 53.7640 44.7580 173.9084 38 R 5.6120 8.7108 120.8218 55.1416 33.3452 173.8952 39 R 4.7293 9.4123 120.7460 54.9727 33.4586 173.5483 40 V 4.6745 8.1924 120.1561 61.1958 33.5018 175.0751 41 V 4.1189 8.3341 127.3012 61.8968 33.6888 174.9971 42 N 4.4285 9.0753 126.0814 55.7544 35.4448 174.0624 43 G 4.0992 8.1250 98.9759 46.3595 0.0000 173.4556 44 K 4.5357 7.5810 116.5538 53.9073 35.9494 176.3069 45 V 4.1291 8.2016 123.5504 62.9024 32.8273 174.4902 46 E 5.1375 9.1671 126.0101 54.8047 34.0859 174.0870 47 Y 5.4036 9.0355 119.7632 56.2508 41.9803 174.4656 48 F 4.3432 8.6439 126.1671 57.1717 40.5215 174.3147 49 L 4.6590 7.7511 125.8481 52.4822 45.0364 175.1498 50 K 4.5893 7.9382 123.4443 53.8596 33.7845 175.0906 51 W 5.0326 8.4140 126.6910 54.8781 31.5091 175.6225 52 K 4.3387 8.8360 124.9103 57.4832 32.2199 177.1378 53 G 3.8208 9.0025 112.8381 46.0026 0.0000 172.5970 54 F 4.6995 7.7667 115.6673 55.5455 42.4198 174.1763 55 T 4.5813 8.0279 114.9507 60.2163 69.0166 175.0817 56 D 4.5885 8.5679 123.0846 56.7940 40.9706 178.8716 57 A 4.1482 7.9329 121.0629 54.6906 18.7698 177.9626 58 D 4.5799 7.8229 113.4718 55.5806 41.1054 176.4942 59 N 4.7809 7.6944 118.2645 53.5308 39.9501 174.2121 60 T 5.0299 7.7575 110.7569 59.7973 72.6431 173.1924 61 W 5.0092 9.3184 124.6541 57.1076 30.0252 175.4131 62 E 5.0667 9.5398 123.3498 53.6815 33.4200 173.9265 63 P 4.8191 0.0000 0.0000 62.3257 32.5093 176.8683 64 E 4.2711 8.8525 118.9003 59.7616 29.3105 179.2467 65 E 4.2044 8.1468 115.2848 58.1358 29.8771 177.4495 66 N 4.5786 8.2496 116.6665 55.0449 38.8645 174.9603 67 L 4.6631 7.6782 118.7839 52.9833 43.0081 176.7965 68 D 4.4909 8.6005 121.8080 56.3170 40.5020 176.7487 69 C 5.0139 7.6965 118.3554 57.5699 32.4953 172.3020 70 P 4.2413 0.0000 0.0000 65.1307 30.9460 178.1928 71 E 3.9538 8.2692 118.7273 59.4346 29.3792 178.7481 72 L 3.9979 7.7956 119.8848 58.1395 42.1410 179.1891 73 I 3.6944 7.4224 119.2587 64.4608 37.1109 178.1654 74 E 4.0829 8.5320 119.4484 59.1788 29.3111 179.1969 75 A 4.0032 8.4410 121.3257 55.0939 18.2530 179.2280 76 F 4.1332 7.9256 117.6329 61.7229 39.2139 177.1230 77 L 3.9595 8.0919 118.3924 57.8553 41.3292 179.3031 78 N 4.4764 8.6881 117.0990 55.8593 38.2315 176.7814 79 S 4.4960 7.6179 112.4625 59.3272 63.2606 174.4530 80 Q 4.4548 7.4162 119.2277 55.9931 30.9869 175.6964 81 K 4.1380 7.5681 121.7395 56.5635 32.0591 176.6234 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 29 E 8.44 4.39 0.00 1.89 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 2.26 2.33 0.00 30 F 8.59 4.66 0.00 2.76 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 31 V 8.80 3.83 2.26 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 1.01 0.00 0.00 1.02 0.00 0.00 32 V 8.45 4.16 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 0.49 0.00 0.00 0.66 0.00 0.00 33 E 8.99 4.40 0.00 1.97 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 0.00 2.20 2.21 0.00 34 K 7.27 4.22 0.00 1.67 1.72 0.00 1.46 0.00 0.00 1.67 0.00 0.00 2.70 0.00 0.00 2.62 0.00 0.00 0.00 0.00 1.17 1.22 7.81 35 V 8.16 4.36 1.89 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 0.69 0.00 0.00 0.66 0.00 0.00 36 L 8.53 4.61 0.00 1.61 1.72 0.77 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 37 D 7.69 4.70 0.00 2.66 2.24 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 38 R 8.71 5.61 0.00 2.19 1.93 0.00 3.61 0.00 0.00 3.43 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.60 0.00 39 R 9.41 4.73 0.00 1.60 1.70 0.00 2.21 0.00 0.00 2.25 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 1.24 0.00 40 V 8.19 4.67 2.03 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 0.75 0.00 0.00 0.90 0.00 0.00 41 V 8.33 4.12 1.97 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 0.86 0.00 0.00 0.71 0.00 0.00 42 N 9.08 4.43 0.00 2.86 2.86 0.00 0.00 7.29 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 8.12 4.10 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 K 7.58 4.54 0.00 1.89 1.64 0.00 1.67 0.00 0.00 1.57 0.00 0.00 2.99 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.34 1.33 7.81 45 V 8.20 4.13 1.94 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 0.56 0.00 0.00 0.90 0.00 0.00 46 E 9.17 5.14 0.00 1.95 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 0.00 2.22 2.36 0.00 47 Y 9.04 5.40 0.00 2.88 2.74 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.64 4.34 0.00 1.51 2.35 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 49 L 7.75 4.66 0.00 0.34 0.40 0.26 0.03 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 50 K 7.94 4.59 0.00 1.62 1.54 0.00 1.66 0.00 0.00 1.83 0.00 0.00 2.96 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.26 1.20 7.81 51 W 8.41 5.03 0.00 3.19 2.91 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 52 K 8.84 4.34 0.00 1.87 1.88 0.00 2.00 0.00 0.00 1.74 0.00 0.00 3.14 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.51 1.48 7.81 53 G 9.00 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 54 F 7.77 4.70 0.00 3.26 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 55 T 8.03 4.58 4.27 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 1.30 0.00 0.00 56 D 8.57 4.59 0.00 2.78 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 A 7.93 4.15 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 7.82 4.58 0.00 2.95 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 N 7.69 4.78 0.00 2.25 1.55 0.00 0.00 6.43 6.86 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 60 T 7.76 5.03 4.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 61 W 9.32 5.01 0.00 3.33 3.33 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 62 E 9.54 5.07 0.00 1.98 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 2.42 2.68 0.00 63 P 0.00 4.82 0.00 2.59 2.23 0.00 3.85 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.03 0.00 64 E 8.85 4.27 0.00 2.45 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 0.00 2.33 2.35 0.00 65 E 8.15 4.20 0.00 2.14 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 0.00 2.33 2.32 0.00 66 N 8.25 4.58 0.00 3.10 3.08 0.00 0.00 6.92 7.18 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 67 L 7.68 4.66 0.00 1.85 1.56 1.14 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 68 D 8.60 4.49 0.00 2.77 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 C 7.70 5.01 0.00 2.91 2.75 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.24 0.00 2.46 2.43 0.00 3.78 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.28 0.00 71 E 8.27 3.95 0.00 2.08 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 0.00 2.42 2.47 0.00 72 L 7.80 4.00 0.00 1.79 1.73 0.90 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 73 I 7.42 3.69 1.70 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.10 0.82 0.00 0.00 74 E 8.53 4.08 0.00 2.04 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 0.00 2.69 2.59 0.00 75 A 8.44 4.00 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 76 F 7.93 4.13 0.00 2.98 3.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 L 8.09 3.96 0.00 1.82 1.73 1.09 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 78 N 8.69 4.48 0.00 2.72 2.86 0.00 0.00 6.80 7.30 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 79 S 7.62 4.50 0.00 4.01 4.12 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 80 Q 7.42 4.45 0.00 2.05 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.82 7.03 0.00 0.00 0.00 0.00 0.00 2.07 1.99 0.00 81 K 7.57 4.14 0.00 1.67 1.70 0.00 1.73 0.00 0.00 1.74 0.00 0.00 2.99 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.45 1.53 7.81