NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 T 4.2922 8.1749 115.2512 62.1495 69.0332 174.5662 6 N 4.6443 8.0494 115.0808 52.6026 38.6634 173.8061 7 S 4.3973 8.7523 116.0199 58.5006 64.6509 173.4227 8 D 4.8045 8.6010 121.6169 54.8320 41.8980 175.2553 9 F 5.3525 7.9400 114.4935 55.3630 41.7536 173.6622 10 V 4.5565 9.0012 118.5377 61.0528 34.9022 174.0529 11 V 4.8433 8.8982 127.1632 61.2982 33.8726 174.2656 12 I 4.9516 9.2361 128.6319 59.3335 40.6412 174.1941 13 K 5.0412 9.1065 128.7171 54.1785 34.5037 175.0131 14 A 4.3947 8.6562 130.4631 52.3386 19.0765 177.3613 15 L 4.7161 8.9953 122.5299 54.5465 42.5494 175.9400 16 E 4.6759 7.6837 115.6877 54.8427 32.3805 174.4008 17 D 4.3982 8.3352 119.2789 55.6155 41.3420 177.0644 18 G 3.8811 8.4566 109.3599 45.5073 0.0000 173.9114 19 V 3.8893 7.4763 120.3254 62.9825 32.9082 174.5172 20 N 5.3363 9.1131 124.8615 51.4590 41.5119 173.5138 21 V 4.6145 8.7227 124.5557 61.3378 33.6099 174.2396 22 I 4.6921 8.7790 129.7919 59.3557 39.7604 174.9119 23 G 4.1585 8.7361 114.9290 45.0430 0.0000 172.4051 24 L 5.4907 8.8783 125.7434 52.9502 44.0990 176.2560 25 T 4.3180 8.8744 114.7212 61.8851 69.2071 174.1091 26 R 4.2668 7.8190 126.8423 55.9998 30.8497 176.3045 27 G 3.8238 8.8465 111.2958 43.8189 0.0000 172.4869 28 A 4.0869 8.5178 122.2311 54.6039 18.5210 177.9160 29 D 4.8338 7.8447 114.1863 53.0853 42.5422 175.8792 30 T 4.7550 8.3705 119.7320 61.9423 70.6726 173.3514 31 R 4.6458 8.8079 122.2574 54.4932 33.8152 174.0634 32 F 5.3388 8.5850 118.7052 57.8791 39.0549 175.4028 33 H 4.9949 9.0333 118.3028 56.2601 30.5440 173.9483 34 H 4.9070 7.7114 117.5531 54.9601 33.1959 172.1101 35 S 4.9539 8.3198 119.1206 56.4015 65.5533 172.5812 36 E 4.4657 9.0802 125.5136 54.3221 31.0957 174.4976 37 K 4.6550 8.6308 129.1678 56.0589 33.2087 175.6299 38 L 4.9493 9.2047 127.5276 53.1783 44.6518 176.0336 39 D 4.9072 9.3170 123.7456 52.2430 43.5114 175.9048 40 K 3.9314 8.7370 121.5477 58.6106 32.2112 177.0727 41 G 4.0074 9.0709 115.5210 45.2083 0.0000 173.4277 42 E 4.2374 8.0740 119.7847 56.2646 30.8124 175.9851 43 V 4.8632 8.2943 122.1988 61.0019 34.2799 174.1665 44 L 4.7249 9.1665 129.8947 53.2628 44.6791 174.8353 45 I 4.9509 8.4673 126.4346 59.6327 39.2138 174.6598 46 A 4.7038 8.9762 129.5352 50.0614 21.6972 175.4845 47 Q 4.7962 8.6553 121.2478 55.1432 30.3169 175.8069 48 F 4.7643 8.4330 120.3331 57.9163 39.7042 175.1458 49 T 4.7235 9.1242 111.5359 59.9261 72.0170 173.9947 50 E 3.7662 8.9134 121.4964 59.2622 29.5439 177.1482 51 H 4.6070 7.8824 113.9177 55.8912 30.1020 174.2878 52 T 5.1298 8.5221 115.8885 60.9906 70.2452 173.9396 53 S 5.0029 8.7490 120.0320 58.0345 64.7861 173.2782 54 A 5.0691 7.9209 121.3417 51.2036 22.5689 175.2002 55 I 4.9470 8.6044 121.0144 59.3316 40.4660 174.7449 56 K 4.5620 8.9911 128.4685 54.5189 34.6174 174.6814 57 V 4.8499 8.3593 126.5900 61.1761 33.6395 174.6689 58 R 4.5385 9.0350 126.4612 55.5361 33.5151 175.7282 59 G 4.1131 9.0448 108.8056 44.0430 0.0000 172.4447 60 K 4.5374 9.5822 120.5260 56.0564 33.0154 175.5876 61 A 5.1349 8.7987 127.9873 50.8125 23.4122 173.7467 62 Y 4.7993 9.1721 122.2165 56.1589 40.7899 174.4930 63 I 5.0380 8.2578 127.4005 59.5336 40.7398 174.4415 64 Q 5.0772 9.1348 125.7199 54.3357 31.8642 174.8771 65 T 4.6857 8.5975 113.2542 59.3482 72.2951 174.6541 66 R 3.7217 8.5258 120.5434 59.4970 29.8904 176.5942 67 H 4.6145 7.9533 112.7029 55.3186 29.6034 173.9469 68 G 3.7822 7.3178 105.8618 44.1773 0.0000 172.9800 69 V 4.4627 8.0696 113.4490 60.4805 33.0640 175.5713 70 I 4.6614 8.3590 123.0826 59.4516 42.1644 173.3445 71 E 5.1534 8.5371 124.6414 54.4881 32.6901 175.8748 72 S 4.6419 8.7064 118.8885 57.6879 65.3432 172.7146 73 E 4.9011 8.5205 120.4900 54.0151 31.9702 176.4265 74 G 3.8591 8.8325 111.6598 46.1233 0.0000 173.0504 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 8.17 4.29 4.26 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 0.00 0.00 0.00 1.23 0.00 0.00 6 N 8.05 4.64 0.00 2.86 2.85 0.00 0.00 6.91 6.68 0.00 0.00 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 S 8.75 4.40 0.00 4.02 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 8 D 8.60 4.80 0.00 2.77 2.73 0.00 0.00 0.00 0.00 0.00 0.00 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 F 7.94 5.35 0.00 3.03 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 10 V 9.00 4.56 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 0.98 0.00 0.00 0.76 0.00 0.00 11 V 8.90 4.84 2.17 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 1.09 0.00 0.00 1.18 0.00 0.00 12 I 9.24 4.95 1.87 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.36 0.92 0.00 0.00 13 K 9.11 5.04 0.00 1.85 1.77 0.00 1.60 0.00 0.00 1.57 0.00 0.00 2.83 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.34 1.36 7.81 14 A 8.66 4.39 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 9.00 4.72 0.00 1.61 1.72 1.01 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 16 E 7.68 4.68 0.00 2.02 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 0.00 2.18 2.33 0.00 17 D 8.34 4.40 0.00 2.69 2.64 0.00 0.00 0.00 0.00 0.00 0.00 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 8.46 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.48 3.89 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 0.91 0.00 0.00 1.03 0.00 0.00 20 N 9.11 5.34 0.00 2.57 2.58 0.00 0.00 6.30 8.34 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 21 V 8.72 4.61 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 0.85 0.00 0.00 0.90 0.00 0.00 22 I 8.78 4.69 1.38 0.00 0.00 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.43 -0.08 0.00 0.00 23 G 8.74 4.16 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 0.00 0.00 0.00 24 L 8.88 5.49 0.00 1.92 1.72 1.01 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 25 T 8.87 4.32 4.31 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 1.37 0.00 0.00 26 R 7.82 4.27 0.00 1.91 2.00 0.00 3.21 0.00 0.00 3.07 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.44 0.00 27 G 8.85 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 28 A 8.52 4.09 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 29 D 7.84 4.83 0.00 2.68 2.60 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.37 4.76 4.26 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 0.00 0.00 0.00 1.28 0.00 0.00 31 R 8.81 4.65 0.00 1.83 1.93 0.00 2.77 0.00 0.00 3.19 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.67 0.00 32 F 8.59 5.34 0.00 2.91 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 33 H 9.03 4.99 0.00 3.14 3.48 0.00 5.79 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 H 7.71 4.91 0.00 3.30 3.08 0.00 5.80 0.00 0.00 0.00 0.00 6.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 S 8.32 4.95 0.00 3.74 3.62 0.00 0.00 0.00 0.00 0.00 0.00 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 E 9.08 4.47 0.00 2.11 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 2.23 2.27 0.00 37 K 8.63 4.66 0.00 1.78 1.68 0.00 1.77 0.00 0.00 1.70 0.00 0.00 2.95 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.40 1.45 7.81 38 L 9.20 4.95 0.00 1.55 1.52 0.92 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 39 D 9.32 4.91 0.00 2.56 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 40 K 8.74 3.93 0.00 1.80 1.75 0.00 1.81 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.45 1.42 7.81 41 G 9.07 4.01 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 0.00 0.00 0.00 42 E 8.07 4.24 0.00 2.05 1.87 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 2.32 2.32 0.00 43 V 8.29 4.86 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 0.80 0.00 0.00 0.94 0.00 0.00 44 L 9.17 4.72 0.00 1.72 1.46 0.90 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 45 I 8.47 4.95 1.74 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.77 0.64 0.00 0.00 46 A 8.98 4.70 1.12 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 0.00 0.00 47 Q 8.66 4.80 0.00 1.97 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.77 6.93 0.00 0.00 0.00 0.00 0.00 2.48 2.40 0.00 48 F 8.43 4.76 0.00 3.03 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 49 T 9.12 4.72 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 1.32 0.00 0.00 50 E 8.91 3.77 0.00 1.93 2.01 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 2.09 2.30 0.00 51 H 7.88 4.61 0.00 3.09 3.21 0.00 5.80 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 T 8.52 5.13 4.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 53 S 8.75 5.00 0.00 3.85 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 54 A 7.92 5.07 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 55 I 8.60 4.95 1.80 0.00 0.00 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.64 0.86 0.00 0.00 56 K 8.99 4.56 0.00 1.74 1.42 0.00 1.56 0.00 0.00 1.55 0.00 0.00 2.86 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.28 1.35 7.81 57 V 8.36 4.85 2.06 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 0.85 0.00 0.00 0.90 0.00 0.00 58 R 9.03 4.54 0.00 1.74 1.75 0.00 3.05 0.00 0.00 3.14 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.48 0.00 59 G 9.04 4.11 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 0.00 0.00 0.00 0.00 0.00 0.00 60 K 9.58 4.54 0.00 1.90 1.72 0.00 1.64 0.00 0.00 1.66 0.00 0.00 2.93 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.46 1.42 7.81 61 A 8.80 5.13 1.23 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 0.00 0.00 0.00 62 Y 9.17 4.80 0.00 3.03 2.85 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 63 I 8.26 5.04 1.92 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.55 0.86 0.00 0.00 64 Q 9.13 5.08 0.00 1.99 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.54 0.00 0.00 0.00 0.00 0.00 2.27 2.29 0.00 65 T 8.60 4.69 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 66 R 8.53 3.72 0.00 1.61 1.79 0.00 3.10 0.00 0.00 3.20 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.60 0.00 67 H 7.95 4.61 0.00 3.18 3.27 0.00 5.69 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 G 7.32 3.78 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 0.00 0.00 0.00 69 V 8.07 4.46 1.83 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 0.66 0.00 0.00 0.70 0.00 0.00 70 I 8.36 4.66 1.81 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 1.51 0.84 0.00 0.00 71 E 8.54 5.15 0.00 1.84 1.82 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 2.13 2.17 0.00 72 S 8.71 4.64 0.00 3.99 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 73 E 8.52 4.90 0.00 1.84 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.28 0.00 74 G 8.83 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 0.00 0.00 0.00