NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 F 4.7768 8.3249 115.8589 56.8896 39.2493 173.6992 3 M 4.1504 8.4525 120.9501 52.7807 33.4053 174.2766 4 K 4.5601 8.2341 124.4398 55.1992 34.4790 175.5024 5 S 4.9288 8.2986 119.7812 56.1890 65.7939 174.1939 6 T 3.8630 8.5521 111.9914 63.0486 68.8634 174.3677 7 G 3.7849 8.0708 108.2921 46.8480 0.0000 173.2390 8 I 4.4961 7.6795 118.0484 58.9971 40.0003 175.7981 9 V 4.4454 8.2359 123.5922 60.9446 33.9290 174.4099 10 R 4.6911 8.1371 124.4371 54.0315 33.2836 174.5574 11 K 4.2287 8.3111 122.5765 55.6081 33.0776 176.4393 12 V 3.8519 8.1350 125.0564 62.2774 32.4135 175.8825 13 D 4.7727 7.9017 124.7976 52.1034 41.3755 176.5715 14 E 3.9126 8.7708 117.6754 59.7016 29.3042 178.1866 15 L 4.1232 8.3194 117.8442 55.1367 42.6257 175.8882 16 G 3.7156 7.8355 104.9297 47.6719 0.0000 173.5519 17 R 4.7353 8.1422 116.6972 54.0687 33.2745 176.1901 18 V 4.6248 8.0530 112.2739 59.5267 35.0797 175.2522 19 V 4.3790 8.0786 121.2602 61.0163 33.3944 175.3435 20 I 4.1172 8.1785 127.9277 59.6426 38.1217 174.1234 21 P 4.3481 0.0000 0.0000 62.7382 31.8511 177.0412 22 I 3.6216 8.4954 120.3286 64.4181 37.7872 177.6683 23 E 3.9471 8.2218 119.6556 59.2279 29.3253 178.5066 24 L 4.1664 8.0975 118.7830 57.0777 41.8240 179.3038 25 R 3.9270 7.8802 117.8583 59.3353 30.1501 179.1339 26 R 3.9064 7.9824 117.6065 59.7269 29.9825 179.3161 27 T 3.9255 7.5522 113.5475 66.0412 68.5038 175.6472 28 L 4.3134 8.2001 120.2282 54.1784 42.7886 176.0605 29 G 3.8896 7.8534 105.2648 47.8331 0.0000 173.7931 30 I 4.4846 7.7437 118.4388 59.1042 40.0257 175.4243 31 A 4.7288 9.0109 126.1887 49.8346 22.4839 175.0276 32 E 4.1071 8.5283 119.8428 57.8510 29.8662 177.4735 33 K 3.9962 8.7513 123.5533 56.7040 31.4824 175.7058 34 D 4.6315 7.8454 117.0918 54.6693 41.6869 174.8900 35 A 4.8769 8.3969 121.7676 50.5047 21.2327 175.7468 36 L 4.8184 8.6007 121.9932 52.9625 44.4400 175.4118 37 E 4.4688 8.9336 123.5099 54.5339 32.0507 174.4142 38 I 4.9419 8.2209 126.4190 59.8629 39.6784 174.4702 39 Y 4.6559 9.3596 123.8953 56.1337 41.6769 174.8165 40 V 5.0071 8.2676 120.4538 61.2694 34.1921 174.4911 41 D 4.6878 9.2539 126.4754 53.0373 42.6460 174.5282 42 D 4.3601 9.6133 119.0417 55.8933 39.6113 173.4004 43 E 3.8608 8.3545 111.9636 56.7773 27.8683 174.7769 44 K 4.6833 8.5161 118.4482 54.5488 35.1121 174.8357 45 I 4.7917 8.2020 122.3291 60.0733 38.9090 175.0510 46 I 4.4071 8.5881 127.9652 59.6947 39.0962 174.4470 47 L 5.3773 8.5336 127.4626 52.8851 43.8025 175.9963 48 K 4.6952 8.7428 121.3207 54.6742 36.7089 175.3242 49 K 4.3275 8.7353 121.7171 57.3159 32.8414 174.8408 50 Y 5.0284 8.2503 127.2789 56.0374 40.0938 174.6373 51 K 4.2297 8.7048 128.2602 53.5978 33.4891 174.1221 52 P 3.8775 0.0000 0.0000 62.8221 31.8603 175.9775 53 N 4.5654 8.4669 116.6501 53.5668 39.0733 174.4129 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 F 8.32 4.78 0.00 3.22 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 3 M 8.45 4.15 0.00 2.10 2.05 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.53 0.00 4 K 8.23 4.56 0.00 1.74 1.70 0.00 1.77 0.00 0.00 1.78 0.00 0.00 3.12 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.43 1.55 7.81 5 S 8.30 4.93 0.00 3.99 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 6 T 8.55 3.86 4.25 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 1.22 0.00 0.00 7 G 8.07 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 8 I 7.68 4.50 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 1.30 0.74 0.91 0.00 0.00 9 V 8.24 4.45 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 0.89 0.00 0.00 0.93 0.00 0.00 10 R 8.14 4.69 0.00 1.73 1.73 0.00 3.33 0.00 0.00 3.15 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.63 0.00 11 K 8.31 4.23 0.00 1.76 1.68 0.00 1.82 0.00 0.00 1.63 0.00 0.00 2.84 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.41 1.42 7.81 12 V 8.14 3.85 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 0.83 0.00 0.00 0.93 0.00 0.00 13 D 7.90 4.77 0.00 2.83 2.82 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 14 E 8.77 3.91 0.00 1.98 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 2.32 2.31 0.00 15 L 8.32 4.12 0.00 1.59 1.67 0.92 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 16 G 7.84 3.72 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 0.00 0.00 0.00 17 R 8.14 4.74 0.00 2.12 1.81 0.00 3.07 0.00 0.00 3.17 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.55 0.00 18 V 8.05 4.62 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 0.67 0.00 0.00 0.94 0.00 0.00 19 V 8.08 4.38 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 0.92 0.00 0.00 0.93 0.00 0.00 20 I 8.18 4.12 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 1.48 0.54 0.92 0.00 0.00 21 P 0.00 4.35 0.00 2.21 2.19 0.00 3.71 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 1.96 0.00 22 I 8.50 3.62 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.19 0.91 0.00 0.00 23 E 8.22 3.95 0.00 2.07 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 0.00 2.38 2.41 0.00 24 L 8.10 4.17 0.00 1.89 1.69 0.92 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 25 R 7.88 3.93 0.00 2.03 1.99 0.00 3.13 0.00 0.00 3.34 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.88 0.00 26 R 7.98 3.91 0.00 1.87 1.97 0.00 3.13 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.84 0.00 27 T 7.55 3.93 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 1.21 0.00 0.00 28 L 8.20 4.31 0.00 1.64 1.72 0.92 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 29 G 7.85 3.89 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 0.00 0.00 0.00 30 I 7.74 4.48 1.88 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.00 0.93 0.00 0.00 31 A 9.01 4.73 1.28 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 0.00 0.00 0.00 32 E 8.53 4.11 0.00 1.94 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 2.31 2.32 0.00 33 K 8.75 4.00 0.00 1.95 1.96 0.00 1.83 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.31 1.46 7.81 34 D 7.85 4.63 0.00 2.94 2.63 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.40 4.88 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.60 4.82 0.00 1.53 1.61 0.94 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 37 E 8.93 4.47 0.00 2.02 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 2.22 1.98 0.00 38 I 8.22 4.94 1.83 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 1.36 0.74 0.93 0.00 0.00 39 Y 9.36 4.66 0.00 2.99 2.90 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 0.00 0.00 0.00 40 V 8.27 5.01 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 0.93 0.00 0.00 0.93 0.00 0.00 41 D 9.25 4.69 0.00 2.84 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 42 D 9.61 4.36 0.00 2.73 2.70 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.35 3.86 0.00 2.15 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 2.22 2.32 0.00 44 K 8.52 4.68 0.00 2.01 1.67 0.00 1.66 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.34 1.62 7.81 45 I 8.20 4.79 1.89 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 1.36 0.55 0.98 0.00 0.00 46 I 8.59 4.41 1.94 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.72 0.66 0.00 0.00 47 L 8.53 5.38 0.00 1.50 1.59 0.94 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 48 K 8.74 4.70 0.00 1.72 1.68 0.00 1.11 0.00 0.00 0.71 0.00 0.00 2.87 0.00 0.00 3.48 0.00 0.00 0.00 0.00 1.25 1.43 7.81 49 K 8.74 4.33 0.00 1.81 1.80 0.00 1.76 0.00 0.00 1.64 0.00 0.00 2.68 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.47 1.50 7.81 50 Y 8.25 5.03 0.00 2.89 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 51 K 8.70 4.23 0.00 1.76 1.65 0.00 1.83 0.00 0.00 1.73 0.00 0.00 3.05 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.27 1.37 7.81 52 P 0.00 3.88 0.00 2.08 1.82 0.00 3.56 0.00 0.00 3.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.84 0.00 53 N 8.47 4.57 0.00 2.73 2.73 0.00 0.00 6.92 7.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00