NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.3627 8.2644 123.5845 52.1942 18.8737 175.6531 3 R 4.3636 7.8471 117.6485 53.5587 31.7594 174.6877 4 K 4.1266 7.9890 120.8561 58.5808 33.1197 177.2941 5 A 4.0272 8.0153 121.1109 55.3652 18.2311 179.6471 6 L 3.9749 7.9197 117.2373 57.9964 41.9096 178.9991 7 I 3.5305 7.5361 112.8062 64.5092 37.1432 177.8636 8 E 3.8697 8.0561 119.3126 59.1423 29.3535 178.7601 9 K 3.8491 8.0591 118.1806 59.6908 32.1339 178.2289 10 A 3.9287 8.6361 121.0484 54.7468 18.3243 179.3520 11 K 3.9222 7.4142 115.5832 58.8997 32.5666 178.1694 12 R 4.1156 7.0919 116.5530 57.2978 30.6389 176.8529 13 T 4.6732 8.2418 112.8325 63.1808 71.7523 175.6599 14 P 3.9824 0.0000 0.0000 65.2457 32.4131 176.6636 15 K 3.8094 8.0683 117.2840 55.7772 33.0509 177.0045 16 F 3.7031 6.3633 117.9145 55.4877 37.7848 177.3237 17 K 4.0060 8.9199 124.5064 59.4477 32.5587 178.9822 18 V 3.5843 8.1346 118.9762 66.2994 31.2897 177.3176 19 R 4.0266 7.8489 115.5000 57.7085 29.9565 176.6229 20 A 4.0895 7.8738 121.4105 52.6334 17.7085 176.1731 21 Y 4.9079 8.0383 119.2152 55.6851 41.0033 176.1003 22 T 4.2129 8.3558 110.6839 61.5757 70.6402 173.4166 23 R 5.0550 8.3261 126.8458 56.2174 32.1284 173.3295 24 C 3.8887 8.9332 125.9238 60.0856 32.2201 174.1273 25 V 3.7310 8.5878 126.3347 66.1408 30.8635 177.5732 26 R 4.0163 7.5475 117.7474 57.9362 30.4857 175.8853 27 C 4.5758 7.6171 114.4212 56.8260 31.7882 175.2275 28 G 3.9209 8.4196 111.9630 45.1557 0.0000 171.9792 29 R 4.5527 7.7337 120.6261 54.7347 32.6550 176.1269 30 A 4.0756 8.6916 127.7122 53.8659 19.5557 177.6407 31 R 4.2809 7.9160 113.8484 56.1325 31.5143 176.3310 32 S 3.5480 8.2577 112.6441 59.4766 61.5814 170.4737 33 V 4.5905 7.2331 120.1897 62.2163 33.9087 173.5660 34 Y 4.8443 8.1332 117.5854 56.1026 40.9522 177.2934 35 R 4.0754 8.7970 120.8479 57.8581 31.7897 177.3679 36 F 4.7603 8.0199 119.6712 58.8024 38.3055 179.4413 37 F 3.3304 8.1267 113.8655 59.4182 39.1583 177.0070 38 G 3.9384 8.8783 106.7238 45.5867 0.0000 172.5806 39 L 5.0357 7.7285 119.0240 52.7630 44.6939 175.1026 40 C 5.1676 8.0764 115.0501 56.5566 32.9791 174.5999 41 R 3.8820 8.1059 118.3140 60.4511 28.5006 178.3323 42 I 3.6091 7.8913 118.4328 64.5210 37.2176 177.3875 43 C 3.9652 8.1493 116.1434 63.5191 28.1461 175.8297 44 L 3.3961 8.6492 120.7620 58.6480 41.5024 179.0680 45 R 3.7122 7.7657 118.8773 60.0587 30.2915 177.9740 46 E 4.0201 8.3441 118.3643 59.1001 29.3234 178.8986 47 L 3.8928 7.8276 117.7019 58.1544 40.3490 179.2769 48 A 3.8797 8.3197 120.6422 56.0052 17.9740 179.5432 49 H 4.5279 7.8058 112.8856 58.5798 28.7624 178.0612 50 K 4.1768 7.9648 120.3796 60.3765 32.3801 177.5126 51 G 3.8210 7.4934 105.1076 45.7707 0.0000 175.4667 52 Q 4.1186 8.2013 116.4303 56.9281 28.3212 176.4099 53 L 4.6525 7.6283 119.4668 51.6542 42.1195 173.8233 54 P 4.0838 0.0000 0.0000 64.0960 31.7021 178.1607 55 G 4.0023 8.8775 108.8237 46.0864 0.0000 173.6708 56 V 3.9419 7.6890 120.2912 62.4370 32.0896 175.1984 57 R 4.5633 8.2311 125.9618 53.8237 33.0960 173.7375 58 K 3.8130 8.8039 124.7766 56.2008 31.3792 175.7068 59 A 4.1431 8.1888 127.7927 52.8439 18.9133 177.3933 60 S 4.5185 8.5123 115.7346 57.4593 66.8438 174.8936 61 W 4.8120 8.3284 121.9410 56.8694 27.7008 174.4681 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 A 8.26 4.36 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 3 R 7.85 4.36 0.00 1.82 1.89 0.00 3.42 0.00 0.00 3.21 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.71 0.00 4 K 7.99 4.13 0.00 1.92 1.69 0.00 1.70 0.00 0.00 1.83 0.00 0.00 3.07 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.50 1.76 7.81 5 A 8.02 4.03 1.35 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 0.00 0.00 6 L 7.92 3.97 0.00 1.91 1.82 1.02 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 7 I 7.54 3.53 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 1.83 0.70 1.06 0.00 0.00 8 E 8.06 3.87 0.00 2.20 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 0.00 2.39 2.36 0.00 9 K 8.06 3.85 0.00 1.91 2.09 0.00 1.85 0.00 0.00 1.79 0.00 0.00 3.11 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.55 1.53 7.81 10 A 8.64 3.93 0.98 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 0.00 0.00 11 K 7.41 3.92 0.00 1.89 1.86 0.00 1.71 0.00 0.00 1.68 0.00 0.00 2.99 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.43 1.70 7.81 12 R 7.09 4.12 0.00 1.95 1.88 0.00 3.11 0.00 0.00 3.23 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.72 0.00 13 T 8.24 4.67 4.22 0.00 0.00 0.00 0.00 0.00 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 14 P 0.00 3.98 0.00 2.13 2.09 0.00 3.60 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 2.03 0.00 15 K 8.07 3.81 0.00 1.75 1.81 0.00 1.31 0.00 0.00 1.30 0.00 0.00 2.97 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.40 1.56 7.81 16 F 6.36 3.70 0.00 3.15 3.07 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 0.00 0.00 0.00 17 K 8.92 4.01 0.00 1.97 2.13 0.00 1.55 0.00 0.00 1.77 0.00 0.00 3.07 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.57 1.51 7.81 18 V 8.13 3.58 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 0.83 0.00 0.00 0.98 0.00 0.00 19 R 7.85 4.03 0.00 2.00 2.12 0.00 3.42 0.00 0.00 3.34 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.73 0.00 20 A 7.87 4.09 1.34 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 0.00 0.00 0.00 0.00 0.00 0.00 21 Y 8.04 4.91 0.00 3.09 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 22 T 8.36 4.21 4.29 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 23 R 8.33 5.06 0.00 1.84 1.82 0.00 3.50 0.00 0.00 3.37 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.58 0.00 24 C 8.93 3.89 0.00 3.05 3.31 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 25 V 8.59 3.73 2.19 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 0.81 0.00 0.00 0.97 0.00 0.00 26 R 7.55 4.02 0.00 1.84 1.89 0.00 3.23 0.00 0.00 3.26 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.61 0.00 27 C 7.62 4.58 0.00 3.08 2.92 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 28 G 8.42 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 0.00 0.00 0.00 29 R 7.73 4.55 0.00 1.85 1.81 0.00 3.20 0.00 0.00 3.39 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.62 0.00 30 A 8.69 4.08 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 31 R 7.92 4.28 0.00 1.85 1.89 0.00 3.37 0.00 0.00 3.29 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.62 0.00 32 S 8.26 3.55 0.00 4.15 4.08 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 33 V 7.23 4.59 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 1.01 0.00 0.00 1.04 0.00 0.00 34 Y 8.13 4.84 0.00 3.14 3.05 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 0.00 0.00 0.00 35 R 8.80 4.08 0.00 1.89 2.05 0.00 3.20 0.00 0.00 3.18 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.64 0.00 36 F 8.02 4.76 0.00 2.74 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 37 F 8.13 3.33 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 38 G 8.88 3.94 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 0.00 0.00 0.00 0.00 0.00 0.00 39 L 7.73 5.04 0.00 1.56 1.50 0.83 0.83 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 40 C 8.08 5.17 0.00 3.20 3.09 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 41 R 8.11 3.88 0.00 2.15 2.42 0.00 2.82 0.00 0.00 3.22 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.74 0.00 42 I 7.89 3.61 1.87 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 1.66 0.82 0.91 0.00 0.00 43 C 8.15 3.97 0.00 3.12 2.92 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 44 L 8.65 3.40 0.00 1.21 1.51 0.19 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 45 R 7.77 3.71 0.00 1.78 2.04 0.00 3.36 0.00 0.00 3.22 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.59 0.00 46 E 8.34 4.02 0.00 2.22 1.91 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 2.33 2.63 0.00 47 L 7.83 3.89 0.00 1.67 1.69 0.87 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 48 A 8.32 3.88 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 H 7.81 4.53 0.00 3.31 3.34 0.00 5.66 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 K 7.96 4.18 0.00 1.87 1.86 0.00 1.68 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.48 1.45 7.81 51 G 7.49 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 52 Q 8.20 4.12 0.00 2.05 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.96 0.00 0.00 0.00 0.00 0.00 2.37 2.39 0.00 53 L 7.63 4.65 0.00 1.62 1.78 0.67 0.98 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 54 P 0.00 4.08 0.00 2.23 2.06 0.00 3.84 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.16 0.00 55 G 8.88 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 V 7.69 3.94 2.32 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 0.82 0.00 0.00 1.43 0.00 0.00 57 R 8.23 4.56 0.00 1.78 1.76 0.00 3.34 0.00 0.00 3.19 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.61 0.00 58 K 8.80 3.81 0.00 1.77 1.79 0.00 1.88 0.00 0.00 1.71 0.00 0.00 2.85 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.45 1.42 7.81 59 A 8.19 4.14 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.51 4.52 0.00 3.88 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 W 8.33 4.81 0.00 3.22 3.09 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