NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 P 4.4897 0.0000 0.0000 62.4229 33.6246 175.1296 2 I 4.8112 8.2245 122.8461 59.3006 40.4500 172.7849 3 A 4.7441 9.1548 130.0263 50.0097 22.0260 174.6038 4 Q 4.8592 8.6995 123.0276 54.4601 31.3424 174.4049 5 I 4.4361 8.6942 128.3387 59.9564 39.6484 174.5156 6 H 5.2094 8.8302 124.4721 54.2933 29.8799 174.2011 7 I 4.5847 8.4469 117.0290 58.5510 41.0738 175.0069 8 L 4.6575 8.2865 123.2422 54.2009 42.4445 176.8977 9 E 4.0108 9.1172 121.3838 57.1933 30.1768 176.5000 10 G 3.4497 8.7536 112.4702 45.6410 0.0000 174.3859 11 R 4.3657 7.5439 119.6695 55.5085 31.2776 176.6308 12 S 4.5638 8.4538 115.2165 57.6921 65.6656 175.1365 13 D 4.3699 8.4856 122.0221 57.6828 40.5450 178.9991 14 E 4.0187 8.0947 118.6090 59.3877 29.5223 179.2401 15 Q 3.9997 7.8612 117.7995 58.9007 28.8052 178.8154 16 K 4.0888 8.1549 119.3807 58.9369 32.1034 179.0846 17 E 3.9847 8.2840 120.0030 59.3224 29.5235 179.0305 18 T 3.8785 7.8992 115.9951 66.3309 68.5655 176.4054 19 L 3.9204 7.8875 122.2709 58.4489 41.9766 179.1617 20 I 3.7120 7.7905 119.5659 64.1695 36.9429 178.5617 21 R 3.9014 7.7514 119.1282 59.4119 30.0258 178.0861 22 E 3.8923 8.5548 118.6982 59.7233 29.5440 179.6132 23 V 3.5996 7.9013 117.8856 66.2151 31.6347 178.2465 24 S 4.1488 7.8512 115.0028 61.5390 62.6288 176.5935 25 E 3.9526 8.2655 121.1194 59.2530 29.2642 178.9151 26 A 4.0344 8.0973 120.8554 55.4071 18.3581 179.8818 27 I 3.6464 7.7917 118.0645 64.4000 37.2347 178.3946 28 S 4.1653 7.9073 113.9880 61.6353 62.3896 176.5655 29 R 4.0272 8.4819 118.9313 59.2304 29.0879 178.8695 30 S 4.2846 8.0361 115.3214 60.3915 62.8971 175.4550 31 L 4.5495 7.6742 118.3763 53.1110 42.3449 175.5969 32 D 4.3322 7.4668 115.7878 55.0988 40.2398 172.8782 33 A 4.7193 7.6635 118.8766 48.9218 21.0979 176.1193 34 P 4.3104 0.0000 0.0000 62.5260 32.1270 177.0005 35 L 3.9348 8.8782 124.9010 58.4095 41.9972 178.9651 36 T 3.9837 7.9072 107.0865 63.7981 68.6807 174.8046 37 S 4.4117 8.0419 116.1315 59.1601 63.8537 174.5990 38 V 4.0168 7.5112 122.3022 62.8937 32.1083 175.4961 39 R 4.6439 8.7181 125.5768 54.4283 33.3895 174.3771 40 V 4.8486 8.5355 123.5669 61.0663 34.3291 174.6358 41 I 4.5771 8.7664 127.4143 59.6359 40.4362 174.2321 42 I 4.7497 8.4208 127.7424 59.9820 39.1160 175.2839 43 T 4.5121 8.6941 123.0126 61.7740 71.4376 173.1480 44 E 4.8039 8.8408 126.2116 55.9699 31.0456 175.8615 45 M 4.8650 8.9397 122.4111 53.2037 35.3291 175.3465 46 A 4.7080 8.4526 124.3660 51.0980 19.4207 178.6202 47 K 3.7977 9.4153 121.1228 59.2407 32.3719 178.7982 48 G 4.1525 8.0094 105.1754 45.6745 0.0000 173.4548 49 H 4.9577 8.8723 115.0640 54.9591 29.7345 173.4450 50 F 5.0767 8.1725 122.6112 56.3001 41.4259 173.6494 51 G 4.1440 8.3550 116.6689 43.6296 0.0000 172.6479 52 I 4.0215 8.2704 123.3636 60.0065 39.4493 175.9917 53 G 3.8895 9.4532 113.0156 46.1583 0.0000 173.4478 54 G 3.9715 8.3740 108.8569 44.8721 0.0000 174.2239 55 E 4.4877 7.6152 118.5411 54.6921 31.1256 175.7889 56 L 4.4657 8.0838 120.5711 54.3218 42.5381 178.3209 57 A 4.0470 8.8668 125.8183 55.3195 18.5605 179.6372 58 S 4.2886 7.9214 110.3394 60.1378 63.3295 174.4990 59 K 4.1731 7.6672 124.4041 56.6895 32.3365 175.6196 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 1 P 0.00 4.49 0.00 2.09 2.03 0.00 3.64 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.12 0.00 2 I 8.22 4.81 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 1.27 0.71 0.91 0.00 0.00 3 A 9.15 4.74 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.70 4.86 0.00 2.02 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.71 6.65 0.00 0.00 0.00 0.00 0.00 2.10 2.27 0.00 5 I 8.69 4.44 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 1.21 0.61 0.88 0.00 0.00 6 H 8.83 5.21 0.00 2.91 3.11 0.00 5.83 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 I 8.45 4.58 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 1.17 1.04 0.86 0.00 0.00 8 L 8.29 4.66 0.00 1.52 1.62 1.01 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 9 E 9.12 4.01 0.00 2.00 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 0.00 2.29 2.27 0.00 10 G 8.75 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 R 7.54 4.37 0.00 1.80 1.97 0.00 3.35 0.00 0.00 3.26 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.54 0.00 12 S 8.45 4.56 0.00 4.21 3.98 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 13 D 8.49 4.37 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 14 E 8.09 4.02 0.00 2.05 1.99 0.00 0.00 0.00 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 2.45 0.00 15 Q 7.86 4.00 0.00 2.31 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.82 0.00 0.00 0.00 0.00 0.00 2.37 2.39 0.00 16 K 8.15 4.09 0.00 1.80 1.83 0.00 1.64 0.00 0.00 1.65 0.00 0.00 3.02 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.44 1.63 7.81 17 E 8.28 3.98 0.00 2.19 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 2.30 2.34 0.00 18 T 7.90 3.88 4.46 0.00 0.00 0.00 0.00 0.00 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 19 L 7.89 3.92 0.00 1.85 1.84 0.91 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 20 I 7.79 3.71 1.99 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.60 0.90 0.00 0.00 21 R 7.75 3.90 0.00 1.86 2.08 0.00 3.10 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.66 0.00 22 E 8.55 3.89 0.00 2.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.47 0.00 23 V 7.90 3.60 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 1.02 0.00 0.00 0.94 0.00 0.00 24 S 7.85 4.15 0.00 4.14 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 25 E 8.27 3.95 0.00 2.18 1.99 0.00 0.00 0.00 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 26 A 8.10 4.03 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 27 I 7.79 3.65 2.00 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 1.40 0.72 0.91 0.00 0.00 28 S 7.91 4.17 0.00 4.03 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 29 R 8.48 4.03 0.00 2.03 2.28 0.00 2.83 0.00 0.00 3.17 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.66 0.00 30 S 8.04 4.28 0.00 4.08 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 31 L 7.67 4.55 0.00 1.60 1.66 0.92 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 32 D 7.47 4.33 0.00 2.85 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 33 A 7.66 4.72 1.24 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 0.00 0.00 34 P 0.00 4.31 0.00 2.23 2.21 0.00 3.72 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 2.07 1.95 0.00 35 L 8.88 3.93 0.00 1.74 1.73 0.93 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 36 T 7.91 3.98 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 37 S 8.04 4.41 0.00 3.96 4.02 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 0.00 0.00 0.00 38 V 7.51 4.02 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 0.75 0.00 0.00 0.97 0.00 0.00 39 R 8.72 4.64 0.00 1.75 1.76 0.00 3.28 0.00 0.00 3.09 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.67 0.00 40 V 8.54 4.85 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 0.80 0.00 0.00 0.92 0.00 0.00 41 I 8.77 4.58 1.84 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.68 0.87 0.00 0.00 42 I 8.42 4.75 1.84 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 1.31 0.52 0.87 0.00 0.00 43 T 8.69 4.51 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 1.18 0.00 0.00 44 E 8.84 4.80 0.00 1.83 1.85 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 2.25 2.30 0.00 45 M 8.94 4.86 0.00 1.90 1.81 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.45 0.00 46 A 8.45 4.71 1.06 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 0.00 0.00 0.00 0.00 0.00 0.00 47 K 9.42 3.80 0.00 1.81 1.94 0.00 1.70 0.00 0.00 1.67 0.00 0.00 2.90 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.67 1.56 7.81 48 G 8.01 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 H 8.87 4.96 0.00 3.36 3.33 0.00 5.62 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 F 8.17 5.08 0.00 2.98 2.93 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.35 4.14 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 I 8.27 4.02 1.69 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.43 0.83 0.00 0.00 53 G 9.45 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 54 G 8.37 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 0.00 0.00 0.00 55 E 7.62 4.49 0.00 1.94 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 0.00 2.24 2.38 0.00 56 L 8.08 4.47 0.00 1.75 1.59 0.92 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 57 A 8.87 4.05 1.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.92 4.29 0.00 3.95 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 K 7.67 4.17 0.00 1.80 1.79 0.00 1.64 0.00 0.00 1.74 0.00 0.00 3.00 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.32 1.33 7.81