NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.3183 8.2644 123.5843 51.8110 20.4519 177.5525 3 R 4.0859 7.8535 119.7148 58.4660 30.3464 176.4119 4 K 3.9973 8.2984 120.9649 59.4787 32.7424 178.0594 5 A 4.0516 8.0188 120.4481 54.7060 18.2401 179.5400 6 L 4.0290 7.8399 117.6839 57.9357 42.0508 179.2648 7 I 4.0468 7.5091 112.3869 63.3927 37.0287 177.6317 8 E 3.9741 7.9737 122.0518 58.7750 29.3565 177.8145 9 K 4.1034 7.6523 117.5485 57.8797 32.4593 178.2045 10 A 3.8640 8.2566 121.0793 55.2057 18.3222 179.2429 11 K 4.0629 7.5475 115.6433 58.5502 32.2861 177.4892 12 R 3.8247 6.9192 120.0894 57.6095 30.0906 176.4128 13 T 4.4674 8.4028 119.3658 62.7829 68.8612 173.7277 14 P 4.4654 0.0000 0.0000 63.0032 33.6386 174.3434 15 K 3.1357 9.3710 116.4992 57.7904 29.2572 171.9595 16 F 3.7979 8.1867 126.6405 56.8634 37.4765 176.6509 17 K 4.1556 8.8649 122.4805 58.2416 32.6107 178.0001 18 V 3.9344 8.2103 120.7922 65.7989 31.8455 178.1922 19 R 3.9456 8.2685 116.7150 58.9092 30.0088 176.0042 20 A 3.9734 7.4729 119.0398 52.8246 18.1374 175.9171 21 Y 5.0133 7.9272 118.8165 55.3559 41.6786 177.1968 22 T 4.1049 8.3671 114.8269 63.8265 68.3992 171.2496 23 R 4.2464 8.8414 121.1848 55.5323 31.5891 174.9856 24 C 4.2527 8.4177 128.0270 59.8349 32.2954 173.5216 25 V 3.8779 7.9851 124.9538 65.5804 31.2935 177.5173 26 R 3.9527 7.8444 117.3561 58.7819 30.1866 176.8391 27 C 4.5595 7.6580 112.0463 56.8924 31.4761 173.7471 28 G 3.7982 8.4620 107.6035 45.6206 0.0000 173.7956 29 R 3.9677 7.7896 120.6880 56.3768 30.6983 176.1098 30 A 4.6302 8.3089 120.4128 51.8826 21.0377 176.8108 31 R 4.3378 8.0351 114.2270 56.3506 31.7880 176.1864 32 S 3.5460 8.3981 113.9905 59.4200 61.4782 173.3121 33 V 4.2031 7.5378 120.3105 62.1624 30.2665 173.8882 34 Y 4.0891 8.9314 124.1271 58.3265 38.5324 178.6049 35 R 4.0280 8.8262 123.1568 59.3177 30.5086 177.6787 36 F 4.1300 8.6241 118.6630 61.5880 39.3406 176.0165 37 F 4.3391 9.2303 117.0913 57.6591 38.9558 176.2221 38 G 4.0429 8.1855 108.7665 46.4036 0.0000 173.1699 39 L 4.7936 7.8780 117.8528 52.4775 44.9772 175.6948 40 C 5.1104 8.2009 115.0260 56.6341 31.2709 174.8380 41 R 4.0328 8.3543 116.6385 58.4231 29.4599 177.8047 42 I 4.1385 7.5699 118.6863 63.6913 38.0381 177.5617 43 C 4.6063 7.7405 116.0784 60.1019 28.4437 174.2205 44 L 4.3899 7.6818 120.0693 55.9969 44.1939 178.0332 45 R 3.9750 7.7940 117.5042 59.0652 29.7085 177.9895 46 E 3.9487 7.8853 117.9834 59.2113 29.7520 178.7970 47 L 4.1192 7.8525 117.8967 57.8467 41.8122 179.0143 48 A 4.0433 7.8992 120.7485 56.0341 18.0372 179.4504 49 H 4.0652 7.8048 112.0074 58.7665 28.9169 177.3558 50 K 4.3542 8.3923 118.6051 56.1786 31.7448 179.7163 51 G 3.9918 8.5365 110.2216 46.7191 0.0000 176.0411 52 Q 4.0034 8.0183 117.5253 57.3995 28.9908 176.6413 53 L 4.5761 7.8220 118.9160 52.0345 42.6279 174.3039 54 P 4.0314 0.0000 0.0000 63.8974 31.3311 178.3164 55 G 3.9401 8.9440 111.1663 45.9704 0.0000 173.2044 56 V 3.7052 7.5436 118.8285 62.9464 31.1248 174.9724 57 R 4.5485 8.1678 127.1089 53.5409 32.6174 174.5681 58 K 3.6979 8.7511 124.2325 56.5082 32.0321 176.3359 59 A 4.1494 8.4903 129.3075 52.6395 18.9316 176.8914 60 S 4.3539 8.3570 110.3479 57.6525 64.1093 175.9646 61 W 4.8072 8.1705 124.6331 56.7351 27.9700 174.8370 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 4.32 1.31 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 0.00 0.00 3 R 7.85 4.09 0.00 1.98 1.93 0.00 3.20 0.00 0.00 3.32 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.77 0.00 4 K 8.30 4.00 0.00 1.92 1.78 0.00 1.68 0.00 0.00 1.83 0.00 0.00 3.03 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.51 1.57 7.81 5 A 8.02 4.05 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 6 L 7.84 4.03 0.00 1.92 1.81 1.03 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 7 I 7.51 4.05 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 1.65 0.71 1.03 0.00 0.00 8 E 7.97 3.97 0.00 2.22 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 2.31 2.36 0.00 9 K 7.65 4.10 0.00 1.78 1.99 0.00 1.91 0.00 0.00 1.75 0.00 0.00 3.11 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.51 1.49 7.81 10 A 8.26 3.86 1.19 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 0.00 0.00 0.00 0.00 0.00 0.00 11 K 7.55 4.06 0.00 1.86 1.86 0.00 1.72 0.00 0.00 1.68 0.00 0.00 3.00 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.44 1.68 7.81 12 R 6.92 3.82 0.00 1.87 1.93 0.00 3.15 0.00 0.00 3.35 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.62 0.00 13 T 8.40 4.47 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 4.47 0.00 2.15 2.08 0.00 3.96 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.97 0.00 15 K 9.37 3.14 0.00 1.88 1.93 0.00 1.94 0.00 0.00 1.12 0.00 0.00 2.86 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.25 1.37 7.81 16 F 8.19 3.80 0.00 3.28 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 17 K 8.86 4.16 0.00 1.90 1.97 0.00 1.59 0.00 0.00 1.67 0.00 0.00 3.01 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.48 1.49 7.81 18 V 8.21 3.93 2.11 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 0.97 0.00 0.00 0.95 0.00 0.00 19 R 8.27 3.95 0.00 1.97 2.16 0.00 3.46 0.00 0.00 3.33 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.72 0.00 20 A 7.47 3.97 1.36 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 0.00 0.00 0.00 21 Y 7.93 5.01 0.00 3.05 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 22 T 8.37 4.10 4.34 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 1.31 0.00 0.00 23 R 8.84 4.25 0.00 1.73 1.96 0.00 3.81 0.00 0.00 3.31 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.48 0.00 24 C 8.42 4.25 0.00 3.00 2.99 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 0.00 0.00 0.00 25 V 7.99 3.88 2.11 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 0.84 0.00 0.00 0.99 0.00 0.00 26 R 7.84 3.95 0.00 1.86 1.96 0.00 3.28 0.00 0.00 3.29 7.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.66 0.00 27 C 7.66 4.56 0.00 3.09 2.94 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 28 G 8.46 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 R 7.79 3.97 0.00 1.88 1.90 0.00 3.15 0.00 0.00 3.52 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.70 0.00 30 A 8.31 4.63 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 31 R 8.04 4.34 0.00 1.83 1.87 0.00 3.37 0.00 0.00 3.28 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.61 0.00 32 S 8.40 3.55 0.00 4.20 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 0.00 33 V 7.54 4.20 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 0.99 0.00 0.00 1.11 0.00 0.00 34 Y 8.93 4.09 0.00 3.29 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 35 R 8.83 4.03 0.00 1.93 2.07 0.00 3.25 0.00 0.00 3.20 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.66 0.00 36 F 8.62 4.13 0.00 3.19 3.53 0.00 0.00 0.00 0.00 0.00 0.00 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 9.23 4.34 0.00 3.05 3.21 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 38 G 8.19 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.88 4.79 0.00 1.71 1.65 1.13 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 40 C 8.20 5.11 0.00 3.16 3.11 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 41 R 8.35 4.03 0.00 2.07 2.34 0.00 3.11 0.00 0.00 3.26 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.70 0.00 42 I 7.57 4.14 1.87 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 1.11 0.90 0.00 0.00 43 C 7.74 4.61 0.00 2.97 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 44 L 7.68 4.39 0.00 1.44 1.32 -0.19 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 45 R 7.79 3.98 0.00 1.85 1.83 0.00 3.22 0.00 0.00 3.30 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.73 0.00 46 E 7.89 3.95 0.00 2.00 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 0.00 2.31 2.52 0.00 47 L 7.85 4.12 0.00 1.72 1.77 1.02 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 48 A 7.90 4.04 1.46 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 0.00 0.00 0.00 49 H 7.80 4.07 0.00 3.27 3.41 0.00 5.85 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 K 8.39 4.35 0.00 2.00 1.84 0.00 1.79 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.47 1.57 7.81 51 G 8.54 3.99 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 0.00 0.00 0.00 0.00 0.00 0.00 52 Q 8.02 4.00 0.00 2.08 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.70 0.00 0.00 0.00 0.00 0.00 2.43 2.54 0.00 53 L 7.82 4.58 0.00 1.75 1.90 1.07 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 54 P 0.00 4.03 0.00 2.17 2.05 0.00 3.72 0.00 0.00 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.14 0.00 55 G 8.94 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 56 V 7.54 3.71 2.31 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 0.84 0.00 0.00 1.21 0.00 0.00 57 R 8.17 4.55 0.00 1.78 1.76 0.00 3.33 0.00 0.00 3.17 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.57 0.00 58 K 8.75 3.70 0.00 1.72 1.76 0.00 1.84 0.00 0.00 1.71 0.00 0.00 2.96 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.38 1.37 7.81 59 A 8.49 4.15 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.36 4.35 0.00 3.78 3.77 0.00 0.00 0.00 0.00 0.00 0.00 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 8.17 4.81 0.00 3.37 3.13 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 0.00