NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 P 4.2535 0.0000 0.0000 63.3759 32.7865 173.9805 6 V 2.9776 8.1915 119.7323 61.1134 28.2389 168.1505 7 P 4.5991 0.0000 0.0000 61.1297 33.9529 176.6310 8 K 4.3064 8.0695 118.8524 55.2788 31.6480 175.7584 9 K 4.2297 7.6187 124.5943 56.0713 35.1440 174.5667 10 K 4.5150 8.2889 126.6234 56.1757 32.4936 175.5526 11 T 4.6541 8.1964 106.6652 59.9162 72.0506 173.4549 12 S 4.6260 8.3335 117.4406 56.3624 63.9169 175.0119 13 K 3.9651 8.6972 125.2214 57.6487 31.6897 178.3119 14 A 3.9852 7.4256 121.5056 55.8025 18.5179 179.2783 15 R 4.1064 8.2059 117.5856 57.6023 30.5139 178.3775 16 R 3.8382 8.0256 115.3927 60.0050 29.5074 177.7454 17 D 4.4187 8.0773 117.2834 55.1681 41.2601 177.5610 18 A 4.3089 7.4404 118.5808 53.4492 18.6053 178.3034 19 R 4.5204 7.4700 112.7124 55.8361 29.8891 176.5447 20 R 4.6478 7.5604 115.6680 56.1005 32.3266 177.1486 21 S 4.2507 8.2111 116.8878 62.0195 63.1453 176.3798 22 H 4.1722 8.4869 116.2527 59.1742 28.7267 176.2380 23 H 3.9349 7.9044 114.3475 58.8428 28.5450 176.0321 24 A 3.4247 7.1520 119.3121 52.4620 18.0918 175.6215 25 L 4.4658 8.2188 119.1982 53.7098 42.9345 175.3630 26 T 4.4168 8.3223 121.7869 59.5483 68.1316 172.2356 27 P 4.4780 0.0000 0.0000 61.5880 32.3536 173.9140 28 P 4.4343 0.0000 0.0000 61.7523 32.0286 175.8812 29 I 3.8128 8.1659 116.8829 61.3878 38.1659 174.8250 30 L 4.4776 8.1612 123.1338 54.2140 44.5285 175.1320 31 V 4.4549 8.1318 119.5536 58.7688 35.0592 173.4893 32 P 4.7096 0.0000 0.0000 62.5178 32.5489 176.5966 33 C 5.5722 8.2151 119.0462 58.2726 31.4892 174.4115 34 P 4.7309 0.0000 0.0000 61.5164 31.3156 181.2842 35 E 3.5098 8.9001 116.5945 56.9811 28.2620 175.2933 36 C 3.8983 8.3797 123.2374 60.8220 28.2421 173.3105 37 K 5.0122 7.0896 135.0000 56.9375 33.4647 173.6617 38 A 4.1627 7.7513 129.5480 48.9965 20.3958 176.4129 39 M 3.7857 7.9436 114.6818 54.9891 29.3273 177.3017 40 K 4.4211 7.2734 118.4504 53.9034 34.4684 176.2903 41 P 4.3946 0.0000 0.0000 61.7027 31.5867 172.4477 42 P 4.0019 0.0000 0.0000 64.3671 31.0921 176.0578 43 H 4.3200 8.5627 121.7345 55.7746 26.3833 175.1733 44 T 4.2548 7.4089 114.3286 63.0763 69.3903 175.3198 45 V 4.3567 8.0031 121.1753 61.8454 33.2596 173.8427 46 C 4.8284 8.1515 123.8094 57.6422 32.2922 173.4447 47 P 4.2683 0.0000 0.0000 65.0960 31.3335 176.0974 48 E 3.8426 8.0821 118.5316 57.4160 28.6295 177.6869 49 C 3.9190 9.2863 123.7983 58.8232 31.6067 172.8084 50 G 4.8186 8.0949 110.6176 45.0011 0.0000 175.2775 51 Y 4.9402 6.9554 117.5607 56.8289 39.0782 173.4901 52 Y 5.7398 7.7824 135.0000 58.4770 38.5640 172.5970 53 A 4.6821 7.1967 123.0585 50.7662 20.1031 176.1279 54 G 3.6683 7.0277 116.2226 45.6322 0.0000 176.7584 55 R 4.5729 8.2005 112.8332 55.5967 31.3565 172.6165 56 K 4.6717 8.4454 118.8710 57.2515 38.3176 177.1542 57 V 4.5375 7.3866 109.8985 58.0947 35.0387 175.1488 58 L 4.2960 8.2490 120.8700 55.1116 42.1560 177.0803 59 E 4.7572 8.3142 118.0788 55.8099 29.8465 175.7187 60 V 3.9029 7.8665 122.9081 64.0770 31.6131 174.9021 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 P 0.00 4.25 0.00 2.06 2.08 0.00 3.69 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 2.08 0.00 6 V 8.19 2.98 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 0.74 0.00 0.00 0.93 0.00 0.00 7 P 0.00 4.60 0.00 2.21 2.03 0.00 3.78 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.97 0.00 8 K 8.07 4.31 0.00 1.74 1.81 0.00 1.84 0.00 0.00 1.63 0.00 0.00 2.96 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.35 1.39 7.81 9 K 7.62 4.23 0.00 1.69 1.68 0.00 1.65 0.00 0.00 1.63 0.00 0.00 3.06 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.17 1.26 7.81 10 K 8.29 4.51 0.00 1.73 1.62 0.00 1.67 0.00 0.00 1.75 0.00 0.00 3.02 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.38 1.47 7.81 11 T 8.20 4.65 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 12 S 8.33 4.63 0.00 3.98 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 13 K 8.70 3.97 0.00 1.83 1.90 0.00 1.68 0.00 0.00 1.82 0.00 0.00 2.92 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.53 1.45 7.81 14 A 7.43 3.99 1.25 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 0.00 0.00 0.00 15 R 8.21 4.11 0.00 1.85 1.98 0.00 3.15 0.00 0.00 3.38 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.68 0.00 16 R 8.03 3.84 0.00 1.92 2.03 0.00 3.06 0.00 0.00 3.14 7.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.91 0.00 17 D 8.08 4.42 0.00 2.77 2.68 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 0.00 0.00 0.00 0.00 18 A 7.44 4.31 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 19 R 7.47 4.52 0.00 1.91 2.06 0.00 3.01 0.00 0.00 3.22 7.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.58 0.00 20 R 7.56 4.65 0.00 1.71 1.52 0.00 3.09 0.00 0.00 3.03 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 1.40 0.00 21 S 8.21 4.25 0.00 3.99 3.95 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 22 H 8.49 4.17 0.00 3.12 3.41 0.00 5.94 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 H 7.90 3.93 0.00 3.43 3.42 0.00 5.82 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 24 A 7.15 3.42 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 25 L 8.22 4.47 0.00 1.59 1.57 0.92 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 26 T 8.32 4.42 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 27 P 0.00 4.48 0.00 2.21 2.02 0.00 3.81 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.94 0.00 28 P 0.00 4.43 0.00 2.19 2.09 0.00 3.79 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 1.96 1.94 0.00 29 I 8.17 3.81 1.86 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 0.84 0.90 0.00 0.00 30 L 8.16 4.48 0.00 1.59 1.53 0.91 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 31 V 8.13 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 0.69 0.00 0.00 1.00 0.00 0.00 32 P 0.00 4.71 0.00 1.95 2.00 0.00 3.78 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.11 0.00 33 C 8.22 5.57 0.00 2.79 2.80 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 34 P 0.00 4.73 0.00 2.12 1.18 0.00 3.96 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.89 0.00 35 E 8.90 3.51 0.00 2.08 1.27 0.00 0.00 0.00 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 2.50 0.00 36 C 8.38 3.90 0.00 2.96 2.88 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 37 K 7.09 5.01 0.00 1.77 1.78 0.00 1.75 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.17 1.16 7.81 38 A 7.75 4.16 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 M 7.94 3.79 0.00 2.15 2.15 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.55 0.00 40 K 7.27 4.42 0.00 1.70 1.64 0.00 1.44 0.00 0.00 1.55 0.00 0.00 2.91 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.38 1.29 7.81 41 P 0.00 4.39 0.00 2.19 2.35 0.00 3.69 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.98 0.00 42 P 0.00 4.00 0.00 1.97 1.91 0.00 3.79 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.08 0.00 43 H 8.56 4.32 0.00 3.30 3.38 0.00 5.75 0.00 0.00 0.00 0.00 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 T 7.41 4.25 4.21 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 1.21 0.00 0.00 45 V 8.00 4.36 2.13 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 0.90 0.00 0.00 1.05 0.00 0.00 46 C 8.15 4.83 0.00 2.95 2.76 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 47 P 0.00 4.27 0.00 2.18 2.19 0.00 3.78 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.99 0.00 48 E 8.08 3.84 0.00 2.03 2.10 0.00 0.00 0.00 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 2.29 0.00 49 C 9.29 3.92 0.00 3.28 3.06 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 50 G 8.09 4.82 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 51 Y 6.96 4.94 0.00 3.15 2.22 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 0.00 52 Y 7.78 5.74 0.00 3.15 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 53 A 7.20 4.68 0.72 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 54 G 7.03 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.20 4.57 0.00 1.69 1.76 0.00 3.23 0.00 0.00 3.27 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.49 0.00 56 K 8.45 4.67 0.00 1.85 1.84 0.00 1.51 0.00 0.00 1.80 0.00 0.00 2.92 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.33 1.51 7.81 57 V 7.39 4.54 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 0.81 0.00 0.00 1.05 0.00 0.00 58 L 8.25 4.30 0.00 1.63 1.61 0.93 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 59 E 8.31 4.76 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 2.19 2.29 0.00 60 V 7.87 3.90 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 0.80 0.00 0.00 0.94 0.00 0.00