NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 T 4.3500 8.1744 110.9441 61.2550 70.6398 173.3373 6 N 4.7537 7.8681 120.4100 53.3375 39.3985 173.5155 7 S 4.4812 8.7698 113.2242 57.6456 65.0884 173.6342 8 D 4.6323 8.6667 122.5963 55.2079 41.9044 175.4229 9 F 5.2037 7.5695 114.3523 55.5347 41.7671 173.7790 10 V 4.6770 9.2284 111.5043 59.5188 35.3728 175.1115 11 V 4.7603 8.5764 123.2292 61.3164 33.8214 174.4144 12 I 4.9497 8.8720 128.6264 59.3816 40.6042 174.2067 13 K 4.9373 9.4410 129.4955 54.1665 34.3171 175.1353 14 A 4.4143 8.4848 130.4903 52.6375 19.0358 177.3321 15 L 4.6852 8.7932 122.4512 54.5521 42.5552 175.7325 16 E 4.7190 7.6093 115.7140 55.4877 32.2046 174.5048 17 D 4.4842 8.7362 119.9867 54.1162 42.1369 176.2167 18 G 3.8537 7.8320 104.7417 46.7002 0.0000 174.4064 19 V 3.9815 7.6572 119.3723 62.5141 33.0997 174.2600 20 N 5.2697 8.9083 124.6234 51.5159 41.2220 173.6872 21 V 4.4988 8.8383 124.8462 61.4901 33.3765 174.2509 22 I 4.6190 8.7934 129.9665 59.3798 39.8174 174.9412 23 G 4.3177 8.9881 114.4867 44.7742 0.0000 172.7103 24 L 5.3079 9.2072 126.1049 53.4919 43.9031 176.4592 25 T 4.5012 8.6705 113.1522 61.7290 69.5816 174.2478 26 R 4.2431 7.8470 124.7471 56.7025 30.0271 174.9386 27 G 3.7808 8.9195 109.0546 44.1284 0.0000 173.7520 28 A 4.0979 8.7789 121.2385 54.5990 18.5766 177.7454 29 D 4.8649 7.3112 111.5981 53.2493 42.6095 176.7816 30 T 4.5418 8.2731 122.8823 61.2948 68.3093 172.8446 31 R 4.6782 8.6861 122.3703 53.6302 32.6281 175.8633 32 F 5.1402 8.5689 117.1007 57.5183 39.6133 175.2971 33 H 4.9910 8.8353 120.6568 56.6665 30.6830 174.3123 34 H 4.9105 7.6288 116.8379 54.3613 33.6706 172.0794 35 S 4.7801 7.9919 118.0450 56.4267 65.1055 172.3371 36 E 4.5461 9.0243 129.2490 54.3878 31.1740 174.8864 37 K 4.8506 8.6028 126.8741 56.0052 33.4684 176.4527 38 L 5.0319 9.1510 123.4728 53.1526 45.7793 175.5695 39 D 5.1288 9.2449 122.1667 52.2844 43.4437 176.1295 40 K 4.0652 9.2114 122.6628 58.5927 32.3686 177.3064 41 G 3.9943 9.3316 115.1944 44.9194 0.0000 172.9655 42 E 4.3789 8.1445 120.1782 55.5806 31.2038 175.5500 43 V 4.6544 8.3344 123.6433 61.2162 33.2872 174.2353 44 L 4.6778 8.8930 130.7580 53.3373 44.3111 174.8065 45 I 4.9396 8.3727 126.5609 59.5605 39.1718 174.8252 46 A 4.6908 8.9728 128.6492 50.2590 22.3888 175.1459 47 Q 4.8830 8.5604 120.1466 54.4752 30.9685 175.5632 48 F 4.6894 8.3908 119.9310 58.0387 40.0337 175.0755 49 T 4.6216 8.7507 110.4548 60.4420 71.7875 173.0046 50 E 4.0089 8.9819 121.5898 59.6913 29.5802 177.5415 51 H 4.4002 8.2351 114.2770 56.8239 29.7460 174.2109 52 T 5.4351 8.2369 116.1060 61.1590 70.0286 174.7234 53 S 4.9219 8.7719 120.2153 57.9420 64.8310 173.2802 54 A 4.8932 7.7702 120.9144 51.3074 22.4181 175.2959 55 I 4.9556 8.6528 121.2909 59.3302 40.5911 174.7327 56 K 4.5514 9.0993 128.2617 54.5517 34.5997 174.6613 57 V 4.7738 8.3894 126.8616 61.2503 33.5273 174.5595 58 R 4.4985 9.0798 127.5651 55.5635 32.5353 176.1886 59 G 3.8802 8.9975 109.2299 43.8991 0.0000 172.1894 60 K 4.7497 8.9152 119.4121 55.5361 33.0843 175.4787 61 A 5.1100 8.6393 128.0814 51.2448 23.4902 173.6835 62 Y 5.0045 9.5721 122.0468 56.0361 41.1245 174.5717 63 I 4.8940 7.9712 126.8473 59.5368 40.8626 174.2453 64 Q 5.0322 8.9390 126.5756 54.2925 31.3838 174.9412 65 T 4.7787 8.8768 113.0080 59.8490 72.3157 174.9394 66 R 3.8437 8.2840 122.3467 59.4509 30.1187 176.4948 67 H 4.8110 9.2802 112.0349 54.8294 29.5103 175.6829 68 G 3.7290 6.9047 108.0539 44.6819 0.0000 172.4832 69 V 4.8077 7.6980 113.3393 59.8331 35.1737 175.1111 70 I 4.5378 8.3225 122.2309 60.0510 41.8703 172.8646 71 E 5.3869 8.6762 126.0184 54.5415 32.2809 176.0418 72 S 4.6592 8.7015 118.3150 57.9873 65.2131 172.8314 73 E 4.8993 8.6374 119.2603 54.5613 33.3750 176.0530 74 G 3.7198 8.6576 110.7654 45.7323 0.0000 172.9420 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 T 8.17 4.35 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 6 N 7.87 4.75 0.00 2.81 2.86 0.00 0.00 7.12 6.75 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 7 S 8.77 4.48 0.00 4.06 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 8 D 8.67 4.63 0.00 2.67 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 9 F 7.57 5.20 0.00 2.98 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 V 9.23 4.68 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 0.53 0.00 0.00 0.84 0.00 0.00 11 V 8.58 4.76 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 1.11 0.00 0.00 1.13 0.00 0.00 12 I 8.87 4.95 1.86 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.67 0.91 0.00 0.00 13 K 9.44 4.94 0.00 1.89 1.86 0.00 1.66 0.00 0.00 1.64 0.00 0.00 2.85 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.38 1.39 7.81 14 A 8.48 4.41 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 15 L 8.79 4.69 0.00 1.54 1.71 0.95 1.00 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 16 E 7.61 4.72 0.00 1.92 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 2.33 2.32 0.00 17 D 8.74 4.48 0.00 2.59 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 18 G 7.83 3.85 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 0.00 0.00 0.00 0.00 0.00 0.00 19 V 7.66 3.98 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 0.94 0.00 0.00 0.96 0.00 0.00 20 N 8.91 5.27 0.00 2.66 2.60 0.00 0.00 6.37 6.98 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 21 V 8.84 4.50 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 0.98 0.00 0.00 0.89 0.00 0.00 22 I 8.79 4.62 1.40 0.00 0.00 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.27 -0.29 0.00 0.00 23 G 8.99 4.32 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 L 9.21 5.31 0.00 1.84 1.69 0.82 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 25 T 8.67 4.50 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 1.36 0.00 0.00 26 R 7.85 4.24 0.00 1.88 1.91 0.00 3.24 0.00 0.00 3.06 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.42 0.00 27 G 8.92 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 28 A 8.78 4.10 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 29 D 7.31 4.86 0.00 2.64 2.58 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 30 T 8.27 4.54 4.28 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 1.28 0.00 0.00 31 R 8.69 4.68 0.00 1.95 2.05 0.00 2.78 0.00 0.00 3.38 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.64 0.00 32 F 8.57 5.14 0.00 2.94 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 33 H 8.84 4.99 0.00 3.20 3.48 0.00 5.72 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 H 7.63 4.91 0.00 3.11 2.93 0.00 5.80 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 S 7.99 4.78 0.00 3.76 3.57 0.00 0.00 0.00 0.00 0.00 0.00 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 E 9.02 4.55 0.00 2.12 1.76 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 2.21 2.29 0.00 37 K 8.60 4.85 0.00 1.67 1.70 0.00 1.73 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.41 1.44 7.81 38 L 9.15 5.03 0.00 1.49 1.50 0.91 1.07 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 39 D 9.24 5.13 0.00 2.57 2.66 0.00 0.00 0.00 0.00 0.00 0.00 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 K 9.21 4.07 0.00 1.53 1.74 0.00 1.78 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.41 7.81 41 G 9.33 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 42 E 8.14 4.38 0.00 2.03 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.34 0.00 43 V 8.33 4.65 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 0.76 0.00 0.00 0.96 0.00 0.00 44 L 8.89 4.68 0.00 1.76 1.47 0.89 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 45 I 8.37 4.94 1.70 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.71 0.54 0.00 0.00 46 A 8.97 4.69 1.11 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 0.00 0.00 47 Q 8.56 4.88 0.00 1.96 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.69 6.99 0.00 0.00 0.00 0.00 0.00 2.43 2.40 0.00 48 F 8.39 4.69 0.00 3.06 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 49 T 8.75 4.62 4.31 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 1.28 0.00 0.00 50 E 8.98 4.01 0.00 1.95 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 2.04 2.29 0.00 51 H 8.24 4.40 0.00 3.25 3.17 0.00 5.81 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 T 8.24 5.44 4.37 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 1.38 0.00 0.00 53 S 8.77 4.92 0.00 3.80 4.06 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 54 A 7.77 4.89 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 55 I 8.65 4.96 1.89 0.00 0.00 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.80 0.91 0.00 0.00 56 K 9.10 4.55 0.00 1.74 1.48 0.00 1.60 0.00 0.00 1.55 0.00 0.00 2.86 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.29 1.35 7.81 57 V 8.39 4.77 2.06 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 0.85 0.00 0.00 0.90 0.00 0.00 58 R 9.08 4.50 0.00 1.73 1.80 0.00 3.17 0.00 0.00 3.20 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.53 0.00 59 G 9.00 3.88 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 0.00 0.00 0.00 60 K 8.92 4.75 0.00 1.87 1.72 0.00 1.80 0.00 0.00 1.79 0.00 0.00 2.92 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.52 1.31 7.81 61 A 8.64 5.11 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 Y 9.57 5.00 0.00 2.99 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 I 7.97 4.89 1.88 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 0.51 0.82 0.00 0.00 64 Q 8.94 5.03 0.00 1.92 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.65 0.00 0.00 0.00 0.00 0.00 2.23 2.00 0.00 65 T 8.88 4.78 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 1.16 0.00 0.00 66 R 8.28 3.84 0.00 1.58 1.74 0.00 3.13 0.00 0.00 3.18 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.62 0.00 67 H 9.28 4.81 0.00 3.20 3.26 0.00 5.72 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 68 G 6.90 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 V 7.70 4.81 1.92 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 0.75 0.00 0.00 0.99 0.00 0.00 70 I 8.32 4.54 1.84 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 1.22 1.16 0.86 0.00 0.00 71 E 8.68 5.39 0.00 1.91 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.45 0.00 72 S 8.70 4.66 0.00 4.01 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 73 E 8.64 4.90 0.00 1.82 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.30 0.00 74 G 8.66 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