NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 P 4.4298 0.0000 0.0000 62.7559 33.3254 174.7872 3 F 5.2814 8.8945 125.6830 56.1177 40.8902 171.5560 4 I 4.0904 9.0570 127.7274 59.7526 39.1538 173.8590 5 E 4.7943 8.3698 128.1010 54.5058 31.5169 174.4648 6 C 4.6079 9.0321 125.5821 58.4620 30.4713 172.6794 7 H 5.3319 8.8407 122.3273 54.4347 29.4256 174.2640 8 I 4.7763 8.3906 116.4590 58.3655 41.3488 174.6972 9 A 4.6973 8.4532 123.9957 51.9095 18.9290 177.5568 10 T 4.3148 7.9951 116.0514 62.0203 67.6749 173.1238 11 G 3.4828 9.0145 117.9027 45.6650 0.0000 174.6144 12 L 4.2118 7.5108 120.3672 54.2297 42.5715 177.4688 13 S 4.4607 8.3318 116.7259 57.8638 65.3943 175.7269 14 V 3.6079 8.3047 122.8246 64.9349 31.1433 178.2833 15 A 3.9827 7.9483 120.8379 55.1716 18.2423 179.7043 16 R 3.9257 8.1036 116.4680 59.3223 30.1039 179.5224 17 K 3.9976 8.2582 118.3921 59.4426 31.9990 179.4657 18 Q 4.0412 8.2161 118.5551 58.7761 28.5396 178.4986 19 Q 3.9447 7.8962 120.3552 59.0307 29.1535 177.8552 20 L 4.0439 8.1933 121.5823 57.9751 42.0324 179.1307 21 I 3.6719 7.8299 119.8883 64.3554 37.0610 178.1389 22 R 3.8927 7.8749 119.4563 59.7797 29.8683 178.1584 23 D 4.3431 8.5291 118.9195 57.3499 40.8751 179.0951 24 V 3.5962 7.8056 118.7609 65.9680 31.5025 177.8549 25 I 3.6561 7.8830 119.5782 64.4894 36.9871 177.3608 26 D 4.3803 8.2935 118.5788 58.1064 40.9689 179.4727 27 V 3.7453 7.9120 112.0932 64.3357 31.4736 178.8305 28 T 3.9197 7.8158 115.5968 66.4360 68.3123 176.3791 29 N 4.7320 8.3371 120.5451 55.9242 38.7212 177.0777 30 K 4.0749 7.8412 119.5001 58.8773 32.4259 178.9086 31 S 4.3833 8.3037 113.7367 60.1320 63.4406 175.5603 32 I 4.3555 7.6899 120.8659 60.1834 38.4669 176.8130 33 G 3.9264 7.8379 106.7885 45.3569 0.0000 173.5132 34 S 4.2803 7.7201 116.4933 57.6158 63.7538 173.2407 35 D 4.4540 8.6553 125.1466 53.3277 41.8569 174.9059 36 P 4.4216 0.0000 0.0000 66.0131 31.0421 178.2246 37 K 4.2044 8.6402 117.8206 58.3196 32.0013 177.3786 38 I 4.4514 8.1183 110.9728 60.2759 37.8136 174.7483 39 I 4.7154 8.0060 122.0889 60.2524 38.7242 174.9357 40 N 5.1625 9.2396 123.2731 51.4471 42.3901 173.5591 41 V 4.9932 8.5646 121.9471 61.0102 34.9665 174.2390 42 L 4.7567 8.9793 128.8252 53.2983 44.8975 174.5083 43 L 5.0629 8.6569 129.0881 53.5489 43.5732 175.7391 44 V 4.4580 8.7390 125.9109 59.9841 34.1246 174.3888 45 E 5.0505 8.6652 124.0007 55.4465 31.7196 174.7057 46 H 5.0241 8.9469 118.7427 53.8231 33.8214 172.6858 47 A 4.4504 8.6627 123.4788 51.8441 19.5166 178.6679 48 E 3.8323 9.0439 122.3183 59.6456 29.8117 179.7705 49 A 4.0259 7.9768 119.9419 55.0000 18.5301 177.6000 50 N 4.7406 9.0512 112.3420 53.5613 38.7014 174.7010 51 M 4.6647 7.8725 118.1935 53.3334 34.8739 174.8585 52 S 4.5702 8.6573 117.4430 56.4300 64.8709 172.7183 53 I 4.3803 8.2278 128.3858 60.7778 38.8730 175.9816 54 S 3.5702 9.5325 120.6924 59.7322 60.2120 173.3278 55 G 3.9030 8.3427 104.9769 46.0744 0.0000 174.6877 56 R 4.1194 7.9034 123.9234 56.2929 30.0966 176.3040 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 P 0.00 4.43 0.00 2.17 2.28 0.00 3.73 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.99 0.00 3 F 8.89 5.28 0.00 2.97 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 4 I 9.06 4.09 1.85 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.29 0.84 0.00 0.00 5 E 8.37 4.79 0.00 1.38 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 2.28 0.00 6 C 9.03 4.61 0.00 2.82 2.79 0.00 0.00 0.00 0.00 0.00 0.00 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 H 8.84 5.33 0.00 3.06 3.33 0.00 5.64 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 8 I 8.39 4.78 1.88 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 1.15 0.92 0.91 0.00 0.00 9 A 8.45 4.70 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 10 T 8.00 4.31 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 1.25 0.00 0.00 11 G 9.01 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 L 7.51 4.21 0.00 1.63 1.61 0.92 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 13 S 8.33 4.46 0.00 4.05 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 14 V 8.30 3.61 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 0.84 0.00 0.00 0.93 0.00 0.00 15 A 7.95 3.98 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 16 R 8.10 3.93 0.00 1.94 1.99 0.00 3.29 0.00 0.00 3.17 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.81 0.00 17 K 8.26 4.00 0.00 1.96 1.85 0.00 1.77 0.00 0.00 1.73 0.00 0.00 2.94 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.45 1.47 7.81 18 Q 8.22 4.04 0.00 2.27 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.82 0.00 0.00 0.00 0.00 0.00 2.58 2.51 0.00 19 Q 7.90 3.94 0.00 2.19 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.80 0.00 0.00 0.00 0.00 0.00 2.35 2.60 0.00 20 L 8.19 4.04 0.00 1.79 1.81 0.92 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 21 I 7.83 3.67 2.03 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 1.71 0.79 0.92 0.00 0.00 22 R 7.87 3.89 0.00 1.90 2.11 0.00 3.10 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.69 0.00 23 D 8.53 4.34 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 24 V 7.81 3.60 2.23 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 1.03 0.00 0.00 1.00 0.00 0.00 25 I 7.88 3.66 2.03 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 1.68 0.69 0.92 0.00 0.00 26 D 8.29 4.38 0.00 2.78 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 27 V 7.91 3.75 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 0.87 0.00 0.00 0.98 0.00 0.00 28 T 7.82 3.92 4.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 29 N 8.34 4.73 0.00 2.89 3.01 0.00 0.00 6.90 5.59 0.00 0.00 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 K 7.84 4.07 0.00 1.79 1.85 0.00 1.83 0.00 0.00 1.93 0.00 0.00 3.07 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.46 1.44 7.81 31 S 8.30 4.38 0.00 4.01 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 32 I 7.69 4.36 2.08 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 1.46 0.65 0.92 0.00 0.00 33 G 7.84 3.93 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 0.00 0.00 0.00 34 S 7.72 4.28 0.00 3.91 3.81 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.66 4.45 0.00 2.68 2.54 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.42 0.00 2.26 2.33 0.00 3.77 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.03 0.00 37 K 8.64 4.20 0.00 1.82 1.93 0.00 1.64 0.00 0.00 1.75 0.00 0.00 3.07 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.48 1.51 7.81 38 I 8.12 4.45 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 1.57 0.68 0.91 0.00 0.00 39 I 8.01 4.72 1.95 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 1.45 0.90 0.94 0.00 0.00 40 N 9.24 5.16 0.00 2.71 2.64 0.00 0.00 6.12 7.23 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 41 V 8.56 4.99 2.12 0.00 0.00 0.00 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 0.97 0.00 0.00 42 L 8.98 4.76 0.00 2.07 1.54 1.03 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 43 L 8.66 5.06 0.00 1.69 1.54 0.92 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 44 V 8.74 4.46 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 0.65 0.00 0.00 0.90 0.00 0.00 45 E 8.67 5.05 0.00 1.90 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 2.31 2.30 0.00 46 H 8.95 5.02 0.00 3.04 3.11 0.00 5.61 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 A 8.66 4.45 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 48 E 9.04 3.83 0.00 2.01 2.05 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 2.42 2.31 0.00 49 A 7.98 4.03 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 50 N 9.05 4.74 0.00 2.70 2.82 0.00 0.00 6.79 7.54 0.00 0.00 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 M 7.87 4.66 0.00 1.98 1.93 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.37 0.00 52 S 8.66 4.57 0.00 3.76 3.69 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.23 4.38 1.87 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 1.41 0.85 0.91 0.00 0.00 54 S 9.53 3.57 0.00 3.99 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 55 G 8.34 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.90 4.12 0.00 1.95 1.85 0.00 3.19 0.00 0.00 3.26 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.65 0.00