NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 T 4.3152 8.1631 117.3743 62.9994 69.7730 173.4937 2 G 3.4916 8.4384 115.9426 45.0662 0.0000 172.5152 3 A 4.2166 8.1371 124.9153 52.9517 20.9602 176.8668 4 G 4.3488 7.1669 112.3512 45.0781 0.0000 176.3258 5 T 3.8766 8.9492 120.6813 66.1994 67.8260 173.5762 6 P 4.3162 0.0000 0.0000 65.5311 30.7287 177.4298 7 S 4.5385 8.2444 113.4131 59.0005 62.8441 175.5251 8 Q 4.3305 8.1949 122.4424 57.6366 28.5081 177.9782 9 G 3.6887 7.4791 107.9270 47.5805 0.0000 174.3645 10 K 4.3403 7.8540 117.3767 56.5852 32.6279 177.9641 11 K 4.3873 7.4970 120.8258 55.3064 30.0735 176.1053 12 N 5.0552 7.9540 116.8775 52.4432 38.4215 175.0027 13 T 4.4745 7.8806 114.6310 63.0723 70.1311 174.1818 14 T 4.4713 8.3480 122.5265 62.3225 69.6356 172.5558 15 T 4.3054 7.6271 114.9273 62.8741 71.4020 173.1926 16 H 4.7551 8.1640 118.5564 55.3334 30.0673 174.9064 17 T 4.8301 9.3209 113.0843 58.9939 72.9565 173.0127 18 K 4.2249 8.8165 122.7705 57.6230 32.7085 175.2076 19 C 4.2998 9.1049 128.5275 58.3337 32.3106 174.3639 20 R 3.6945 8.3772 126.4375 59.2573 30.0497 177.5391 21 R 3.6596 7.2130 116.8559 58.2726 30.5299 176.4388 22 C 4.4921 7.7540 109.6015 57.0574 30.6523 175.1812 23 G 3.9352 8.1500 108.4465 45.7945 0.0000 173.6063 24 E 4.3435 7.4382 118.6297 54.6354 31.1727 176.6607 25 K 4.4903 8.1223 124.2435 56.5087 30.0982 176.8254 26 S 4.7645 7.8077 113.3583 58.3501 66.2665 174.8415 27 Y 4.6805 8.9246 123.8249 56.8881 39.2751 174.2294 28 H 4.2355 8.8917 128.8743 56.3082 30.1558 175.6861 29 T 3.6344 8.8014 122.2425 64.0637 67.0742 175.4868 30 K 4.2157 8.2167 119.6055 59.0343 32.7282 177.9681 31 K 4.0116 7.8196 115.5445 56.2210 32.8269 176.5333 32 K 3.2602 8.1702 117.5645 55.5475 29.9835 175.8577 33 V 4.5945 6.5672 116.4436 61.4715 35.2416 172.5495 34 C 5.0218 9.3561 128.4469 58.6618 32.0743 174.3915 35 S 4.3925 9.0169 122.2724 60.3451 63.1089 175.3090 36 S 4.4210 8.1023 115.6993 60.3033 62.8084 174.3427 37 C 4.3649 8.1204 113.3050 57.9311 30.5639 175.0723 38 G 3.9512 8.3670 109.1391 45.0651 0.0000 173.0268 39 F 4.4686 8.1423 122.3522 60.0189 39.6181 175.6897 40 G 3.7060 8.7019 116.1051 44.7870 0.0000 173.5917 41 K 4.3394 8.2488 119.0483 56.9504 33.9879 176.1003 42 S 4.7012 7.7459 110.6077 55.9911 65.1139 173.4573 43 A 4.1820 8.7007 129.9290 54.9204 18.5266 178.3850 44 K 4.3083 7.4973 114.1199 55.7492 32.9455 177.0986 45 R 4.2518 8.2471 121.0912 55.9985 30.7567 176.5948 46 R 3.8861 8.7482 125.2360 56.7402 30.5845 175.3154 47 D 4.3650 7.4692 123.0664 53.6568 44.2082 174.0451 48 Y 4.4709 8.2643 122.0468 55.8185 41.6006 176.5781 49 E 4.0114 8.5199 121.7031 58.6697 29.8333 178.4898 50 W 4.7663 7.4910 113.8163 57.0343 28.3867 176.8038 51 Q 4.3762 7.5657 117.6617 57.3502 28.3726 175.4862 52 S 4.7294 7.5060 110.2506 56.1293 66.4934 173.9622 53 K 4.0373 8.5688 119.9185 56.3806 32.4756 177.8195 54 A 4.0136 9.0065 126.5288 55.5880 18.1303 179.1022 55 G 4.0926 7.9241 101.7560 45.4183 0.0000 173.2617 56 E 4.1777 8.2631 126.7535 56.1579 29.9071 174.5581 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 T 8.16 4.32 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 2 G 8.44 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.14 4.22 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 4 G 7.17 4.35 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 0.00 5 T 8.95 3.88 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 6 P 0.00 4.32 0.00 2.26 2.31 0.00 3.59 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 2.22 2.06 0.00 7 S 8.24 4.54 0.00 4.12 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 Q 8.19 4.33 0.00 2.18 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.82 0.00 0.00 0.00 0.00 0.00 2.63 2.51 0.00 9 G 7.48 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 0.00 0.00 0.00 10 K 7.85 4.34 0.00 1.75 1.85 0.00 1.75 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.40 1.45 7.81 11 K 7.50 4.39 0.00 1.82 1.78 0.00 1.64 0.00 0.00 1.76 0.00 0.00 3.07 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.37 7.81 12 N 7.95 5.06 0.00 2.77 2.83 0.00 0.00 6.29 7.71 0.00 0.00 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 T 7.88 4.47 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 14 T 8.35 4.47 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 15 T 7.63 4.31 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 1.15 0.00 0.00 16 H 8.16 4.76 0.00 3.07 3.51 0.00 5.64 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 T 9.32 4.83 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 1.33 0.00 0.00 18 K 8.82 4.22 0.00 1.79 1.81 0.00 1.84 0.00 0.00 1.64 0.00 0.00 2.82 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.42 1.51 7.81 19 C 9.10 4.30 0.00 3.17 2.85 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 20 R 8.38 3.69 0.00 1.54 1.48 0.00 3.19 0.00 0.00 3.12 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.52 0.00 21 R 7.21 3.66 0.00 0.67 1.40 0.00 3.25 0.00 0.00 3.25 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.31 0.00 22 C 7.75 4.49 0.00 3.09 3.08 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 0.00 0.00 0.00 23 G 8.15 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 24 E 7.44 4.34 0.00 2.04 1.90 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 2.31 2.41 0.00 25 K 8.12 4.49 0.00 1.80 1.78 0.00 1.74 0.00 0.00 1.73 0.00 0.00 3.06 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.58 1.51 7.81 26 S 7.81 4.76 0.00 3.86 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 27 Y 8.92 4.68 0.00 3.11 3.15 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 28 H 8.89 4.24 0.00 3.15 2.99 0.00 5.66 0.00 0.00 0.00 0.00 6.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 T 8.80 3.63 4.27 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 1.20 0.00 0.00 30 K 8.22 4.22 0.00 1.78 1.82 0.00 1.81 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.42 1.46 7.81 31 K 7.82 4.01 0.00 1.55 1.73 0.00 1.71 0.00 0.00 1.57 0.00 0.00 2.53 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.20 0.91 7.81 32 K 8.17 3.26 0.00 1.78 1.90 0.00 1.82 0.00 0.00 1.41 0.00 0.00 3.02 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.33 1.47 7.81 33 V 6.57 4.59 2.02 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 1.06 0.00 0.00 0.96 0.00 0.00 34 C 9.36 5.02 0.00 3.43 3.14 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 35 S 9.02 4.39 0.00 4.08 4.09 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 36 S 8.10 4.42 0.00 3.91 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 37 C 8.12 4.36 0.00 3.17 3.18 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 0.00 0.00 0.00 0.00 38 G 8.37 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 0.00 0.00 0.00 39 F 8.14 4.47 0.00 3.10 3.14 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 40 G 8.70 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.25 4.34 0.00 1.67 1.99 0.00 1.80 0.00 0.00 1.69 0.00 0.00 2.83 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.36 1.34 7.81 42 S 7.75 4.70 0.00 3.84 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 43 A 8.70 4.18 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 44 K 7.50 4.31 0.00 1.69 1.71 0.00 1.69 0.00 0.00 1.67 0.00 0.00 2.95 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.45 1.40 7.81 45 R 8.25 4.25 0.00 1.65 1.83 0.00 3.37 0.00 0.00 3.17 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.55 0.00 46 R 8.75 3.89 0.00 1.90 2.00 0.00 3.47 0.00 0.00 3.45 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.70 0.00 47 D 7.47 4.37 0.00 2.49 2.20 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 8.26 4.47 0.00 1.43 1.48 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 49 E 8.52 4.01 0.00 2.04 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 0.00 2.37 2.25 0.00 50 W 7.49 4.77 0.00 3.47 3.20 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 7.57 4.38 0.00 2.02 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.72 0.00 0.00 0.00 0.00 0.00 2.23 1.58 0.00 52 S 7.51 4.73 0.00 3.98 3.79 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 53 K 8.57 4.04 0.00 1.83 1.80 0.00 1.74 0.00 0.00 1.86 0.00 0.00 2.94 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.56 1.41 7.81 54 A 9.01 4.01 1.32 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 55 G 7.92 4.09 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 0.00 0.00 0.00 56 E 8.26 4.18 0.00 1.90 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 2.22 2.26 0.00