NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 8 K 3.9702 8.3144 119.9541 55.7335 34.4167 174.7059 9 K 3.9733 7.3901 120.2872 54.1639 34.5863 174.2356 10 F 4.9273 9.0070 125.8720 55.8083 41.8862 174.7434 11 F 4.9802 8.6593 121.9204 55.7271 42.6077 174.1223 12 I 4.7277 8.3052 117.1863 58.3173 40.6245 175.6484 13 S 4.5265 8.5380 117.0639 57.8341 65.2843 175.1556 14 R 4.0455 8.4067 120.4475 59.3039 29.8669 178.0174 15 K 4.1518 8.0730 119.1980 59.3541 32.2119 178.6279 16 E 3.9751 7.9939 117.9497 59.4356 29.4464 178.3646 17 Y 4.1420 8.0693 119.6093 60.9089 38.9107 178.2056 18 E 3.7325 8.5404 119.4745 59.2710 29.6176 179.2502 19 K 3.9083 7.9308 119.3880 59.6261 32.1638 178.9313 20 I 3.7191 7.8680 120.1193 64.2508 36.9344 178.2838 21 E 3.7779 7.9293 119.6606 59.0514 28.9055 178.9405 22 E 3.8575 7.9787 119.1887 59.2498 29.6837 178.8082 23 I 3.6913 7.7015 119.7712 64.5622 37.2220 178.3972 24 L 3.9665 8.0545 119.7292 57.8147 41.2984 179.3352 25 D 4.3505 8.0749 118.8727 57.4143 40.6703 179.0010 26 I 3.7960 7.5571 120.1825 64.2054 37.0857 178.5324 27 G 3.6778 8.1676 106.7045 47.8297 0.0000 175.3756 28 L 3.9176 8.0363 122.6378 57.7116 42.1397 178.6009 29 A 3.9776 8.2347 121.0577 55.5112 18.1274 179.8713 30 K 4.1221 8.4572 116.7769 59.3399 31.8611 179.4290 31 A 4.0045 8.1846 120.8977 55.5330 18.5301 179.3206 32 M 4.1614 8.2957 117.2277 58.5370 31.8850 178.7584 33 E 3.9707 8.2726 118.7598 59.4648 29.3813 179.1585 34 E 4.0975 7.9291 117.7874 58.4243 29.7274 177.6706 35 T 4.5753 7.6684 108.6347 61.0790 69.2281 176.4056 36 K 3.8852 7.7104 125.3672 59.6146 32.1547 177.1582 37 D 4.7387 7.8491 115.2486 53.9396 41.3321 176.2649 38 D 4.4444 7.7361 120.3269 53.8406 41.3406 176.0492 39 E 3.9685 8.6912 123.7416 56.6124 30.1412 175.9677 40 L 4.5839 8.3386 125.3640 53.3630 43.1697 175.9070 41 L 4.9792 8.1952 122.7522 52.9366 44.4540 177.0261 42 T 4.3408 8.6225 113.1119 61.0139 70.7038 175.4230 43 Y 4.3856 8.4946 121.1488 61.1753 38.6341 177.5435 44 D 4.2531 8.1834 119.2094 57.6092 40.7197 178.6685 45 E 3.9895 7.8418 117.6290 59.2465 29.4996 178.9075 46 I 3.9005 7.7232 118.2870 63.2350 38.1236 177.3703 47 K 4.0475 7.5484 117.9248 56.8931 32.9246 176.5932 48 E 4.0681 7.7490 123.9292 56.7874 29.9839 173.9153 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 8 K 8.31 3.97 0.00 1.77 1.90 0.00 1.44 0.00 0.00 1.67 0.00 0.00 2.87 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.21 1.35 7.81 9 K 7.39 3.97 0.00 1.62 1.58 0.00 1.69 0.00 0.00 1.67 0.00 0.00 3.08 0.00 0.00 3.18 0.00 0.00 0.00 0.00 0.89 1.31 7.81 10 F 9.01 4.93 0.00 2.94 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 11 F 8.66 4.98 0.00 3.01 2.90 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 12 I 8.31 4.73 2.03 0.00 0.00 0.96 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 0.78 1.02 0.00 0.00 13 S 8.54 4.53 0.00 4.15 4.11 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 14 R 8.41 4.05 0.00 1.93 2.01 0.00 3.20 0.00 0.00 3.31 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.69 0.00 15 K 8.07 4.15 0.00 1.89 1.82 0.00 1.79 0.00 0.00 1.83 0.00 0.00 2.94 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.53 1.55 7.81 16 E 7.99 3.98 0.00 2.33 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 0.00 2.35 2.35 0.00 17 Y 8.07 4.14 0.00 3.03 3.22 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 18 E 8.54 3.73 0.00 2.23 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 2.39 2.62 0.00 19 K 7.93 3.91 0.00 1.89 1.95 0.00 1.50 0.00 0.00 1.62 0.00 0.00 3.02 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.42 1.50 7.81 20 I 7.87 3.72 1.98 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 1.49 0.45 0.86 0.00 0.00 21 E 7.93 3.78 0.00 1.87 1.80 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 1.47 1.83 0.00 22 E 7.98 3.86 0.00 2.02 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 0.00 2.27 2.32 0.00 23 I 7.70 3.69 1.98 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 1.64 0.66 0.88 0.00 0.00 24 L 8.05 3.97 0.00 1.93 1.67 0.89 1.06 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 25 D 8.07 4.35 0.00 2.83 2.69 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 26 I 7.56 3.80 1.98 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.69 0.90 0.00 0.00 27 G 8.17 3.68 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 0.00 0.00 0.00 28 L 8.04 3.92 0.00 1.87 1.83 0.91 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 29 A 8.23 3.98 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.46 4.12 0.00 1.87 1.86 0.00 1.88 0.00 0.00 1.64 0.00 0.00 2.97 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.73 1.59 7.81 31 A 8.18 4.00 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 32 M 8.30 4.16 0.00 2.07 2.27 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.80 2.57 0.00 33 E 8.27 3.97 0.00 2.21 2.00 0.00 0.00 0.00 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 2.57 0.00 34 E 7.93 4.10 0.00 2.05 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.54 0.00 35 T 7.67 4.58 4.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 36 K 7.71 3.89 0.00 1.89 1.89 0.00 1.78 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.45 1.42 7.81 37 D 7.85 4.74 0.00 2.70 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 38 D 7.74 4.44 0.00 2.85 2.61 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.69 3.97 0.00 1.92 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 2.30 2.35 0.00 40 L 8.34 4.58 0.00 1.65 1.58 0.98 0.94 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 41 L 8.20 4.98 0.00 1.63 1.57 0.94 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 42 T 8.62 4.34 4.30 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 1.23 0.00 0.00 43 Y 8.49 4.39 0.00 2.95 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 44 D 8.18 4.25 0.00 2.75 2.67 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 45 E 7.84 3.99 0.00 2.19 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 0.00 2.35 2.32 0.00 46 I 7.72 3.90 1.95 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.07 1.12 0.00 0.00 47 K 7.55 4.05 0.00 1.85 1.76 0.00 1.49 0.00 0.00 1.16 0.00 0.00 2.13 0.00 0.00 2.61 0.00 0.00 0.00 0.00 1.38 1.36 7.81 48 E 7.75 4.07 0.00 2.08 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 2.22 2.47 0.00