NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 Y 4.6203 8.1293 121.6900 56.6878 38.8493 174.0555 2 P 4.2805 0.0000 0.0000 61.1159 32.1138 174.9564 3 I 3.8082 9.4342 125.4577 63.4391 39.2126 177.5424 4 K 4.5174 7.7700 118.7715 53.7616 33.2201 173.9417 5 P 4.0182 0.0000 0.0000 63.5933 31.2407 177.2466 6 E 4.2970 8.3648 117.3234 56.0204 34.2560 170.7008 7 A 3.3851 8.4749 130.9801 50.7260 18.6167 175.2433 8 P 4.7528 0.0000 0.0000 62.8597 33.9821 174.4068 9 G 3.7950 8.9672 106.8908 45.9021 0.0000 173.5817 10 E 4.6431 9.2301 122.4108 55.4792 32.3033 176.4485 11 D 4.3602 8.3394 118.0726 54.4089 41.2664 179.1252 12 A 3.5159 9.3153 120.4631 51.1906 17.6038 176.6104 13 S 4.0905 9.0839 115.8121 55.9948 63.3372 170.2968 14 P 4.4013 0.0000 0.0000 64.4271 31.4169 177.0422 15 E 4.3465 8.0846 119.5791 58.6380 30.3317 177.3432 16 E 4.0176 7.9776 118.0945 59.2664 29.6765 178.8719 17 L 4.2701 8.3041 120.7509 58.2359 42.1768 178.5380 18 N 4.3480 8.1726 116.5975 56.2597 38.9482 177.1264 19 R 3.9254 8.2604 120.0026 59.5579 30.3204 178.3565 20 Y 4.1603 8.5674 119.6093 60.7780 38.6881 177.1050 21 Y 3.2108 8.1148 120.4267 60.7483 38.8654 178.1776 22 A 4.1581 8.3578 121.1256 54.6892 18.5928 179.6755 23 S 4.2632 8.1431 114.1194 61.2824 62.7972 176.4138 24 L 4.0810 7.7318 123.4596 57.9207 41.8119 178.8895 25 R 3.8447 7.8774 118.8351 59.3227 29.9298 178.0604 26 H 4.1708 8.4859 118.6447 59.3843 29.8695 176.5922 27 Y 4.3024 8.4757 121.5956 60.9428 38.4479 178.0979 28 L 3.7615 8.2387 118.8188 57.5076 42.0606 178.8682 29 N 4.4109 8.2366 117.0022 56.8550 39.0449 177.1422 30 L 4.0917 8.1398 120.5913 57.4862 41.4449 179.7738 31 V 3.6184 7.8407 118.6092 63.9561 31.3340 177.5253 32 T 4.4742 7.2245 113.9815 62.6989 70.0377 175.2257 33 R 4.6448 7.6147 120.4445 55.4518 30.7990 175.8342 34 Q 4.2716 7.7110 120.1111 55.5515 28.2722 179.1148 35 R 4.2207 7.6473 118.6545 55.5440 29.5322 174.9933 36 Y 4.1828 8.5014 123.9008 57.8369 39.7929 170.0326 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 Y 8.13 4.62 0.00 2.87 3.03 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 0.00 0.00 0.00 2 P 0.00 4.28 0.00 2.43 2.10 0.00 3.58 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.97 0.00 3 I 9.43 3.81 1.95 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.72 1.09 0.00 0.00 4 K 7.77 4.52 0.00 1.55 1.45 0.00 1.76 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.31 1.31 7.81 5 P 0.00 4.02 0.00 2.25 2.04 0.00 3.68 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.01 0.00 6 E 8.36 4.30 0.00 1.92 2.14 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 2.30 2.43 0.00 7 A 8.47 3.39 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 8 P 0.00 4.75 0.00 2.07 1.88 0.00 3.12 0.00 0.00 2.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.50 0.00 9 G 8.97 3.80 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 0.00 0.00 0.00 10 E 9.23 4.64 0.00 1.87 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 0.00 2.18 2.29 0.00 11 D 8.34 4.36 0.00 2.77 2.78 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 12 A 9.32 3.52 1.26 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 0.00 0.00 0.00 13 S 9.08 4.09 0.00 4.08 3.91 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.40 0.00 2.15 2.15 0.00 3.75 0.00 0.00 3.58 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 15 E 8.08 4.35 0.00 2.09 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 2.30 2.44 0.00 16 E 7.98 4.02 0.00 2.32 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 2.41 2.43 0.00 17 L 8.30 4.27 0.00 1.97 1.75 0.95 0.94 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 18 N 8.17 4.35 0.00 2.90 2.98 0.00 0.00 7.23 7.64 0.00 0.00 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 8.26 3.93 0.00 2.22 2.04 0.00 3.22 0.00 0.00 3.12 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.67 0.00 20 Y 8.57 4.16 0.00 2.99 3.17 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 8.11 3.21 0.00 3.19 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 22 A 8.36 4.16 1.37 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 0.00 0.00 0.00 23 S 8.14 4.26 0.00 4.10 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 24 L 7.73 4.08 0.00 1.48 1.51 0.82 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 25 R 7.88 3.84 0.00 1.93 1.88 0.00 3.12 0.00 0.00 2.98 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.65 0.00 26 H 8.49 4.17 0.00 3.49 3.38 0.00 5.66 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 27 Y 8.48 4.30 0.00 3.09 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 28 L 8.24 3.76 0.00 1.59 1.64 0.86 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 29 N 8.24 4.41 0.00 2.94 2.96 0.00 0.00 7.18 6.10 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 30 L 8.14 4.09 0.00 1.87 1.72 0.95 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 31 V 7.84 3.62 1.78 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 0.54 0.00 0.00 0.56 0.00 0.00 32 T 7.22 4.47 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 1.19 0.00 0.00 33 R 7.61 4.64 0.00 1.81 1.78 0.00 3.31 0.00 0.00 3.22 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.65 0.00 34 Q 7.71 4.27 0.00 2.09 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.94 0.00 0.00 0.00 0.00 0.00 2.38 2.34 0.00 35 R 7.65 4.22 0.00 1.76 1.90 0.00 3.43 0.00 0.00 3.15 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.71 0.00 36 Y 8.50 4.18 0.00 2.99 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