NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.3471 8.2493 123.5833 51.8820 19.5537 176.4352 2 P 4.1284 0.0000 0.0000 61.9140 32.1787 177.0475 3 L 4.3069 7.2933 120.9364 54.5082 41.6259 174.0531 4 E 4.5984 8.2869 127.2735 53.7328 29.5039 173.3995 5 P 4.3775 0.0000 0.0000 62.6605 32.7688 175.3069 6 V 3.2998 8.6408 123.8474 63.2243 32.1299 170.5275 7 Y 3.2190 8.5056 125.3020 57.3053 35.9239 167.4882 8 P 4.5446 0.0000 0.0000 62.0933 33.1309 177.6231 9 G 4.1931 8.2098 104.7635 44.2792 0.0000 171.5365 10 D 4.7327 7.3292 117.9370 53.1999 44.8193 173.1521 11 N 3.9082 8.7525 125.0709 52.9864 36.8459 173.7627 12 A 4.2789 8.1012 128.1813 52.0620 19.8423 176.5068 13 T 4.6496 7.7571 111.2109 59.2387 71.4804 172.5243 14 P 4.2746 0.0000 0.0000 66.0851 31.2347 178.5639 15 E 4.0199 7.9033 117.0932 58.2506 29.5761 177.9377 16 Q 4.4161 7.8694 118.6708 57.6881 29.9283 177.2268 17 M 3.9401 8.1171 119.8046 58.3203 32.1481 178.5773 18 A 4.2285 8.4704 121.1276 54.9288 18.4702 180.0164 19 R 3.9814 7.9184 116.4815 59.4914 30.4023 178.1361 20 Y 3.9699 8.5807 117.0411 61.6142 37.9376 178.7680 21 Y 4.2529 7.9402 116.8382 61.1406 37.9945 178.4125 22 S 4.1696 8.2884 113.7282 61.2896 62.5041 176.0194 23 A 3.9928 8.6432 123.8232 55.0394 18.0446 179.1395 24 L 3.9943 7.9414 118.8680 58.3995 42.1263 179.0409 25 R 3.9180 8.1075 118.3849 59.7177 30.0491 178.4573 26 R 3.9383 8.0956 118.3421 59.3802 30.0577 177.7567 27 Y 4.2129 8.7105 119.6821 60.8388 38.8366 177.9723 28 I 3.4500 8.0558 120.9921 64.4629 37.0358 177.7688 29 N 4.2264 7.8790 116.1276 56.9560 39.1950 176.1100 30 M 4.1483 8.4343 119.8476 58.7630 32.1521 178.2297 31 L 3.9973 8.0310 117.9589 56.8309 41.7449 178.3139 32 T 4.5975 7.2844 115.2083 62.0880 70.1867 175.0666 33 R 4.0087 7.0157 119.2408 55.4866 30.6769 175.7251 34 P 4.4448 0.0000 0.0000 63.1433 30.5764 176.6632 35 R 4.6348 7.9946 127.7160 55.2218 30.1233 174.4439 36 Y 4.3192 8.0109 120.2605 57.3778 38.1219 176.2576 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 A 8.25 4.35 1.29 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 0.00 0.00 0.00 2 P 0.00 4.13 0.00 2.27 2.19 0.00 3.81 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.01 0.00 3 L 7.29 4.31 0.00 1.72 1.68 0.92 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 4 E 8.29 4.60 0.00 1.91 1.88 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 2.21 2.27 0.00 5 P 0.00 4.38 0.00 2.23 2.04 0.00 3.96 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.96 0.00 6 V 8.64 3.30 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 0.93 0.00 0.00 0.96 0.00 0.00 7 Y 8.51 3.22 0.00 3.13 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 P 0.00 4.54 0.00 2.31 2.03 0.00 3.49 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 1.86 1.89 0.00 9 G 8.21 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 7.33 4.73 0.00 2.56 2.51 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.75 3.91 0.00 2.81 2.83 0.00 0.00 6.97 7.94 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 12 A 8.10 4.28 1.17 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 0.00 0.00 13 T 7.76 4.65 4.22 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 1.17 0.00 0.00 14 P 0.00 4.27 0.00 2.31 2.30 0.00 3.74 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 2.07 2.05 0.00 15 E 7.90 4.02 0.00 1.92 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 0.00 2.36 2.38 0.00 16 Q 7.87 4.42 0.00 2.12 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.98 0.00 0.00 0.00 0.00 0.00 2.32 2.54 0.00 17 M 8.12 3.94 0.00 2.15 2.23 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.54 0.00 18 A 8.47 4.23 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.92 3.98 0.00 2.10 2.11 0.00 3.36 0.00 0.00 3.38 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.71 0.00 20 Y 8.58 3.97 0.00 3.08 2.80 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 21 Y 7.94 4.25 0.00 3.09 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 S 8.29 4.17 0.00 4.11 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 23 A 8.64 3.99 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 24 L 7.94 3.99 0.00 1.83 2.06 1.04 1.12 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 25 R 8.11 3.92 0.00 2.05 2.16 0.00 3.23 0.00 0.00 3.13 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.73 0.00 26 R 8.10 3.94 0.00 1.98 1.97 0.00 3.18 0.00 0.00 3.12 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.67 0.00 27 Y 8.71 4.21 0.00 3.06 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 28 I 8.06 3.45 2.08 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.50 0.88 0.00 0.00 29 N 7.88 4.23 0.00 2.88 2.96 0.00 0.00 7.26 7.46 0.00 0.00 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 M 8.43 4.15 0.00 2.22 2.13 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 2.62 2.59 0.00 31 L 8.03 4.00 0.00 1.55 1.50 -0.07 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 32 T 7.28 4.60 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 1.20 0.00 0.00 33 R 7.02 4.01 0.00 1.95 1.88 0.00 3.17 0.00 0.00 3.28 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.70 0.00 34 P 0.00 4.44 0.00 2.25 2.15 0.00 3.72 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.97 0.00 35 R 7.99 4.63 0.00 1.72 1.82 0.00 3.21 0.00 0.00 3.24 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.56 0.00 36 Y 8.01 4.32 0.00 3.15 2.92 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