NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.3392 8.2644 123.5821 52.0483 19.9360 175.8493 2 V 4.3337 7.9648 121.1911 58.5144 34.8449 173.3426 3 Q 4.0719 8.8302 123.2890 57.0275 29.4832 176.0900 4 Q 4.4145 8.4825 119.1472 56.5288 30.1137 175.2726 5 N 4.8382 7.7004 113.9736 51.4832 42.4892 173.3585 6 K 3.8068 8.7757 124.0213 55.9621 32.1304 174.4819 7 P 4.2156 0.0000 0.0000 63.1000 31.9879 177.2126 8 T 4.0501 8.4093 116.9656 61.8491 69.1367 175.1823 9 R 4.0176 8.5145 122.3501 58.9399 29.5099 179.1053 10 S 4.0653 7.7786 114.6143 61.2998 62.5920 175.6393 11 K 3.8344 8.0788 121.8462 59.5333 31.6020 177.9884 12 R 3.9724 7.6285 117.4216 59.6528 30.1572 178.2199 13 G 3.7665 7.7590 104.7408 48.2293 0.0000 175.1620 14 M 3.9864 7.8798 121.2021 58.4361 31.7564 178.9619 15 R 3.9924 7.7900 117.3417 58.9509 30.1724 177.7905 16 R 4.3229 8.0398 116.3409 56.3390 29.9350 178.2027 17 S 4.1230 7.4413 115.3870 62.2385 62.9687 175.7142 18 H 4.2801 8.0116 119.1130 57.7189 29.2777 176.5146 19 D 4.6689 7.4426 119.7621 53.9120 38.2642 174.0910 20 A 4.7935 7.3832 122.3614 50.2656 23.0560 175.3656 21 L 4.6777 8.1791 118.5915 53.5756 43.7877 176.2626 22 T 4.6846 7.9623 114.1789 60.0411 70.5791 176.2425 23 A 4.7373 7.9077 132.3716 51.6709 17.3932 180.1873 24 V 4.4202 8.3183 111.0620 62.8832 35.1050 174.8660 25 T 3.8058 8.8503 108.4470 62.1783 67.4765 168.4467 26 S 4.1181 7.4885 121.6881 58.7220 65.1862 168.9364 27 L 4.8093 7.7930 128.9195 54.9485 39.1531 178.3829 28 S 4.7659 8.6587 109.3938 57.3183 65.9245 172.8344 29 V 5.0767 8.3474 123.4907 59.8724 33.7675 174.8080 30 D 4.5300 8.6375 122.3779 54.1884 41.6681 176.2050 31 K 4.2853 8.5153 120.8089 58.7629 33.1370 178.8172 32 T 4.1616 8.0202 115.1379 65.8545 68.8214 174.2296 33 S 4.7098 7.2085 114.3627 56.6496 66.3272 174.9591 34 G 3.8347 8.2986 111.1729 45.2510 0.0000 173.7103 35 E 4.3128 7.5821 118.5307 54.9811 31.8369 177.5993 36 K 4.7966 8.7539 127.2053 55.5262 31.1296 175.0106 37 H 5.1363 9.0739 121.6303 52.7263 31.9834 173.2623 38 L 4.2354 8.2874 121.4650 54.6303 43.2468 176.4414 39 R 3.8971 8.6106 124.4173 58.6465 30.4304 176.2446 40 H 4.8787 10.2000 117.0492 56.4102 26.0350 174.1873 41 H 3.7321 8.2926 110.2508 56.1590 31.2753 174.9979 42 I 3.2626 7.1601 122.3753 60.0884 36.7164 174.9835 43 T 4.4241 8.8118 115.4465 60.5510 70.7103 174.8757 44 A 4.3575 7.8887 122.8756 54.1406 18.2761 177.8477 45 D 4.8086 8.2010 112.8801 53.4534 43.0832 176.0951 46 G 4.1848 8.1852 106.5692 46.4742 0.0000 173.2241 47 Y 4.9839 8.7383 117.8143 56.8026 41.2527 176.4370 48 Y 5.3374 8.1784 123.9962 58.0059 39.9665 177.7929 49 R 4.2416 8.0703 113.6352 55.4426 29.6584 175.5678 50 G 4.2699 7.7432 105.9190 45.2085 0.0000 171.6248 51 R 3.4486 8.4269 115.4092 57.9243 30.4443 175.0800 52 K 3.7513 7.9950 118.1273 56.4043 33.6987 176.1114 53 V 4.1182 8.5093 120.7055 59.9260 33.7401 172.1548 54 I 2.9783 8.3527 127.7577 60.5125 36.5945 174.0238 55 A 3.8839 8.8159 127.9538 53.7905 18.7937 177.1310 56 K 4.2808 8.6550 119.7119 57.3863 34.2586 174.4555 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 8.26 4.34 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 2 V 7.96 4.33 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 0.86 0.00 0.00 0.93 0.00 0.00 3 Q 8.83 4.07 0.00 2.19 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.63 0.00 0.00 0.00 0.00 0.00 2.33 2.37 0.00 4 Q 8.48 4.41 0.00 2.02 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.69 0.00 0.00 0.00 0.00 0.00 2.26 2.36 0.00 5 N 7.70 4.84 0.00 2.69 2.65 0.00 0.00 6.87 7.61 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 6 K 8.78 3.81 0.00 1.71 1.77 0.00 1.80 0.00 0.00 1.70 0.00 0.00 2.78 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.43 1.48 7.81 7 P 0.00 4.22 0.00 2.08 2.00 0.00 3.74 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.09 0.00 8 T 8.41 4.05 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 1.23 0.00 0.00 9 R 8.51 4.02 0.00 2.07 2.18 0.00 3.02 0.00 0.00 3.26 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.69 0.00 10 S 7.78 4.07 0.00 3.87 3.89 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 0.00 0.00 0.00 11 K 8.08 3.83 0.00 1.90 1.95 0.00 1.69 0.00 0.00 1.75 0.00 0.00 2.98 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.51 1.58 7.81 12 R 7.63 3.97 0.00 1.86 2.22 0.00 3.32 0.00 0.00 3.23 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.68 0.00 13 G 7.76 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 M 7.88 3.99 0.00 2.12 2.29 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 2.83 2.57 0.00 15 R 7.79 3.99 0.00 1.85 2.13 0.00 3.26 0.00 0.00 3.23 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.68 0.00 16 R 8.04 4.32 0.00 2.02 1.93 0.00 3.19 0.00 0.00 3.22 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.63 0.00 17 S 7.44 4.12 0.00 3.87 4.03 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 18 H 8.01 4.28 0.00 3.18 3.41 0.00 5.70 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 D 7.44 4.67 0.00 2.77 2.65 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.38 4.79 1.20 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 0.00 0.00 21 L 8.18 4.68 0.00 1.64 1.59 0.92 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 22 T 7.96 4.68 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 23 A 7.91 4.74 1.03 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 0.00 0.00 24 V 8.32 4.42 2.09 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 0.84 0.00 0.00 0.96 0.00 0.00 25 T 8.85 3.81 4.25 0.00 0.00 0.00 0.00 0.00 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 26 S 7.49 4.12 0.00 3.87 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 27 L 7.79 4.81 0.00 1.97 0.98 0.94 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 28 S 8.66 4.77 0.00 3.93 3.78 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 29 V 8.35 5.08 2.09 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 0.77 0.00 0.00 0.93 0.00 0.00 30 D 8.64 4.53 0.00 2.58 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 31 K 8.52 4.29 0.00 1.78 1.83 0.00 1.77 0.00 0.00 1.68 0.00 0.00 2.96 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.38 1.43 7.81 32 T 8.02 4.16 4.66 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 33 S 7.21 4.71 0.00 3.80 3.31 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 34 G 8.30 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 E 7.58 4.31 0.00 1.79 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.22 0.00 36 K 8.75 4.80 0.00 1.77 1.76 0.00 1.73 0.00 0.00 1.76 0.00 0.00 3.00 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.41 1.45 7.81 37 H 9.07 5.14 0.00 3.26 3.37 0.00 5.32 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 L 8.29 4.24 0.00 1.73 1.69 0.97 0.93 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 39 R 8.61 3.90 0.00 1.87 1.99 0.00 3.57 0.00 0.00 3.26 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.66 0.00 40 H 10.20 4.88 0.00 3.20 3.44 0.00 5.98 0.00 0.00 0.00 0.00 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 H 8.29 3.73 0.00 3.02 3.02 0.00 5.58 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 I 7.16 3.26 1.82 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.70 0.93 0.00 0.00 43 T 8.81 4.42 4.28 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 1.32 0.00 0.00 44 A 7.89 4.36 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 45 D 8.20 4.81 0.00 2.84 2.73 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 46 G 8.19 4.18 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 0.00 0.00 0.00 47 Y 8.74 4.98 0.00 3.00 3.10 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 0.00 0.00 0.00 0.00 48 Y 8.18 5.34 0.00 2.94 1.85 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 49 R 8.07 4.24 0.00 1.50 1.62 0.00 2.84 0.00 0.00 2.89 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.50 0.00 50 G 7.74 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 0.00 0.00 0.00 0.00 51 R 8.43 3.45 0.00 1.94 1.96 0.00 3.22 0.00 0.00 3.13 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.53 0.00 52 K 7.99 3.75 0.00 0.79 1.29 0.00 1.51 0.00 0.00 1.54 0.00 0.00 3.23 0.00 0.00 3.04 0.00 0.00 0.00 0.00 0.96 0.34 7.81 53 V 8.51 4.12 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 0.85 0.00 0.00 1.00 0.00 0.00 54 I 8.35 2.98 1.86 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 1.34 0.34 0.91 0.00 0.00 55 A 8.82 3.88 1.24 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 0.00 0.00 0.00 56 K 8.66 4.28 0.00 1.94 1.90 0.00 1.50 0.00 0.00 1.75 0.00 0.00 3.12 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.34 1.48 7.81