NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 7 G 3.9366 8.3393 109.7387 44.7257 0.0000 172.9508 8 P 4.4390 0.0000 0.0000 61.2801 32.3931 174.4651 9 H 4.4405 8.3130 117.1364 55.7679 30.2202 176.7234 10 M 4.2877 8.4316 119.9476 55.7616 31.8113 176.1901 11 R 4.7410 8.5244 117.5910 56.1570 32.7144 174.7237 12 T 5.1945 7.6445 114.3052 62.4425 72.9215 172.9122 13 I 4.5435 8.4031 122.4955 60.1040 42.0022 174.3398 14 S 5.1057 8.5439 122.0215 57.1587 64.4537 174.5354 15 Y 4.0773 8.7351 122.5769 61.0408 38.2650 178.2136 16 S 3.4842 8.0011 112.0733 61.5365 62.2505 175.4493 17 E 3.9938 8.0174 120.8993 58.9539 29.4722 178.4580 18 A 4.0352 8.1491 121.2709 54.8915 18.1392 179.4932 19 R 3.7786 7.5160 115.9901 59.5649 30.1326 177.8966 20 Q 4.3446 7.3931 111.6600 56.5638 29.3096 175.9952 21 N 5.0325 7.8032 115.0342 52.2124 40.2376 176.0929 22 L 3.9000 8.3108 122.0277 58.4770 41.9861 178.4711 23 S 4.0442 8.0876 112.0171 61.4981 62.3791 175.8230 24 A 3.9953 7.9408 122.7759 55.5070 18.1977 179.5253 25 T 3.8401 8.1671 114.4243 67.0049 68.5077 176.8064 26 M 4.0600 8.4207 120.9609 58.7474 31.9482 178.7166 27 M 4.0824 8.1827 118.8198 58.2317 32.0889 178.8108 28 K 3.9476 8.1452 119.6653 59.3214 32.2735 178.7886 29 A 4.2664 7.9244 122.4554 54.5811 18.1475 179.8730 30 V 3.5270 7.7882 116.7547 65.9658 31.4244 177.7829 31 E 3.9469 8.2874 118.6754 59.4168 29.4413 177.3990 32 D 4.5730 8.1163 114.8988 54.1530 41.4718 175.5871 33 H 4.0245 7.7259 118.2106 56.6922 28.7865 173.9277 34 A 4.9539 7.7338 117.9511 49.2959 22.9401 175.2379 35 P 4.6178 0.0000 0.0000 62.9272 32.6353 175.5959 36 I 4.6550 8.6849 122.6971 59.4937 40.3399 174.2546 37 L 4.7110 8.8222 129.4862 54.3238 43.7524 175.2699 38 I 4.8861 9.1121 128.4067 59.9207 38.5857 175.4109 39 T 4.5891 8.7767 118.4812 61.3911 70.6485 174.0835 40 R 4.7413 8.2130 120.8633 54.5674 32.6194 174.8059 41 Q 4.0739 9.2254 126.2332 58.7461 29.1299 176.6356 42 N 4.8065 8.0092 111.0719 54.3526 39.5497 176.7158 43 G 3.8831 7.6911 109.7845 44.4642 0.0000 171.8075 44 E 4.5526 8.4265 120.1035 54.4980 31.5356 175.6333 45 A 4.5305 8.2676 123.6487 52.2315 19.6776 176.1590 46 C 4.9796 8.9218 115.9264 57.9467 32.8361 173.2921 47 V 4.8409 8.3523 119.5104 61.0854 33.8279 174.2493 48 L 4.9570 8.8773 129.3236 53.5148 44.5384 174.9240 49 M 5.2267 8.3959 121.8948 53.6791 34.4960 174.6683 50 S 4.3251 8.6025 114.1546 57.9616 64.1555 175.0635 51 L 4.0087 8.5737 123.3490 58.3328 41.8321 179.0667 52 E 4.0018 8.2214 118.0850 59.6480 29.5064 178.8921 53 E 3.9914 8.4242 119.2873 59.2715 29.6120 178.1929 54 Y 4.0230 8.1816 119.7300 60.7990 38.9242 177.8345 55 N 4.2395 8.6894 117.8438 56.2430 38.6970 177.2389 56 S 4.0919 8.1265 114.5899 61.4096 62.4324 176.0657 57 L 3.9224 7.8492 122.8989 58.1842 41.9298 178.8624 58 E 3.9478 7.8386 118.5884 59.3168 29.4747 178.9474 59 E 4.0365 8.6708 119.0761 59.7588 29.4441 179.7169 60 T 3.8460 7.9196 115.2103 66.6300 68.4819 176.5725 61 A 4.1268 7.8295 120.1114 54.0153 18.4254 177.9143 62 Y 4.2590 7.5547 113.2590 56.2434 39.7429 175.1572 63 L 3.5213 8.5157 119.8676 56.3252 39.3970 174.5414 64 L 3.9910 8.0111 121.5485 56.3177 42.2669 175.0088 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 7 G 8.34 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 8 P 0.00 4.44 0.00 2.28 2.05 0.00 3.78 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.05 0.00 9 H 8.31 4.44 0.00 3.14 3.26 0.00 5.72 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 M 8.43 4.29 0.00 2.13 2.08 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.56 0.00 11 R 8.52 4.74 0.00 1.72 1.93 0.00 3.27 0.00 0.00 3.42 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.57 0.00 12 T 7.64 5.19 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 1.26 0.00 0.00 13 I 8.40 4.54 1.87 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 1.28 1.31 0.98 0.00 0.00 14 S 8.54 5.11 0.00 4.08 3.99 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 15 Y 8.74 4.08 0.00 3.11 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 S 8.00 3.48 0.00 3.84 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 E 8.02 3.99 0.00 2.06 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 2.27 2.28 0.00 18 A 8.15 4.04 1.40 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 0.00 0.00 0.00 19 R 7.52 3.78 0.00 1.73 1.91 0.00 3.03 0.00 0.00 2.87 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.92 0.00 20 Q 7.39 4.34 0.00 2.02 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 7.35 0.00 0.00 0.00 0.00 0.00 2.31 2.25 0.00 21 N 7.80 5.03 0.00 2.81 2.72 0.00 0.00 6.49 6.36 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 22 L 8.31 3.90 0.00 1.89 1.67 0.93 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 23 S 8.09 4.04 0.00 3.92 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 A 7.94 4.00 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 25 T 8.17 3.84 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 1.21 0.00 0.00 26 M 8.42 4.06 0.00 2.03 2.25 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.78 2.58 0.00 27 M 8.18 4.08 0.00 2.06 2.25 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.87 2.55 0.00 28 K 8.15 3.95 0.00 1.82 1.93 0.00 1.62 0.00 0.00 1.65 0.00 0.00 2.90 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.51 1.43 7.81 29 A 7.92 4.27 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.79 3.53 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.97 0.00 0.00 31 E 8.29 3.95 0.00 2.17 1.98 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 2.33 2.35 0.00 32 D 8.12 4.57 0.00 2.77 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 H 7.73 4.02 0.00 3.18 3.34 0.00 5.90 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 A 7.73 4.95 1.25 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 0.00 0.00 0.00 35 P 0.00 4.62 0.00 2.10 2.08 0.00 3.72 0.00 0.00 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.01 0.00 36 I 8.68 4.66 1.88 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 1.13 0.84 0.92 0.00 0.00 37 L 8.82 4.71 0.00 1.78 1.68 0.96 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 38 I 9.11 4.89 1.91 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.75 1.00 0.00 0.00 39 T 8.78 4.59 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 1.23 0.00 0.00 40 R 8.21 4.74 0.00 1.64 1.89 0.00 3.29 0.00 0.00 3.03 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.55 0.00 41 Q 9.23 4.07 0.00 2.03 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.85 0.00 0.00 0.00 0.00 0.00 2.38 2.47 0.00 42 N 8.01 4.81 0.00 2.83 2.88 0.00 0.00 5.97 7.00 0.00 0.00 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 G 7.69 3.88 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 0.00 0.00 0.00 44 E 8.43 4.55 0.00 1.94 1.86 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 2.21 2.21 0.00 45 A 8.27 4.53 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 46 C 8.92 4.98 0.00 2.86 2.79 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 47 V 8.35 4.84 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 0.80 0.00 0.00 0.95 0.00 0.00 48 L 8.88 4.96 0.00 1.76 1.47 0.92 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 49 M 8.40 5.23 0.00 2.04 1.99 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.60 0.00 50 S 8.60 4.33 0.00 4.22 4.04 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.57 4.01 0.00 1.79 1.74 1.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 52 E 8.22 4.00 0.00 2.17 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 0.00 2.45 2.48 0.00 53 E 8.42 3.99 0.00 1.72 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 2.30 2.28 0.00 54 Y 8.18 4.02 0.00 3.14 3.16 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.69 4.24 0.00 2.80 2.86 0.00 0.00 6.69 7.20 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 56 S 8.13 4.09 0.00 4.01 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 L 7.85 3.92 0.00 1.98 1.57 0.91 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 58 E 7.84 3.95 0.00 1.93 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 2.31 1.92 0.00 59 E 8.67 4.04 0.00 2.14 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 2.29 2.58 0.00 60 T 7.92 3.85 4.39 0.00 0.00 0.00 0.00 0.00 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 61 A 7.83 4.13 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 62 Y 7.55 4.26 0.00 3.23 2.94 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 63 L 8.52 3.52 0.00 1.80 1.73 0.93 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 64 L 8.01 3.99 0.00 1.89 1.70 0.93 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 0.00 0.00 0.00 0.00 0.00 0.00