NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 T 4.2886 8.1744 117.3709 63.2562 70.4771 174.5702 6 E 4.2801 7.8845 124.8012 53.5536 28.8696 173.1020 7 L 4.8073 8.6236 124.3584 52.6494 46.0720 175.8966 8 R 4.5341 7.9334 119.9817 56.0605 31.5692 176.0070 9 C 4.7120 8.6440 121.3943 57.0955 41.5964 173.4080 10 Q 4.0726 8.4523 121.4572 57.1895 29.1119 176.5208 11 C 4.9101 7.6762 114.0220 56.3229 43.9681 173.8539 12 L 4.0005 8.5902 124.2039 56.0221 41.9038 175.9769 13 Q 4.6506 7.6693 117.4857 54.5504 32.4123 173.0623 14 T 4.7444 7.9724 109.0360 60.4331 71.8484 172.9257 15 L 4.5642 8.9853 122.5433 53.6412 43.2586 177.5123 16 Q 4.1196 9.3727 120.1534 56.3365 29.4806 173.5613 17 G 2.9924 7.5238 102.6807 45.0894 0.0000 172.9620 18 I 4.3449 7.5576 127.8995 58.7654 39.1266 175.5311 19 H 4.1270 8.5977 121.0710 57.1837 29.8209 175.1244 20 L 4.4578 8.5378 126.6201 55.3161 41.9912 177.0608 21 K 4.1023 7.7754 118.4958 58.5738 32.8625 177.1234 22 N 4.6365 7.8014 114.7963 54.9092 39.5062 175.7086 23 I 4.0736 7.7042 118.2117 61.9848 37.4576 175.1866 24 Q 4.6249 9.3041 126.1057 56.5830 31.1510 175.3007 25 S 4.7557 7.7347 112.8345 57.3742 67.7028 173.2619 26 V 4.6629 8.2934 121.3318 60.9967 34.2451 174.4749 27 K 4.6010 9.3534 128.6716 54.5509 35.1809 174.5329 28 V 4.6911 8.5258 127.0118 61.1292 33.3049 175.1777 29 K 4.4858 8.3960 129.0243 53.6538 32.7755 175.2596 30 S 4.5162 8.5518 121.8781 57.4599 64.0056 171.4878 31 P 4.7012 0.0000 0.0000 63.3335 32.5404 174.9732 32 G 3.8470 9.1639 107.8240 44.6891 0.0000 171.9283 33 P 4.6317 0.0000 0.0000 63.9439 31.7355 175.4969 34 H 4.6360 7.5545 111.0934 56.9385 30.2230 173.3096 35 C 4.5811 7.6068 123.1912 54.2205 43.9797 172.8896 36 A 4.6858 8.4698 130.2763 52.3066 18.6667 176.1044 37 Q 4.7245 7.5545 115.9477 55.8263 32.8390 175.3620 38 T 4.3888 8.4708 117.7705 63.6093 69.7812 175.1539 39 E 4.4659 8.3535 122.1276 55.4650 31.8291 173.4597 40 V 4.3356 8.2657 126.6545 62.4436 33.4923 174.3614 41 I 4.8244 9.5843 129.2732 59.5724 40.1813 174.2255 42 A 5.0732 8.5196 128.7702 50.6145 21.9241 175.2551 43 T 4.7117 8.8319 118.0895 62.2626 70.4546 174.5246 44 L 4.6099 9.7073 129.0164 54.5662 43.3107 177.4358 45 K 4.1816 9.2432 124.8663 57.6960 32.2578 176.8967 46 N 4.5883 7.8034 115.0348 53.7999 39.4846 175.0692 47 G 4.0391 7.8739 104.7392 45.7828 0.0000 173.7970 48 Q 4.5376 7.7514 118.6180 55.1079 31.6173 174.4098 49 K 4.7485 8.3645 116.9699 55.4014 36.5801 176.2872 50 A 4.6017 9.0376 124.8455 50.3478 22.0760 174.9150 51 C 4.8171 8.9081 120.2377 57.3629 41.6981 173.1976 52 L 5.1186 8.5117 122.1044 53.0599 44.6841 175.2762 53 N 4.8618 8.5424 119.6922 51.6204 39.8788 173.7020 54 P 4.5481 0.0000 0.0000 63.7631 31.7089 176.3127 55 A 4.6856 7.8084 120.8953 51.8999 19.6173 175.8885 56 S 4.7884 7.6750 113.4182 57.0622 64.6801 173.2762 57 P 4.4658 0.0000 0.0000 64.5791 31.5884 176.5675 58 M 4.2209 8.0435 118.7839 56.7563 32.2844 177.5184 59 V 3.8042 7.5171 116.9801 64.8370 31.4855 176.7239 60 K 4.2773 7.8350 116.0038 56.4968 32.2680 177.1029 61 K 4.5176 7.7167 119.1264 56.8638 33.8950 177.5592 62 I 3.7968 7.6813 119.8883 62.5574 37.4010 177.2603 63 I 3.9492 7.0832 121.4031 63.7555 37.3480 177.5772 64 E 3.9450 8.2128 117.7823 59.7545 29.4532 179.4196 65 K 4.1608 7.7044 118.0036 59.4756 31.8088 179.2610 66 M 3.9947 7.5244 118.6699 58.4593 31.7276 178.6807 67 L 3.8919 8.0447 117.2569 56.6567 41.8030 178.5593 68 K 4.2526 7.3139 116.8803 56.1808 33.0799 174.5305 69 N 4.3082 9.2352 117.4454 53.2788 39.4241 173.5355 70 G 4.2109 7.5851 106.3576 44.3428 0.0000 170.6118 71 K 4.3412 8.2250 122.5555 56.1992 34.2321 177.1800 72 S 4.4524 8.0339 112.0461 58.5197 63.4750 175.1101 73 N 4.4285 8.7509 126.0573 54.6254 39.7072 173.7215 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 5 T 8.17 4.29 4.23 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 0.00 0.00 0.00 1.21 0.00 0.00 6 E 7.88 4.28 0.00 1.97 1.84 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 2.19 2.40 0.00 7 L 8.62 4.81 0.00 1.48 1.49 0.82 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 8 R 7.93 4.53 0.00 1.75 1.68 0.00 3.20 0.00 0.00 3.23 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.63 0.00 9 C 8.64 4.71 0.00 3.04 3.14 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 0.00 0.00 0.00 10 Q 8.45 4.07 0.00 2.02 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.68 0.00 0.00 0.00 0.00 0.00 2.33 2.33 0.00 11 C 7.68 4.91 0.00 2.94 3.02 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 0.00 0.00 0.00 12 L 8.59 4.00 0.00 1.63 1.72 0.92 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 13 Q 7.67 4.65 0.00 1.92 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.78 0.00 0.00 0.00 0.00 0.00 2.22 2.37 0.00 14 T 7.97 4.74 4.31 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 1.22 0.00 0.00 15 L 8.99 4.56 0.00 1.75 1.61 0.93 0.87 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 16 Q 9.37 4.12 0.00 2.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 7.27 0.00 0.00 0.00 0.00 0.00 2.28 2.34 0.00 17 G 7.52 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 0.00 0.00 0.00 18 I 7.56 4.34 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 1.30 0.65 0.93 0.00 0.00 19 H 8.60 4.13 0.00 3.16 3.17 0.00 5.68 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 L 8.54 4.46 0.00 1.65 1.66 1.02 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 21 K 7.78 4.10 0.00 1.55 1.52 0.00 1.67 0.00 0.00 1.66 0.00 0.00 3.02 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.32 1.45 7.81 22 N 7.80 4.64 0.00 2.83 2.83 0.00 0.00 6.84 7.21 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 23 I 7.70 4.07 1.87 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 1.30 0.47 0.97 0.00 0.00 24 Q 9.30 4.62 0.00 2.08 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.77 6.63 0.00 0.00 0.00 0.00 0.00 2.26 2.44 0.00 25 S 7.73 4.76 0.00 3.77 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 26 V 8.29 4.66 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 0.73 0.00 0.00 0.93 0.00 0.00 27 K 9.35 4.60 0.00 1.74 1.75 0.00 1.65 0.00 0.00 1.58 0.00 0.00 2.81 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.31 1.49 7.81 28 V 8.53 4.69 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 0.79 0.00 0.00 0.93 0.00 0.00 29 K 8.40 4.49 0.00 1.81 1.63 0.00 1.74 0.00 0.00 1.65 0.00 0.00 2.87 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.32 1.53 7.81 30 S 8.55 4.52 0.00 3.78 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 31 P 0.00 4.70 0.00 2.05 2.14 0.00 3.76 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.95 0.00 32 G 9.16 3.85 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 0.00 0.00 0.00 33 P 0.00 4.63 0.00 2.23 2.19 0.00 3.76 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 1.98 0.00 34 H 7.55 4.64 0.00 3.42 3.39 0.00 5.54 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 C 7.61 4.58 0.00 3.09 2.93 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 36 A 8.47 4.69 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 37 Q 7.55 4.72 0.00 1.88 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.30 6.97 0.00 0.00 0.00 0.00 0.00 2.24 2.30 0.00 38 T 8.47 4.39 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 39 E 8.35 4.47 0.00 1.80 2.05 0.00 0.00 0.00 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 2.40 0.00 40 V 8.27 4.34 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 0.97 0.00 0.00 0.93 0.00 0.00 41 I 9.58 4.82 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.45 0.91 0.00 0.00 42 A 8.52 5.07 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 43 T 8.83 4.71 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 1.26 0.00 0.00 44 L 9.71 4.61 0.00 1.77 1.58 0.92 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 45 K 9.24 4.18 0.00 1.77 1.80 0.00 1.85 0.00 0.00 1.63 0.00 0.00 2.92 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.45 1.51 7.81 46 N 7.80 4.59 0.00 2.69 2.80 0.00 0.00 7.34 7.98 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 47 G 7.87 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 0.00 0.00 0.00 48 Q 7.75 4.54 0.00 2.02 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.79 0.00 0.00 0.00 0.00 0.00 2.42 2.39 0.00 49 K 8.36 4.75 0.00 1.57 1.72 0.00 1.69 0.00 0.00 1.71 0.00 0.00 2.94 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.34 1.44 7.81 50 A 9.04 4.60 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 51 C 8.91 4.82 0.00 2.90 3.08 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 0.00 0.00 0.00 52 L 8.51 5.12 0.00 1.50 1.57 0.92 0.83 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 53 N 8.54 4.86 0.00 3.05 2.69 0.00 0.00 7.37 7.87 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 54 P 0.00 4.55 0.00 2.21 2.14 0.00 3.77 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.96 0.00 55 A 7.81 4.69 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 56 S 7.67 4.79 0.00 3.78 3.87 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 0.00 0.00 0.00 57 P 0.00 4.47 0.00 2.22 2.15 0.00 3.80 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 58 M 8.04 4.22 0.00 2.26 2.08 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.51 0.00 59 V 7.52 3.80 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.94 0.00 0.00 60 K 7.84 4.28 0.00 1.74 1.96 0.00 1.58 0.00 0.00 1.80 0.00 0.00 3.17 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.39 1.54 7.81 61 K 7.72 4.52 0.00 1.95 2.01 0.00 1.19 0.00 0.00 1.65 0.00 0.00 3.02 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.30 1.68 7.81 62 I 7.68 3.80 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 1.65 0.95 0.92 0.00 0.00 63 I 7.08 3.95 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.62 0.91 0.00 0.00 64 E 8.21 3.94 0.00 1.93 2.04 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 2.32 2.43 0.00 65 K 7.70 4.16 0.00 1.95 1.85 0.00 1.68 0.00 0.00 1.65 0.00 0.00 2.97 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.61 7.81 66 M 7.52 3.99 0.00 2.13 2.37 0.00 0.00 0.00 0.00 0.00 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.73 0.00 67 L 8.04 3.89 0.00 1.73 1.73 0.97 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 68 K 7.31 4.25 0.00 1.97 1.85 0.00 1.85 0.00 0.00 1.63 0.00 0.00 2.97 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.39 1.42 7.81 69 N 9.24 4.31 0.00 2.80 2.75 0.00 0.00 6.92 6.78 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 70 G 7.59 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 0.00 0.00 0.00 0.00 71 K 8.23 4.34 0.00 1.68 1.77 0.00 1.83 0.00 0.00 1.76 0.00 0.00 2.83 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.30 1.32 7.81 72 S 8.03 4.45 0.00 3.95 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 N 8.75 4.43 0.00 2.77 2.74 0.00 0.00 7.11 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00