NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 V 3.9227 7.9133 120.5974 62.7148 33.0849 173.9975 3 F 5.0140 8.6436 125.7372 54.8149 41.4906 173.2510 4 K 4.4955 9.0548 123.3893 54.4163 36.0776 174.6238 5 K 5.0217 8.4075 123.2829 54.6193 35.4836 175.7995 6 V 4.4992 8.7180 116.4032 59.5030 35.0821 174.6654 7 L 4.9949 8.5686 126.5982 53.8416 42.7798 175.2455 8 L 4.8948 8.8653 126.6504 53.1217 45.4880 175.9743 9 T 4.9190 8.5759 119.0537 61.9336 70.3285 174.3921 10 G 4.6995 9.2700 114.7156 45.0316 0.0000 172.0488 11 T 5.4436 8.8617 110.2398 60.2272 72.2506 173.1980 12 S 4.6265 8.8388 115.5364 57.5666 66.2337 174.5705 13 E 4.5857 8.9441 124.7104 56.6797 29.6943 176.2285 14 E 4.5183 8.4229 118.8072 57.4328 31.4698 176.6207 15 S 3.7871 7.2423 110.7487 56.1304 66.7014 175.5759 16 F 4.4641 7.9063 120.8021 60.9540 38.6485 178.1234 17 T 3.9162 7.9772 114.8253 66.6804 68.3871 176.4720 18 A 4.0636 8.3122 122.4762 54.9050 18.3224 179.5793 19 A 4.0318 8.1839 119.4814 55.1433 18.4644 179.6866 20 A 4.0032 8.1624 119.4823 55.5030 18.4591 179.6288 21 D 4.3544 8.3026 117.4364 57.3615 40.9568 178.3979 22 D 4.3314 8.2063 118.4604 57.3447 41.2206 178.3115 23 A 4.0164 7.9415 120.6834 55.2260 18.4080 179.5272 24 I 3.6689 7.8657 118.3437 64.5142 37.2074 178.1783 25 D 4.3647 8.5284 120.2152 57.5797 40.5010 179.1000 26 R 3.9923 7.9153 118.2328 59.2699 30.1102 178.2897 27 A 3.8424 8.0662 120.5933 55.3849 18.1965 179.5555 28 E 3.9713 8.2547 115.7077 59.2385 29.5373 178.9754 29 D 4.5184 7.8537 118.5214 56.2386 40.9522 176.9137 30 T 4.5339 7.3001 106.0122 60.7986 70.2619 173.8696 31 L 4.5915 7.7189 121.3647 53.0069 45.3416 175.7469 32 D 4.6942 8.1724 121.3237 54.0679 42.5189 175.6884 33 N 4.2233 8.5705 114.9352 54.3951 35.9445 174.9442 34 V 4.1956 7.8792 117.0567 63.1524 32.4213 175.2586 35 V 4.6141 8.3172 120.4201 62.1704 34.2979 175.3955 36 W 4.9049 7.3648 114.7212 55.8683 31.0660 173.1996 37 A 5.1756 8.8162 120.9260 50.3605 21.9095 175.1508 38 E 4.7629 9.2210 121.0340 54.3596 32.4409 175.7149 39 V 4.2173 8.5298 124.8817 63.1069 31.8333 175.8414 40 V 4.4344 8.5640 119.9129 61.4295 33.8323 174.9785 41 D 4.5835 7.6242 117.6363 53.6752 44.3612 174.0960 42 Q 4.9340 8.4144 120.7923 54.7603 33.2189 174.1528 43 G 4.2400 9.0082 108.1372 45.9701 0.0000 171.8696 44 V 4.9445 8.2006 118.8303 61.1129 34.5073 174.1555 45 E 4.1570 9.1999 129.7880 55.8182 30.1805 174.8294 46 I 4.2309 8.5770 125.2627 62.2805 40.2159 174.8897 47 G 3.9768 7.8041 108.8008 45.1740 0.0000 172.1361 48 A 3.9880 8.3832 127.7869 51.9755 16.3665 177.3234 49 V 4.5581 7.0280 107.0742 59.2950 35.0222 175.9509 50 E 4.1143 8.7980 120.9743 58.7603 29.6346 177.4710 51 E 4.7230 7.6502 115.7742 53.8099 32.3379 175.8761 52 R 4.0556 8.3928 120.6777 57.2507 31.0908 176.1720 53 T 4.3976 8.2941 118.6834 61.8052 71.7370 173.0337 54 Y 4.6358 8.4955 125.3851 57.7689 39.4766 174.8617 55 Q 5.2801 9.7240 121.7614 54.5663 33.2780 174.5495 56 T 4.9766 8.8740 118.7403 61.9211 72.6347 172.3326 57 E 4.9498 9.2346 128.3184 54.9904 31.4924 175.1549 58 V 5.0176 8.9154 119.6127 59.6645 36.4521 174.6204 59 Q 4.6684 9.0057 123.4749 55.2357 30.1702 174.8790 60 V 4.5692 8.8992 125.3632 61.1418 33.5419 174.2352 61 A 4.8755 8.4506 130.7378 50.3972 20.6507 175.7276 62 F 5.2992 8.3410 115.9683 54.9901 41.9150 173.2783 63 E 4.6129 9.2148 122.6886 55.8439 30.3125 176.3452 64 L 4.4408 8.5283 127.7483 53.5032 43.4991 175.1563 65 D 4.6600 8.3576 117.1322 54.2062 41.3162 175.7398 66 G 3.8911 7.5734 109.3370 45.2988 0.0000 173.7197 67 S 3.9659 8.7562 117.0255 58.8092 63.7871 174.5007 68 Q 4.3916 8.5587 124.2517 56.7853 28.4539 177.4113 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 2 V 7.91 3.92 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 0.85 0.00 0.00 3 F 8.64 5.01 0.00 3.03 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 K 9.05 4.50 0.00 1.37 0.74 0.00 1.53 0.00 0.00 1.79 0.00 0.00 2.97 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.07 1.22 7.81 5 K 8.41 5.02 0.00 1.57 1.78 0.00 1.74 0.00 0.00 1.70 0.00 0.00 2.89 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.08 1.21 7.81 6 V 8.72 4.50 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 0.89 0.00 0.00 1.05 0.00 0.00 7 L 8.57 4.99 0.00 1.76 1.61 0.98 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 8 L 8.87 4.89 0.00 1.60 1.51 0.93 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 9 T 8.58 4.92 4.26 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 1.25 0.00 0.00 10 G 9.27 4.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.86 5.44 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 1.23 0.00 0.00 12 S 8.84 4.63 0.00 3.99 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 13 E 8.94 4.59 0.00 2.02 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 0.00 2.24 2.32 0.00 14 E 8.42 4.52 0.00 1.91 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 2.26 2.35 0.00 15 S 7.24 3.79 0.00 3.79 3.71 0.00 0.00 0.00 0.00 0.00 0.00 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 F 7.91 4.46 0.00 3.14 3.07 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 0.00 0.00 0.00 17 T 7.98 3.92 4.26 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 1.23 0.00 0.00 18 A 8.31 4.06 1.32 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 0.00 0.00 0.00 0.00 0.00 0.00 19 A 8.18 4.03 1.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.16 4.00 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 21 D 8.30 4.35 0.00 2.94 2.75 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.21 4.33 0.00 2.94 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 A 7.94 4.02 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.87 3.67 2.01 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 1.54 0.82 0.92 0.00 0.00 25 D 8.53 4.36 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 26 R 7.92 3.99 0.00 1.94 2.06 0.00 3.12 0.00 0.00 3.16 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.66 0.00 27 A 8.07 3.84 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.25 3.97 0.00 2.04 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 2.33 2.50 0.00 29 D 7.85 4.52 0.00 2.83 2.70 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.30 4.53 4.15 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 31 L 7.72 4.59 0.00 1.36 0.96 0.10 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 32 D 8.17 4.69 0.00 2.69 2.60 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.57 4.22 0.00 3.16 2.98 0.00 0.00 6.51 7.68 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 34 V 7.88 4.20 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 0.80 0.00 0.00 0.88 0.00 0.00 35 V 8.32 4.61 2.41 0.00 0.00 0.00 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 1.00 0.00 0.00 36 W 7.36 4.90 0.00 3.28 3.21 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 37 A 8.82 5.18 1.23 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 0.00 0.00 0.00 38 E 9.22 4.76 0.00 1.98 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 2.41 2.63 0.00 39 V 8.53 4.22 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 0.76 0.00 0.00 0.95 0.00 0.00 40 V 8.56 4.43 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 0.78 0.00 0.00 1.03 0.00 0.00 41 D 7.62 4.58 0.00 2.80 2.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 Q 8.41 4.93 0.00 1.47 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.49 0.00 0.00 0.00 0.00 0.00 2.03 2.16 0.00 43 G 9.01 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 0.00 0.00 0.00 0.00 44 V 8.20 4.94 2.12 0.00 0.00 0.00 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 1.21 0.00 0.00 45 E 9.20 4.16 0.00 2.08 1.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.28 0.00 46 I 8.58 4.23 1.85 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 1.29 1.06 0.89 0.00 0.00 47 G 7.80 3.98 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 0.00 0.00 0.00 48 A 8.38 3.99 1.46 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 0.00 0.00 0.00 0.00 0.00 0.00 49 V 7.03 4.56 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.00 0.00 1.04 0.00 0.00 50 E 8.80 4.11 0.00 1.94 1.99 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 2.30 2.31 0.00 51 E 7.65 4.72 0.00 1.88 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 0.00 2.18 2.27 0.00 52 R 8.39 4.06 0.00 1.42 1.40 0.00 3.14 0.00 0.00 3.17 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.60 0.00 53 T 8.29 4.40 4.13 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 0.00 0.00 0.00 1.16 0.00 0.00 54 Y 8.50 4.64 0.00 2.87 2.55 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 9.72 5.28 0.00 2.01 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.76 0.00 0.00 0.00 0.00 0.00 2.30 2.49 0.00 56 T 8.87 4.98 4.42 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 1.25 0.00 0.00 57 E 9.23 4.95 0.00 2.05 1.81 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 2.25 2.41 0.00 58 V 8.92 5.02 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 0.70 0.00 0.00 0.95 0.00 0.00 59 Q 9.01 4.67 0.00 2.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.78 0.00 0.00 0.00 0.00 0.00 2.36 2.47 0.00 60 V 8.90 4.57 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 0.97 0.00 0.00 0.93 0.00 0.00 61 A 8.45 4.88 -0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.34 5.30 0.00 3.32 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 63 E 9.21 4.61 0.00 2.25 1.99 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 2.23 1.96 0.00 64 L 8.53 4.44 0.00 1.44 1.58 0.84 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 65 D 8.36 4.66 0.00 2.66 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 66 G 7.57 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 0.00 0.00 0.00 67 S 8.76 3.97 0.00 3.88 3.79 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 68 Q 8.56 4.39 0.00 2.09 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.65 0.00 0.00 0.00 0.00 0.00 2.41 2.41 0.00