NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 G 3.9645 8.3549 109.7354 45.0311 0.0000 173.6237 3 R 3.8513 8.6236 117.6072 58.3013 30.0871 176.6867 4 K 4.6961 7.6774 116.5854 52.1657 36.6894 178.4224 5 K 4.2594 8.5382 122.2173 56.1289 32.8754 176.2170 6 I 4.6220 7.9552 117.2154 59.0094 40.3498 174.9967 7 Q 4.3966 8.3192 120.1859 55.3329 29.7826 176.7865 8 I 4.1736 7.9063 122.3796 60.1307 35.8304 174.9159 9 T 4.5610 7.6053 116.9629 59.9032 70.4639 173.1871 10 R 3.8818 8.5318 125.1396 56.7221 30.3102 176.0830 11 I 3.9914 8.2724 126.3843 61.5118 37.5554 176.0248 12 M 4.1716 8.5975 125.1691 57.0761 32.5804 176.4690 13 D 4.6037 7.9149 119.0012 53.0087 42.5664 175.9711 14 E 3.9078 8.8134 127.6474 59.5633 29.7424 179.0112 15 R 3.8958 7.8847 117.3946 59.4251 30.1943 178.5000 16 N 4.3504 8.7591 117.0331 56.4693 38.8205 176.8792 17 R 3.8951 8.2922 120.6610 59.4055 30.1557 178.3615 18 Q 4.0011 8.3802 119.5884 59.0283 29.0665 178.2061 19 V 3.6065 7.9680 119.3352 66.4039 31.5885 178.1412 20 T 3.8781 8.2382 115.7735 66.4389 68.1839 176.3436 21 F 4.0134 8.5056 122.6932 61.6137 39.5919 177.2733 22 T 3.6461 8.1025 115.2144 66.4823 68.2862 176.8361 23 K 3.8986 7.9216 120.1658 59.7285 32.1129 179.8689 24 R 3.9456 8.2960 118.5610 58.7867 29.8578 179.1045 25 K 3.6329 7.9843 120.2635 59.0475 31.9578 178.6466 26 F 3.9014 7.9706 120.7004 61.1977 39.3540 177.3585 27 G 3.6109 8.2587 105.3680 47.7198 0.0000 175.4487 28 L 3.9086 8.1801 123.1099 58.1602 42.0219 179.0175 29 M 3.7670 7.9445 118.7518 57.7624 31.7019 178.7052 30 K 3.6697 7.7633 120.0520 59.4755 32.4046 179.1611 31 K 3.9006 8.0095 118.4706 59.1258 31.8300 179.3616 32 A 3.8854 7.8445 121.2560 55.1130 18.2877 178.8816 33 Y 4.2847 7.5508 119.6620 60.3836 38.7471 178.3665 34 E 3.5423 8.2180 119.4465 59.1174 29.5415 179.1154 35 L 3.8975 7.9684 120.6895 58.0307 42.1370 179.1006 36 S 4.3076 8.0835 115.6975 60.7909 62.5518 176.7985 37 V 3.4426 7.4014 121.6324 65.5295 31.1625 177.9564 38 L 3.9755 7.8471 117.5432 57.6040 41.5212 178.0407 39 C 4.4847 7.9485 112.5356 58.4736 28.9104 173.3688 40 D 4.3987 7.5430 117.0390 55.6149 39.0927 172.2159 41 C 4.9989 8.0155 113.6121 56.5116 34.1902 174.3291 42 E 4.7768 8.6903 119.6337 55.6300 30.2912 175.9280 43 I 4.8006 9.0156 124.8745 59.4060 41.6770 174.2050 44 A 5.1156 8.6175 126.5707 50.0028 22.0782 175.1198 45 L 4.7149 9.2114 123.3334 53.3733 45.4775 175.0946 46 I 4.8892 8.5163 126.4302 59.5305 40.1290 174.9720 47 I 4.6820 8.8265 127.3365 59.5095 40.9015 174.1965 48 F 5.3710 8.9618 125.5910 55.6564 41.1737 175.7199 49 N 4.6252 9.1553 122.2045 51.6052 38.6999 175.9845 50 S 4.0718 8.2441 111.9938 61.5129 63.0293 175.2356 51 S 4.2702 7.9518 114.1659 58.4921 62.7352 173.8224 52 N 4.5102 8.3042 118.1500 53.8665 37.8890 173.7682 53 K 4.2337 9.0481 118.1103 55.4837 33.0456 175.1162 54 L 4.5082 7.9779 126.6107 53.9224 43.2686 175.5804 55 F 5.0410 9.0425 124.3213 55.9230 43.1593 173.7908 56 Q 5.1245 8.5984 118.4385 55.4865 31.8426 172.9864 57 Y 4.9104 8.9955 120.3763 56.2568 41.8967 173.5571 58 A 4.6047 7.3661 126.1650 50.2046 22.5059 176.8469 59 S 4.1407 8.4771 115.8136 60.4366 63.7495 174.1240 60 T 4.3480 6.9848 112.5851 60.5025 70.8314 173.6046 61 D 4.4455 7.9572 122.0689 55.6865 41.1918 172.5099 62 M 4.1666 8.7690 126.7451 58.8672 32.3778 178.7967 63 D 4.4833 8.3028 122.9433 58.9328 39.7200 181.1916 64 K 4.1942 7.9169 123.5551 59.9658 31.8320 182.2259 65 V 3.7870 7.5400 119.5744 65.9066 31.3277 178.1652 66 L 4.1321 8.3215 121.1424 58.1271 41.3759 180.1465 67 L 4.0585 7.9734 122.4842 59.4691 40.8107 182.3958 68 K 4.2098 8.3473 120.0704 59.5175 32.0332 178.5115 69 Y 4.0828 8.2815 120.1036 60.9629 38.5129 178.0997 70 T 3.8461 8.4246 112.8122 65.6405 68.8067 176.4029 71 E 4.1034 8.1436 119.9907 60.9224 29.8892 179.6368 72 Y 4.3175 8.0581 120.0252 60.7334 38.8077 176.5134 73 N 4.6467 7.9144 120.3015 53.4946 38.8341 174.7763 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 G 8.35 3.96 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 0.00 0.00 0.00 3 R 8.62 3.85 0.00 1.89 2.01 0.00 3.32 0.00 0.00 3.24 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.62 0.00 4 K 7.68 4.70 0.00 1.70 1.49 0.00 1.81 0.00 0.00 1.63 0.00 0.00 2.86 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.25 0.97 7.81 5 K 8.54 4.26 0.00 1.71 1.73 0.00 1.68 0.00 0.00 1.76 0.00 0.00 2.85 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.42 1.42 7.81 6 I 7.96 4.62 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 1.41 0.86 0.91 0.00 0.00 7 Q 8.32 4.40 0.00 2.07 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 7.32 0.00 0.00 0.00 0.00 0.00 2.33 2.32 0.00 8 I 7.91 4.17 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 0.78 0.92 0.00 0.00 9 T 7.61 4.56 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 10 R 8.53 3.88 0.00 1.82 1.86 0.00 3.30 0.00 0.00 3.23 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.69 0.00 11 I 8.27 3.99 1.89 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.67 0.99 0.00 0.00 12 M 8.60 4.17 0.00 2.01 2.12 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 2.59 2.59 0.00 13 D 7.91 4.60 0.00 2.79 2.54 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.81 3.91 0.00 2.07 1.94 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 2.38 2.40 0.00 15 R 7.88 3.90 0.00 1.90 1.97 0.00 3.18 0.00 0.00 3.27 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.69 0.00 16 N 8.76 4.35 0.00 2.83 2.82 0.00 0.00 6.91 8.46 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 17 R 8.29 3.90 0.00 2.05 2.08 0.00 3.15 0.00 0.00 3.35 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.67 0.00 18 Q 8.38 4.00 0.00 2.27 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.58 0.00 0.00 0.00 0.00 0.00 2.39 2.46 0.00 19 V 7.97 3.61 2.10 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 0.97 0.00 0.00 0.98 0.00 0.00 20 T 8.24 3.88 4.47 0.00 0.00 0.00 0.00 0.00 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 21 F 8.51 4.01 0.00 3.23 3.26 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 22 T 8.10 3.65 4.36 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 0.00 0.00 0.00 1.19 0.00 0.00 23 K 7.92 3.90 0.00 1.77 1.81 0.00 1.64 0.00 0.00 1.61 0.00 0.00 2.89 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.38 1.58 7.81 24 R 8.30 3.95 0.00 1.86 1.89 0.00 3.11 0.00 0.00 3.07 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.60 0.00 25 K 7.98 3.63 0.00 0.79 1.14 0.00 1.25 0.00 0.00 0.73 0.00 0.00 2.13 0.00 0.00 2.15 0.00 0.00 0.00 0.00 1.11 1.10 7.81 26 F 7.97 3.90 0.00 3.23 3.17 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 27 G 8.26 3.61 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 L 8.18 3.91 0.00 1.72 1.72 0.87 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 29 M 7.94 3.77 0.00 1.74 1.74 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.44 0.00 30 K 7.76 3.67 0.00 1.43 1.78 0.00 1.66 0.00 0.00 1.72 0.00 0.00 2.98 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.41 1.41 7.81 31 K 8.01 3.90 0.00 1.77 1.78 0.00 1.68 0.00 0.00 1.61 0.00 0.00 2.93 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.42 1.53 7.81 32 A 7.84 3.89 1.14 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 0.00 0.00 33 Y 7.55 4.28 0.00 2.69 2.98 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 34 E 8.22 3.54 0.00 2.09 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 2.32 2.57 0.00 35 L 7.97 3.90 0.00 1.79 1.76 0.89 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 36 S 8.08 4.31 0.00 4.31 4.30 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.40 3.44 1.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 0.45 0.00 0.00 38 L 7.85 3.98 0.00 1.63 1.67 0.86 0.74 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 39 C 7.95 4.48 0.00 3.04 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 40 D 7.54 4.40 0.00 2.78 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 C 8.02 5.00 0.00 2.99 2.95 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 0.00 0.00 0.00 0.00 42 E 8.69 4.78 0.00 1.87 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 2.33 0.00 43 I 9.02 4.80 2.04 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 1.19 1.00 1.03 0.00 0.00 44 A 8.62 5.12 1.10 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 0.00 0.00 45 L 9.21 4.71 0.00 1.80 1.79 0.93 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 46 I 8.52 4.89 1.86 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.75 0.77 0.00 0.00 47 I 8.83 4.68 2.04 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.85 1.18 0.00 0.00 48 F 8.96 5.37 0.00 2.98 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 9.16 4.63 0.00 2.25 2.24 0.00 0.00 6.32 7.16 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 50 S 8.24 4.07 0.00 3.97 4.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.95 4.27 0.00 3.98 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 52 N 8.30 4.51 0.00 2.85 2.97 0.00 0.00 7.06 6.68 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 53 K 9.05 4.23 0.00 1.77 1.67 0.00 1.61 0.00 0.00 1.46 0.00 0.00 2.39 0.00 0.00 2.63 0.00 0.00 0.00 0.00 0.81 1.17 7.81 54 L 7.98 4.51 0.00 1.53 1.38 0.20 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 55 F 9.04 5.04 0.00 3.05 2.91 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 56 Q 8.60 5.12 0.00 1.96 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.68 0.00 0.00 0.00 0.00 0.00 2.20 2.34 0.00 57 Y 9.00 4.91 0.00 3.05 2.78 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 58 A 7.37 4.60 1.07 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 0.00 0.00 59 S 8.48 4.14 0.00 3.93 4.07 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 60 T 6.98 4.35 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 1.19 0.00 0.00 61 D 7.96 4.45 0.00 2.76 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 62 M 8.77 4.17 0.00 2.07 2.03 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.64 0.00 63 D 8.30 4.48 0.00 2.72 2.68 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 64 K 7.92 4.19 0.00 1.75 1.84 0.00 1.77 0.00 0.00 1.74 0.00 0.00 2.85 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.44 1.06 7.81 65 V 7.54 3.79 2.15 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 1.02 0.00 0.00 0.95 0.00 0.00 66 L 8.32 4.13 0.00 1.76 1.75 0.92 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 67 L 7.97 4.06 0.00 1.67 1.68 0.92 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 68 K 8.35 4.21 0.00 2.03 1.96 0.00 1.79 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.52 1.49 7.81 69 Y 8.28 4.08 0.00 3.03 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 70 T 8.42 3.85 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 1.34 0.00 0.00 71 E 8.14 4.10 0.00 2.10 1.91 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 2.26 2.19 0.00 72 Y 8.06 4.32 0.00 3.05 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 73 N 7.91 4.65 0.00 2.76 2.60 0.00 0.00 6.91 7.51 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