NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 66 N 4.7237 8.4249 119.2047 53.3824 39.9564 173.4444 67 L 4.6336 8.1314 124.1629 50.8584 46.0766 174.9700 68 S 4.1707 8.6630 116.1946 58.5831 65.0483 174.9730 69 A 3.9944 8.5752 129.9716 55.6194 18.1812 180.0357 70 C 4.2232 8.0414 112.0143 60.9389 29.7800 175.7967 71 E 4.0026 8.2013 121.7274 59.5585 29.2361 179.1199 72 V 3.6177 8.0616 118.0926 65.9287 31.2876 177.7607 73 A 3.9785 8.1109 120.4979 55.2907 18.2550 179.8801 74 V 3.6121 7.5846 116.4836 66.1987 31.6967 177.8814 75 L 4.1378 7.9876 118.8100 58.4833 41.4901 179.4337 76 D 4.5106 8.2665 117.9699 56.6435 40.6565 178.6192 77 L 3.9350 7.6119 120.2240 58.2579 41.6635 179.1691 78 Y 3.9899 8.1471 116.3513 60.9862 37.2174 178.1459 79 E 3.9930 8.3685 119.5530 59.6774 29.4206 179.0983 80 Q 4.2580 8.2744 117.3351 59.4842 28.9634 179.3133 81 S 4.4016 8.1261 112.3437 57.5843 63.7118 174.1022 82 N 4.2070 9.1981 118.5234 54.8672 36.2626 174.6160 83 I 4.5488 7.9268 116.7239 59.4179 40.1849 176.3482 84 R 4.1876 8.5594 124.5810 55.5486 30.7362 175.8792 85 I 4.0377 8.0570 124.0496 59.1247 37.7868 174.1292 86 P 4.2833 0.0000 0.0000 62.8386 31.8510 177.0155 87 S 4.4476 8.1610 113.4159 60.0150 63.4675 176.0301 88 D 4.3563 7.7868 122.7666 57.3040 40.4368 178.5606 89 I 3.8435 7.3784 119.1525 64.4090 37.2875 178.0634 90 I 3.6861 7.8181 120.2377 65.1082 36.8589 177.0309 91 E 3.8212 8.3724 119.0140 60.3700 29.0740 178.5771 92 D 4.5432 8.4251 119.5918 57.3846 41.1353 178.5733 93 L 3.9843 7.9940 120.3116 58.0844 42.1880 179.3085 94 V 3.7586 7.7306 112.0870 64.2565 31.7928 180.4421 95 N 4.8735 7.5286 115.5421 52.7838 37.1753 175.8943 96 Q 4.2564 9.0455 115.7366 54.9334 32.1667 176.0307 97 R 3.5698 7.9496 116.3526 56.6158 27.6528 176.3441 98 L 4.1116 7.5771 117.9965 55.1413 42.6679 177.9214 99 Q 4.1617 8.7820 119.7625 58.0478 29.3149 176.7953 100 S 4.7478 7.9240 113.1718 56.2159 66.4547 175.0735 101 E 3.9731 8.6037 121.3045 59.8076 29.3825 179.3023 102 Q 3.8970 8.0559 119.2499 59.4985 29.0968 179.1453 103 E 4.0365 7.8286 119.0378 59.1816 29.5028 179.0853 104 V 3.6254 7.4818 118.0316 66.1993 31.5959 177.5762 105 L 4.0876 8.1800 119.8087 58.6479 41.7721 178.8433 106 N 4.4350 8.2310 115.5872 56.0702 38.3579 176.8672 107 Y 4.0259 7.8236 120.8281 60.6039 39.0693 177.2379 108 I 3.6154 8.0987 120.9328 64.7057 37.2622 178.2222 109 E 4.0459 8.3935 119.0858 59.8257 29.4036 179.6394 110 T 3.9273 7.5791 115.6233 66.6044 68.4543 176.8465 111 Q 4.0391 7.8298 120.0903 58.6906 28.6126 178.7967 112 R 4.1169 8.2022 119.5123 59.5126 30.2199 179.0407 113 T 3.8812 8.0552 115.6489 66.6678 68.3940 175.9127 114 Y 3.8797 7.7981 120.9548 60.6408 38.8616 178.3376 115 W 4.1852 8.3504 119.6612 59.1130 28.9922 178.3394 116 K 3.9009 8.2920 119.5109 59.8544 31.6987 178.4216 117 L 4.0862 7.7121 118.4732 57.5301 41.3955 179.0824 118 E 3.7323 7.8997 119.3734 59.2556 29.3955 178.4292 119 N 4.5716 8.6048 114.9381 55.2867 38.7273 176.3989 120 Q 4.1670 7.5061 120.1453 56.5935 29.6958 176.0798 121 K 4.0604 7.0595 119.1426 56.3741 32.6731 175.9573 122 K 4.4379 8.2931 123.3638 54.3852 33.3871 175.8338 123 L 4.0637 8.3790 128.5597 54.9507 42.6879 175.4628 124 Y 4.3118 8.5164 127.0347 56.6205 38.5272 174.6041 125 R 4.2160 7.8526 127.3664 54.7518 30.9935 177.3237 126 G 3.6891 8.4780 112.1609 47.0809 0.0000 172.8298 127 S 4.6662 7.1341 112.6311 57.0652 66.1058 172.7180 128 L 4.2411 8.0745 119.9907 55.1053 43.1008 174.8081 *129 K 4.1330 8.4118 124.1831 54.4691 32.3453 177.8738 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 66 N 8.42 4.72 0.00 2.70 2.80 0.00 0.00 6.77 6.89 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 67 L 8.13 4.63 0.00 1.69 1.49 0.93 0.62 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 68 S 8.66 4.17 0.00 3.90 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 A 8.58 3.99 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 70 C 8.04 4.22 0.00 3.18 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 71 E 8.20 4.00 0.00 2.26 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 2.35 2.32 0.00 72 V 8.06 3.62 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 1.03 0.00 0.00 0.94 0.00 0.00 73 A 8.11 3.98 1.43 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 0.00 0.00 74 V 7.58 3.61 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 1.03 0.00 0.00 75 L 7.99 4.14 0.00 1.79 1.77 0.94 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 76 D 8.27 4.51 0.00 2.78 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 77 L 7.61 3.93 0.00 1.73 1.50 0.89 0.67 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 78 Y 8.15 3.99 0.00 3.18 3.03 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 79 E 8.37 3.99 0.00 2.28 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 2.38 2.55 0.00 80 Q 8.27 4.26 0.00 2.13 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 7.31 0.00 0.00 0.00 0.00 0.00 2.41 2.57 0.00 81 S 8.13 4.40 0.00 3.77 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 82 N 9.20 4.21 0.00 2.85 2.86 0.00 0.00 6.68 7.33 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 83 I 7.93 4.55 2.19 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.71 1.04 0.00 0.00 84 R 8.56 4.19 0.00 1.78 1.83 0.00 3.18 0.00 0.00 3.21 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.64 0.00 85 I 8.06 4.04 1.74 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.39 0.76 0.00 0.00 86 P 0.00 4.28 0.00 1.81 1.61 0.00 3.47 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.90 0.00 87 S 8.16 4.45 0.00 3.99 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 88 D 7.79 4.36 0.00 2.67 2.92 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 0.00 0.00 0.00 89 I 7.38 3.84 1.97 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.55 0.93 0.00 0.00 90 I 7.82 3.69 2.02 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.27 0.91 0.00 0.00 91 E 8.37 3.82 0.00 2.31 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 2.34 2.45 0.00 92 D 8.43 4.54 0.00 2.94 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 93 L 7.99 3.98 0.00 1.89 1.98 0.97 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 94 V 7.73 3.76 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 0.81 0.00 0.00 1.01 0.00 0.00 95 N 7.53 4.87 0.00 2.73 2.82 0.00 0.00 6.91 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 96 Q 9.05 4.26 0.00 1.58 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.33 6.64 0.00 0.00 0.00 0.00 0.00 2.20 1.69 0.00 97 R 7.95 3.57 0.00 1.83 2.04 0.00 3.35 0.00 0.00 3.20 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.56 0.00 98 L 7.58 4.11 0.00 1.60 1.58 0.85 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 99 Q 8.78 4.16 0.00 2.15 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.84 0.00 0.00 0.00 0.00 0.00 2.58 2.34 0.00 100 S 7.92 4.75 0.00 4.10 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 0.00 101 E 8.60 3.97 0.00 2.05 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.38 0.00 102 Q 8.06 3.90 0.00 2.17 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.93 0.00 0.00 0.00 0.00 0.00 2.45 2.59 0.00 103 E 7.83 4.04 0.00 2.12 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.33 0.00 104 V 7.48 3.63 2.29 0.00 0.00 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 1.04 0.00 0.00 105 L 8.18 4.09 0.00 1.92 1.89 0.92 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 106 N 8.23 4.44 0.00 3.11 2.92 0.00 0.00 6.69 6.87 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 0.00 107 Y 7.82 4.03 0.00 3.21 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 0.00 108 I 8.10 3.62 2.00 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.72 0.70 0.00 0.00 109 E 8.39 4.05 0.00 2.12 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 2.58 2.56 0.00 110 T 7.58 3.93 4.14 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 1.18 0.00 0.00 111 Q 7.83 4.04 0.00 2.21 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.82 0.00 0.00 0.00 0.00 0.00 1.91 2.43 0.00 112 R 8.20 4.12 0.00 1.92 2.04 0.00 3.15 0.00 0.00 3.08 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.87 0.00 113 T 8.06 3.88 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 1.22 0.00 0.00 114 Y 7.80 3.88 0.00 2.91 3.01 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 0.00 0.00 0.00 115 W 8.35 4.19 0.00 3.57 3.13 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 0.00 116 K 8.29 3.90 0.00 1.77 2.11 0.00 1.81 0.00 0.00 1.73 0.00 0.00 3.03 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.46 1.52 7.81 117 L 7.71 4.09 0.00 1.92 1.49 0.88 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 118 E 7.90 3.73 0.00 1.38 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 0.00 2.09 2.40 0.00 119 N 8.60 4.57 0.00 2.87 2.90 0.00 0.00 7.01 7.73 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 0.00 120 Q 7.51 4.17 0.00 2.24 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.08 6.86 0.00 0.00 0.00 0.00 0.00 2.34 2.39 0.00 121 K 7.06 4.06 0.00 1.89 1.72 0.00 1.69 0.00 0.00 1.60 0.00 0.00 2.87 0.00 0.00 2.67 0.00 0.00 0.00 0.00 1.43 1.46 7.81 122 K 8.29 4.44 0.00 1.71 1.73 0.00 1.83 0.00 0.00 1.68 0.00 0.00 2.93 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.36 1.36 7.81 123 L 8.38 4.06 0.00 1.64 1.56 0.96 0.92 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 0.00 124 Y 8.52 4.31 0.00 3.00 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 0.00 125 R 7.85 4.22 0.00 1.79 1.75 0.00 3.15 0.00 0.00 3.35 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.48 0.00 126 G 8.48 3.69 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 S 7.13 4.67 0.00 3.89 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 L 8.07 4.24 0.00 1.49 1.55 0.90 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 *129 K 8.41 4.13 0.00 1.56 1.61 0.00 1.66 0.00 0.00 1.74 0.00 0.00 2.94 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.26 1.50 7.81 * Residues marked with a * may have inaccurate shift predictions.