NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 80 A 4.1995 8.2649 123.5819 53.1136 19.6447 176.8465 81 V 3.0221 8.3001 111.6047 61.7371 28.4285 170.6459 82 K 4.3367 8.6769 124.7772 55.3484 34.5924 176.1891 83 I 4.6572 7.8816 125.5479 60.1191 39.6937 174.0143 84 L 4.5035 8.3710 117.3303 54.7616 46.2372 173.5520 85 E 3.8101 9.1328 124.4589 55.7318 28.9506 174.4450 86 I 3.6250 7.6312 127.6646 64.1720 37.0640 177.9265 87 E 3.9436 8.5325 120.3750 59.3955 29.5022 178.3683 88 D 4.4204 8.0553 117.7894 56.9335 41.5351 177.9525 89 L 4.1005 8.5428 120.9071 58.3638 40.5784 179.2321 90 F 4.2851 9.0370 122.7338 61.5327 39.4897 177.4993 91 S 4.0423 8.0945 114.4807 61.3544 62.5106 176.9934 92 S 4.0423 7.9344 118.0529 61.7087 62.5730 176.5653 93 L 4.0548 7.7475 121.3063 57.8369 41.3809 179.7843 94 K 3.6737 7.7563 118.1557 59.5111 31.9049 178.9332 95 H 4.1187 8.0524 118.3546 59.4248 29.8886 177.2645 96 I 3.7400 8.3442 121.9868 64.4170 36.9263 178.1930 97 Q 3.8975 8.7009 120.8635 59.4474 28.8314 177.2356 98 H 4.6249 7.8003 114.9453 57.4670 30.0659 175.8815 99 T 4.2336 7.5416 115.9742 65.5660 69.4113 176.4018 100 L 4.1623 8.4818 120.9956 56.9868 42.0282 179.4278 101 V 3.9135 7.1717 108.1909 61.5748 29.7678 173.6355 102 D 4.6767 7.5675 114.5729 53.9972 40.6010 176.4097 103 S 3.9636 7.6918 115.2394 59.8299 62.3117 173.2308 104 Q 4.6545 7.5953 119.5942 58.5821 28.6523 179.2471 105 S 4.1437 7.9705 115.8842 61.6645 62.9841 176.4832 106 Q 3.9956 7.9371 120.2502 58.8545 28.5553 178.5720 107 E 3.9831 8.1688 119.8270 59.3618 29.6243 179.0968 108 D 4.3458 8.0710 118.9118 57.2898 40.8436 178.8055 109 I 3.6849 8.3749 120.6329 64.6846 37.1190 178.6431 110 S 4.0951 8.5596 116.1683 61.3373 62.4666 176.5804 111 L 3.9061 7.7471 122.9858 58.2291 41.8946 179.0712 112 L 3.8864 7.7077 118.2962 57.6457 41.5574 179.3559 113 L 4.1010 8.1825 119.2151 58.1492 41.6344 179.6793 114 Q 3.9888 8.6981 118.0273 59.0379 28.4359 178.9174 115 L 3.9638 7.6998 120.3593 56.9187 41.5734 179.6663 116 V 3.4707 7.5732 117.8321 65.9388 31.7176 178.0591 117 Q 3.9975 8.1744 115.8674 57.3989 28.4460 175.8038 118 N 4.2412 7.7006 119.4949 53.4991 39.1778 175.2322 119 K 3.9014 9.1246 124.3671 60.2809 32.3095 178.5305 120 D 4.2942 8.0539 119.8713 56.0328 39.5305 177.9928 121 F 4.0389 8.5592 123.1806 60.7519 39.4324 176.6230 122 Q 4.1077 9.2690 120.3475 59.4885 28.8064 178.2832 123 N 4.3277 8.2277 117.0619 56.0956 38.6687 177.1303 124 A 3.8876 7.8407 122.1174 55.2912 18.4269 179.4247 125 F 3.7452 7.9581 118.9623 61.3503 39.3413 177.4605 126 K 4.1586 8.1292 118.0938 59.3390 31.7768 179.4484 127 I 3.6595 7.6062 120.1245 64.5464 37.0389 177.9428 128 H 3.9891 7.9150 118.6978 59.2290 29.7191 176.4389 129 N 4.0543 8.1984 118.9029 56.6954 38.7840 176.4095 130 A 3.9430 8.0967 121.6737 55.3750 18.4971 179.5984 131 I 3.6239 7.7629 118.1825 64.7107 37.2230 178.6136 132 T 3.7035 8.2618 114.1583 65.0523 67.2309 176.2005 133 V 3.5322 8.1152 120.5236 66.4806 31.4967 177.5352 134 H 4.1624 8.8045 118.0906 59.1648 29.3673 176.8156 135 M 3.9714 7.9749 119.8819 58.7646 32.1458 177.6913 136 N 4.4549 7.8216 115.1405 56.0476 38.7575 176.9737 137 K 4.0156 7.7197 119.6639 58.3841 32.5343 176.7719 138 A 3.8690 7.6110 121.8885 52.8267 18.7702 177.3622 139 S 4.0432 8.6949 116.8613 58.8467 63.4016 171.4189 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 80 A 8.26 4.20 1.27 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 0.00 0.00 0.00 81 V 8.30 3.02 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 0.52 0.00 0.00 0.90 0.00 0.00 82 K 8.68 4.34 0.00 1.70 1.70 0.00 1.66 0.00 0.00 1.73 0.00 0.00 3.15 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.41 1.54 7.81 83 I 7.88 4.66 1.96 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 1.32 1.03 0.94 0.00 0.00 84 L 8.37 4.50 0.00 1.71 2.07 1.01 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 85 E 9.13 3.81 0.00 2.26 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 0.00 2.38 2.31 0.00 86 I 7.63 3.63 1.52 0.00 0.00 0.37 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 -0.12 0.72 0.00 0.00 87 E 8.53 3.94 0.00 2.39 1.97 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 2.35 2.33 0.00 88 D 8.06 4.42 0.00 2.86 2.67 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.54 4.10 0.00 1.94 2.12 0.97 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 90 F 9.04 4.29 0.00 3.18 3.19 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 0.00 0.00 0.00 0.00 91 S 8.09 4.04 0.00 3.95 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 92 S 7.93 4.04 0.00 4.04 3.90 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 93 L 7.75 4.05 0.00 1.60 1.68 0.99 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 94 K 7.76 3.67 0.00 1.77 1.74 0.00 1.00 0.00 0.00 0.74 0.00 0.00 2.13 0.00 0.00 2.27 0.00 0.00 0.00 0.00 1.21 1.25 7.81 95 H 8.05 4.12 0.00 3.27 3.42 0.00 5.79 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 I 8.34 3.74 2.01 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 1.45 0.75 0.92 0.00 0.00 97 Q 8.70 3.90 0.00 2.24 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.88 0.00 0.00 0.00 0.00 0.00 2.33 2.46 0.00 98 H 7.80 4.62 0.00 3.24 3.22 0.00 5.81 0.00 0.00 0.00 0.00 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 T 7.54 4.23 4.17 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 1.17 0.00 0.00 100 L 8.48 4.16 0.00 1.67 1.68 0.92 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 101 V 7.17 3.91 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 0.58 0.00 0.00 0.90 0.00 0.00 102 D 7.57 4.68 0.00 2.68 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 S 7.69 3.96 0.00 4.01 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 Q 7.60 4.65 0.00 2.10 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.69 0.00 0.00 0.00 0.00 0.00 2.45 2.26 0.00 105 S 7.97 4.14 0.00 3.86 3.90 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 0.00 106 Q 7.94 4.00 0.00 2.15 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.92 0.00 0.00 0.00 0.00 0.00 2.44 2.58 0.00 107 E 8.17 3.98 0.00 2.23 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 2.32 2.34 0.00 108 D 8.07 4.35 0.00 2.85 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 0.00 109 I 8.37 3.68 2.04 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 1.51 0.72 0.95 0.00 0.00 110 S 8.56 4.10 0.00 4.01 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 0.00 111 L 7.75 3.91 0.00 1.99 1.76 0.91 0.63 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 0.00 112 L 7.71 3.89 0.00 1.75 1.69 0.93 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 113 L 8.18 4.10 0.00 1.80 1.83 0.90 0.68 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 0.00 114 Q 8.70 3.99 0.00 2.16 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.78 0.00 0.00 0.00 0.00 0.00 2.38 2.62 0.00 115 L 7.70 3.96 0.00 1.54 0.88 0.88 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 116 V 7.57 3.47 2.27 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 0.66 0.00 0.00 0.90 0.00 0.00 117 Q 8.17 4.00 0.00 2.10 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.63 0.00 0.00 0.00 0.00 0.00 2.49 2.53 0.00 118 N 7.70 4.24 0.00 3.08 3.08 0.00 0.00 6.55 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 K 9.12 3.90 0.00 1.94 2.10 0.00 1.53 0.00 0.00 1.89 0.00 0.00 3.03 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.52 1.48 7.81 120 D 8.05 4.29 0.00 3.01 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 0.00 121 F 8.56 4.04 0.00 3.13 3.23 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 0.00 122 Q 9.27 4.11 0.00 2.37 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.38 0.00 0.00 0.00 0.00 0.00 2.33 2.51 0.00 123 N 8.23 4.33 0.00 2.98 2.85 0.00 0.00 6.92 7.96 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 0.00 124 A 7.84 3.89 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 0.00 125 F 7.96 3.75 0.00 2.69 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 0.00 126 K 8.13 4.16 0.00 2.07 1.88 0.00 1.78 0.00 0.00 1.74 0.00 0.00 3.16 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.79 1.66 7.81 127 I 7.61 3.66 1.96 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 1.39 0.87 0.88 0.00 0.00 128 H 7.91 3.99 0.00 3.05 3.10 0.00 5.60 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 N 8.20 4.05 0.00 2.74 2.88 0.00 0.00 7.56 7.90 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 0.00 130 A 8.10 3.94 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 0.00 131 I 7.76 3.62 1.89 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 1.37 0.79 0.88 0.00 0.00 132 T 8.26 3.70 4.16 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 1.17 0.00 0.00 133 V 8.12 3.53 2.25 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 0.94 0.00 0.00 0.99 0.00 0.00 134 H 8.80 4.16 0.00 3.30 3.37 0.00 5.65 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 M 7.97 3.97 0.00 2.01 2.27 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.57 0.00 136 N 7.82 4.45 0.00 2.91 2.85 0.00 0.00 7.02 7.81 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 0.00 137 K 7.72 4.02 0.00 1.87 1.71 0.00 1.80 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.42 1.44 7.81 138 A 7.61 3.87 1.21 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 0.00 139 S 8.69 4.04 0.00 3.98 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00