NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 64 E 4.3302 8.4293 116.7535 56.0288 31.3953 174.2977 65 T 4.6272 7.9964 109.6580 59.6229 71.9207 172.9376 66 C 4.4596 8.8282 118.1471 58.6897 41.5543 175.7488 67 E 4.2321 7.6704 118.3456 57.7125 29.6081 182.9242 68 N 4.3443 8.8327 118.3306 51.8821 35.5303 172.1986 69 V 3.8524 7.5105 118.0423 63.2333 32.1602 174.8698 70 D 4.8015 8.5451 126.3892 52.9311 41.8973 176.2183 71 C 4.4060 8.8256 124.0361 57.1003 39.5153 174.6386 72 G 3.7226 8.0942 107.4893 43.3804 0.0000 170.6378 73 P 4.2935 0.0000 0.0000 63.8108 31.8746 176.5934 74 G 3.9401 9.0197 108.4146 45.8320 0.0000 172.5792 75 K 5.1798 7.7071 118.3672 55.1663 36.3809 176.2431 76 K 4.7545 8.8031 124.0192 53.7700 36.7632 175.2860 77 C 5.1689 8.8313 122.4184 57.3535 43.3366 173.6940 78 R 4.9046 9.0296 125.5552 55.3134 33.8462 171.4595 79 M 4.7852 8.6830 122.2092 54.6870 33.1806 176.3301 80 N 4.7365 9.0253 124.5846 52.0362 39.7997 176.1195 81 K 4.2654 8.5020 117.9597 55.9773 31.8330 173.2252 82 K 4.4607 8.2702 116.6589 56.7314 32.2208 175.9325 83 N 4.3084 8.0513 115.0028 54.5068 36.3436 174.0030 84 K 4.8338 8.0283 116.0780 53.7258 35.6684 173.9231 85 P 4.8734 0.0000 0.0000 62.8820 32.2411 175.7360 86 R 4.7621 9.1166 121.9300 54.5315 34.5088 173.5328 87 C 5.1148 8.7510 119.4339 56.1940 42.5588 173.5286 88 V 4.6312 8.8231 117.0001 59.1179 35.3376 174.4561 89 C 4.4540 8.9014 121.1439 57.6715 40.4029 174.8709 90 A 4.7822 8.6658 126.7154 49.9893 18.9519 173.7871 91 P 4.1372 0.0000 0.0000 61.9694 32.6002 177.1392 92 D 4.5314 8.5281 120.8377 53.7096 40.7976 177.4689 93 C 4.4325 8.7216 126.0064 59.6966 40.4768 176.2051 94 S 4.0495 8.1293 113.1431 60.1792 62.6920 174.7963 95 N 4.5579 7.9624 117.8134 54.3774 38.7904 175.0366 96 I 4.2735 7.4865 120.4104 60.3954 38.1107 175.9570 97 T 4.1594 8.5685 115.6730 63.5317 69.4864 175.1844 98 W 4.5496 8.1638 131.7731 56.7969 31.1905 175.5643 99 K 4.1309 7.7919 123.6152 56.1015 32.7205 176.2316 100 G 3.7083 5.3800 107.1979 43.8469 0.0000 171.4202 101 P 5.1161 0.0000 0.0000 62.6274 32.7785 175.7737 102 V 5.0364 8.8004 112.9162 58.7510 36.6786 173.6696 103 C 4.8738 8.8933 123.3316 54.9197 41.5644 173.6999 104 G 4.2636 9.0908 114.4707 45.4052 0.0000 174.0474 105 L 4.5053 8.7131 122.6413 56.8030 42.1117 177.3765 106 D 4.5369 8.1058 116.1813 53.7654 39.8012 177.1830 107 G 3.9268 8.5952 108.5170 45.6750 0.0000 173.3299 108 K 4.5924 8.0700 119.3085 54.6254 34.6035 175.9341 109 T 4.5787 8.3127 120.6328 63.7076 69.5231 173.4877 110 Y 4.5721 9.0433 123.9139 55.7608 40.1628 177.3120 111 R 3.9559 8.8307 120.1432 59.1031 29.7403 175.7458 112 N 5.2999 7.6492 115.7045 50.9716 41.3658 174.7240 113 E 3.9767 8.7764 120.5922 59.3755 29.6101 179.0232 114 C 4.2258 8.3307 118.1560 59.5729 43.8372 175.2710 115 A 3.9018 8.7692 122.8508 54.8331 17.8577 179.3963 116 L 3.0119 7.5344 118.9676 58.1500 42.1675 179.3204 117 L 3.9331 8.0168 118.9917 57.4208 41.4282 179.4966 118 K 3.9222 8.3177 119.7868 59.4034 32.1049 178.7607 119 A 3.9984 8.0346 121.1177 55.0189 18.1221 179.4736 120 R 3.9693 8.2133 117.6367 59.8457 29.9252 177.9886 121 C 4.2164 7.9529 116.8660 59.4766 43.7002 175.3380 122 K 4.2216 8.1797 121.5128 59.3406 31.9893 178.5301 123 E 4.6442 8.6007 111.3904 55.5918 32.5602 177.3636 124 Q 4.5548 7.5749 116.1066 53.0366 29.3816 173.8936 125 P 4.2902 0.0000 0.0000 64.9930 31.6382 177.8183 126 E 4.3448 7.9412 116.1951 55.9424 29.9080 175.8537 127 L 4.0869 7.8781 122.7315 55.0955 42.6955 175.6241 128 E 4.7574 8.2114 123.3774 54.3415 34.7699 174.4095 129 V 4.0836 8.2929 121.7308 63.2689 31.3513 175.6077 130 Q 4.5336 8.9141 127.1060 57.9317 29.9266 175.3169 131 Y 4.7838 7.0494 115.1183 56.1279 40.8097 174.3540 132 Q 4.1639 8.6033 120.0669 56.5139 29.9439 176.9755 133 G 4.0577 8.9518 107.6545 44.4961 0.0000 173.1479 134 K 4.3912 8.2897 117.2146 56.0811 32.6843 178.0919 135 C 4.6373 8.6432 119.9828 56.7772 40.8223 174.3493 136 K 4.2426 8.7779 121.1302 56.9290 31.5624 177.1473 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 64 E 8.43 4.33 0.00 2.01 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 2.13 1.88 0.00 65 T 8.00 4.63 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 66 C 8.83 4.46 0.00 3.01 3.15 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 0.00 67 E 7.67 4.23 0.00 2.03 1.75 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 2.26 2.13 0.00 68 N 8.83 4.34 0.00 2.90 2.83 0.00 0.00 6.74 7.67 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 69 V 7.51 3.85 2.20 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 0.88 0.00 0.00 0.93 0.00 0.00 70 D 8.55 4.80 0.00 2.62 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 71 C 8.83 4.41 0.00 3.13 3.11 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 0.00 0.00 0.00 0.00 72 G 8.09 3.72 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 0.00 0.00 0.00 0.00 0.00 0.00 73 P 0.00 4.29 0.00 2.18 2.06 0.00 3.86 0.00 0.00 3.66 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 74 G 9.02 3.94 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 0.00 0.00 0.00 75 K 7.71 5.18 0.00 1.80 1.72 0.00 1.65 0.00 0.00 1.74 0.00 0.00 2.85 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.36 1.52 7.81 76 K 8.80 4.75 0.00 1.39 1.59 0.00 1.80 0.00 0.00 1.57 0.00 0.00 2.74 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.26 1.24 7.81 77 C 8.83 5.17 0.00 2.97 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 78 R 9.03 4.90 0.00 1.45 1.69 0.00 3.31 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 1.45 1.46 0.00 79 M 8.68 4.79 0.00 1.89 2.03 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.48 0.00 80 N 9.03 4.74 0.00 2.92 2.98 0.00 0.00 6.75 6.97 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 81 K 8.50 4.27 0.00 1.80 1.75 0.00 1.78 0.00 0.00 1.70 0.00 0.00 2.95 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.36 1.03 7.81 82 K 8.27 4.46 0.00 2.11 1.84 0.00 1.90 0.00 0.00 1.70 0.00 0.00 2.91 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.39 1.25 7.81 83 N 8.05 4.31 0.00 2.90 2.94 0.00 0.00 6.71 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 K 8.03 4.83 0.00 1.89 1.66 0.00 1.78 0.00 0.00 1.87 0.00 0.00 2.85 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.41 0.96 7.81 85 P 0.00 4.87 0.00 2.05 2.05 0.00 3.44 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 1.98 2.27 0.00 86 R 9.12 4.76 0.00 1.67 1.80 0.00 3.27 0.00 0.00 3.17 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.72 0.00 87 C 8.75 5.11 0.00 2.85 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 88 V 8.82 4.63 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 0.81 0.00 0.00 0.98 0.00 0.00 89 C 8.90 4.45 0.00 2.85 3.06 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 0.00 0.00 0.00 90 A 8.67 4.78 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.14 0.00 2.18 2.06 0.00 3.76 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 2.03 0.00 92 D 8.53 4.53 0.00 2.70 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 93 C 8.72 4.43 0.00 3.02 3.11 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 0.00 0.00 0.00 0.00 94 S 8.13 4.05 0.00 3.99 3.99 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 95 N 7.96 4.56 0.00 2.87 2.91 0.00 0.00 6.95 7.60 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 96 I 7.49 4.27 2.02 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 1.38 0.51 1.05 0.00 0.00 97 T 8.57 4.16 4.32 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 1.25 0.00 0.00 98 W 8.16 4.55 0.00 3.29 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 K 7.79 4.13 0.00 1.45 1.61 0.00 1.73 0.00 0.00 1.64 0.00 0.00 3.14 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.35 1.24 7.81 100 G 5.38 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 0.00 0.00 0.00 101 P 0.00 5.12 0.00 2.24 2.26 0.00 3.90 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 2.22 1.90 0.00 102 V 8.80 5.04 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 1.09 0.00 0.00 1.04 0.00 0.00 103 C 8.89 4.87 0.00 2.40 1.70 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 0.00 104 G 9.09 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 0.00 0.00 0.00 0.00 105 L 8.71 4.51 0.00 1.74 1.69 0.98 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 106 D 8.11 4.54 0.00 2.87 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 0.00 107 G 8.60 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 0.00 0.00 0.00 108 K 8.07 4.59 0.00 1.69 1.43 0.00 1.68 0.00 0.00 1.65 0.00 0.00 2.86 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.47 1.47 7.81 109 T 8.31 4.58 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 1.28 0.00 0.00 110 Y 9.04 4.57 0.00 2.95 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 0.00 111 R 8.83 3.96 0.00 2.00 2.21 0.00 2.99 0.00 0.00 3.40 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.67 0.00 112 N 7.65 5.30 0.00 2.95 2.90 0.00 0.00 6.37 7.66 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 0.00 113 E 8.78 3.98 0.00 2.25 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 2.41 2.39 0.00 114 C 8.33 4.23 0.00 3.03 3.18 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.77 3.90 1.51 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 0.00 0.00 0.00 0.00 0.00 0.00 116 L 7.53 3.01 0.00 1.26 1.65 0.66 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 117 L 8.02 3.93 0.00 1.83 1.67 0.91 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 118 K 8.32 3.92 0.00 1.82 1.81 0.00 1.64 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.45 1.46 7.81 119 A 8.03 4.00 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 0.00 120 R 8.21 3.97 0.00 1.77 2.06 0.00 3.06 0.00 0.00 3.06 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.72 0.00 121 C 7.95 4.22 0.00 3.06 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 0.00 122 K 8.18 4.22 0.00 1.78 1.85 0.00 1.70 0.00 0.00 1.74 0.00 0.00 3.05 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.47 1.66 7.81 123 E 8.60 4.64 0.00 1.90 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 2.14 2.11 0.00 124 Q 7.57 4.55 0.00 2.15 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.06 6.77 0.00 0.00 0.00 0.00 0.00 2.28 2.28 0.00 125 P 0.00 4.29 0.00 2.16 2.18 0.00 3.75 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 1.98 1.99 0.00 126 E 7.94 4.34 0.00 1.97 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 2.26 2.22 0.00 127 L 7.88 4.09 0.00 1.60 1.56 0.94 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 128 E 8.21 4.76 0.00 1.96 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 2.29 1.86 0.00 129 V 8.29 4.08 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 0.77 0.00 0.00 0.90 0.00 0.00 130 Q 8.91 4.53 0.00 2.12 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.44 0.00 0.00 0.00 0.00 0.00 2.30 2.10 0.00 131 Y 7.05 4.78 0.00 2.96 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 0.00 132 Q 8.60 4.16 0.00 1.48 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.58 0.00 0.00 0.00 0.00 0.00 1.52 1.91 0.00 133 G 8.95 4.06 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 0.00 0.00 0.00 0.00 0.00 0.00 134 K 8.29 4.39 0.00 1.84 1.81 0.00 1.79 0.00 0.00 1.74 0.00 0.00 2.85 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.49 1.53 7.81 135 C 8.64 4.64 0.00 2.95 3.06 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 0.00 0.00 0.00 136 K 8.78 4.24 0.00 1.87 1.77 0.00 1.77 0.00 0.00 1.82 0.00 0.00 2.99 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.55 1.53 7.81