NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 74 V 4.0109 8.0544 120.3919 62.9463 32.6963 174.6217 75 T 4.1374 8.2387 121.3899 59.7623 68.6693 172.8309 76 D 4.3640 9.4594 126.5667 55.3665 43.2607 177.4104 77 Q 4.0530 8.7059 125.5555 58.7808 28.8505 178.4960 78 L 4.0145 7.9411 121.0936 58.1321 42.2990 178.5365 79 E 4.0222 8.6129 118.6274 59.3613 29.3701 178.8802 80 D 4.3212 8.1476 117.9353 57.4881 41.4472 178.2811 81 L 4.1376 8.0472 119.4134 57.9952 41.7449 179.8391 82 R 4.0514 8.5898 118.4653 59.1826 29.7657 178.7351 83 E 3.9854 8.2225 118.3189 59.3851 30.0555 177.9077 84 H 4.1683 8.2609 118.3064 59.5171 29.9074 177.1884 85 F 4.2917 8.2350 118.4882 59.6539 38.5727 177.5585 86 K 4.3497 8.0092 116.9131 58.2856 32.0348 177.8311 87 N 4.7438 7.6328 114.8700 52.7093 39.3327 175.0914 88 T 4.2824 7.2811 111.5783 60.6040 70.5337 175.4731 89 E 3.8865 8.8053 120.6360 59.6457 29.3962 179.2581 90 E 3.8503 8.1463 118.8232 59.0956 29.6754 178.8087 91 G 3.9106 7.8940 107.0247 47.2629 0.0000 175.8248 92 K 4.0119 8.5907 121.2087 59.1122 32.0809 179.3680 93 A 4.0068 8.1887 121.1967 55.0245 18.3896 179.7476 94 L 4.0430 8.0093 117.5360 58.1827 41.6610 180.2239 95 V 3.8542 8.0922 112.3793 64.4451 31.3299 178.2389 96 H 4.1870 8.3606 118.3458 59.6004 29.7016 177.0565 97 H 4.1527 8.3849 118.0830 58.9552 28.4099 177.2574 98 Y 4.0692 8.1159 121.0661 60.6481 38.7038 177.3717 99 E 3.7758 8.6005 120.6209 59.1866 29.6968 178.4324 100 E 3.8151 8.2711 119.5408 59.3289 29.6784 178.0060 101 C 4.1676 7.8924 117.9197 59.4806 44.7358 175.2910 102 A 3.7097 7.7249 122.5960 55.1252 18.0216 179.5125 103 E 3.8242 8.0087 116.9766 59.6024 29.0861 179.5358 104 R 3.8656 7.9224 118.6915 59.4257 30.1449 178.6889 105 V 3.6580 7.9243 118.1439 65.5322 31.3103 177.9637 106 K 3.8649 7.8894 118.7553 59.4383 31.7557 178.6055 107 I 3.8240 7.6025 119.8058 64.2843 36.4462 178.4084 108 Q 4.0256 7.6007 117.9280 58.9872 28.2899 178.7638 109 Q 2.5200 7.3466 117.9213 58.2117 28.6488 178.3409 110 Q 4.0494 7.3358 117.3341 57.4551 29.1891 176.9401 111 Q 4.1568 6.9483 117.6551 54.9296 29.3750 174.5377 112 P 4.3067 0.0000 0.0000 64.0432 32.0793 176.5393 113 G 3.9097 8.9822 108.7163 46.3277 0.0000 174.6552 114 Y 4.0664 8.0909 122.9181 60.2139 38.9939 178.1794 115 A 3.8428 8.0829 121.3783 54.6000 18.6066 177.4759 116 D 4.7672 7.4468 113.7248 54.1434 40.9707 177.4480 117 L 3.8768 7.5049 124.0914 55.8483 41.7287 175.6195 118 E 3.8130 7.5573 120.5407 57.2169 29.3006 174.5670 119 H 4.5711 7.4468 118.5167 54.6151 27.4606 173.9696 120 K 4.2722 7.6517 119.4984 55.0352 32.9733 177.0442 121 E 4.1407 8.7683 125.5593 56.0508 30.2449 175.0386 122 D 5.0476 8.3186 122.9323 52.1117 42.9241 175.5344 123 C 5.6179 8.2757 113.4272 56.0759 36.4637 177.0939 124 V 3.6210 7.9560 121.5761 66.1443 31.0862 176.7476 125 E 3.7446 8.0471 118.5335 59.4532 29.5754 178.5623 126 E 4.0956 8.2017 118.0718 59.3063 29.5903 178.9146 127 F 4.2509 8.6200 120.8627 61.3477 39.4659 177.2625 128 F 4.0962 9.1761 117.8710 60.7998 38.5543 177.3146 129 H 4.3621 8.4565 115.9328 58.7470 28.5292 177.5620 130 L 3.9734 7.9096 121.8267 58.3556 42.0143 178.7043 131 Q 3.7540 8.0226 119.8444 59.3617 28.7472 177.8520 132 H 4.0317 8.6191 119.6243 59.2514 29.9167 176.5914 133 Y 3.9877 7.8260 121.0940 60.6643 38.6342 178.0220 134 L 3.5659 7.8687 119.7217 57.7892 41.6839 179.2703 135 D 4.1459 8.2146 119.0459 57.7492 40.5431 178.9562 136 T 3.6466 7.5637 114.7418 66.2332 68.3814 175.8879 137 A 3.7710 6.8255 121.2544 54.3928 19.1406 179.2179 138 T 3.8976 8.0289 108.2739 64.2140 68.6245 176.7566 139 A 3.8665 8.0748 124.3455 54.6184 18.2368 177.7371 140 P 3.9621 0.0000 0.0000 64.8057 31.3391 177.4847 141 R 4.4071 7.3593 117.2293 57.0955 31.1065 177.7172 142 L 4.0494 8.0477 120.7426 58.6280 42.1327 179.2090 143 F 4.2083 8.5398 116.6294 60.4631 38.6055 177.0574 144 D 4.5429 7.8296 116.3646 56.1947 40.6977 177.5972 145 K 4.3944 8.1270 117.4097 55.4649 32.7806 175.9863 146 L 4.5926 6.9325 119.0274 52.5922 44.1701 176.4205 147 K 4.0739 8.2444 119.7063 56.7532 32.1536 176.3149 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 74 V 8.05 4.01 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 0.95 0.00 0.00 0.92 0.00 0.00 75 T 8.24 4.14 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 1.22 0.00 0.00 76 D 9.46 4.36 0.00 2.83 2.57 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 0.00 0.00 0.00 0.00 77 Q 8.71 4.05 0.00 2.19 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.70 0.00 0.00 0.00 0.00 0.00 2.57 2.47 0.00 78 L 7.94 4.01 0.00 1.79 1.85 0.93 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 79 E 8.61 4.02 0.00 2.18 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 2.45 2.49 0.00 80 D 8.15 4.32 0.00 2.87 2.89 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 81 L 8.05 4.14 0.00 2.04 1.85 0.98 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 82 R 8.59 4.05 0.00 2.07 2.03 0.00 3.15 0.00 0.00 3.12 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.83 0.00 83 E 8.22 3.99 0.00 2.11 2.16 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 2.35 2.38 0.00 84 H 8.26 4.17 0.00 3.21 3.40 0.00 5.83 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 85 F 8.24 4.29 0.00 3.23 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 86 K 8.01 4.35 0.00 2.00 1.94 0.00 1.75 0.00 0.00 1.77 0.00 0.00 3.09 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.58 1.82 7.81 87 N 7.63 4.74 0.00 2.82 2.81 0.00 0.00 7.00 7.11 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 88 T 7.28 4.28 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 1.17 0.00 0.00 89 E 8.81 3.89 0.00 1.99 2.02 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 2.39 2.31 0.00 90 E 8.15 3.85 0.00 1.89 1.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 2.08 0.00 91 G 7.89 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 0.00 0.00 0.00 92 K 8.59 4.01 0.00 1.96 1.87 0.00 1.66 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 3.23 0.00 0.00 0.00 0.00 1.47 1.62 7.81 93 A 8.19 4.01 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 94 L 8.01 4.04 0.00 2.00 1.77 0.90 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 95 V 8.09 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 0.93 0.00 0.00 1.07 0.00 0.00 96 H 8.36 4.19 0.00 3.26 3.49 0.00 5.59 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 97 H 8.38 4.15 0.00 3.47 3.39 0.00 5.67 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 Y 8.12 4.07 0.00 3.27 3.25 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 0.00 99 E 8.60 3.78 0.00 2.41 1.90 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 2.34 2.36 0.00 100 E 8.27 3.82 0.00 2.00 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 2.26 0.00 101 C 7.89 4.17 0.00 2.95 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 0.00 102 A 7.72 3.71 1.05 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 0.00 0.00 0.00 0.00 0.00 103 E 8.01 3.82 0.00 2.12 1.96 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 2.28 2.41 0.00 104 R 7.92 3.87 0.00 1.92 2.04 0.00 3.07 0.00 0.00 3.07 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.62 0.00 105 V 7.92 3.66 2.17 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 0.91 0.00 0.00 1.00 0.00 0.00 106 K 7.89 3.86 0.00 1.84 1.88 0.00 1.81 0.00 0.00 1.66 0.00 0.00 2.99 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.38 1.41 7.81 107 I 7.60 3.82 1.97 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 1.48 1.05 0.88 0.00 0.00 108 Q 7.60 4.03 0.00 2.23 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.80 0.00 0.00 0.00 0.00 0.00 2.40 2.62 0.00 109 Q 7.35 2.52 0.00 1.88 1.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 7.03 0.00 0.00 0.00 0.00 0.00 1.57 2.20 0.00 110 Q 7.34 4.05 0.00 2.13 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.87 0.00 0.00 0.00 0.00 0.00 2.32 2.49 0.00 111 Q 6.95 4.16 0.00 2.22 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.84 0.00 0.00 0.00 0.00 0.00 2.68 2.45 0.00 112 P 0.00 4.31 0.00 2.19 2.06 0.00 3.83 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.97 0.00 113 G 8.98 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 0.00 0.00 0.00 114 Y 8.09 4.07 0.00 3.18 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 0.00 115 A 8.08 3.84 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 7.45 4.77 0.00 2.60 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 0.00 117 L 7.50 3.88 0.00 1.54 1.46 1.05 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 118 E 7.56 3.81 0.00 2.03 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 2.17 0.00 119 H 7.45 4.57 0.00 3.15 3.23 0.00 5.94 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 K 7.65 4.27 0.00 1.72 1.81 0.00 1.56 0.00 0.00 0.80 0.00 0.00 2.73 0.00 0.00 2.58 0.00 0.00 0.00 0.00 1.01 1.43 7.81 121 E 8.77 4.14 0.00 1.95 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 2.29 2.30 0.00 122 D 8.32 5.05 0.00 2.77 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 0.00 123 C 8.28 5.62 0.00 3.08 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 0.00 124 V 7.96 3.62 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 0.24 0.00 0.00 0.95 0.00 0.00 125 E 8.05 3.74 0.00 1.97 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 2.17 2.30 0.00 126 E 8.20 4.10 0.00 2.54 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 0.00 2.48 2.51 0.00 127 F 8.62 4.25 0.00 3.16 3.40 0.00 0.00 0.00 0.00 0.00 0.00 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 F 9.18 4.10 0.00 3.14 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 0.00 129 H 8.46 4.36 0.00 3.43 3.38 0.00 5.62 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 L 7.91 3.97 0.00 1.95 1.71 0.94 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 131 Q 8.02 3.75 0.00 1.66 1.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.58 0.00 0.00 0.00 0.00 0.00 1.85 2.14 0.00 132 H 8.62 4.03 0.00 3.31 3.46 0.00 5.84 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 Y 7.83 3.99 0.00 3.07 3.16 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 0.00 134 L 7.87 3.57 0.00 1.77 1.61 0.94 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 135 D 8.21 4.15 0.00 2.63 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 0.00 136 T 7.56 3.65 4.11 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 1.06 0.00 0.00 137 A 6.83 3.77 -0.06 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 0.00 138 T 8.03 3.90 4.19 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 1.19 0.00 0.00 139 A 8.07 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 0.00 140 P 0.00 3.96 0.00 2.16 2.09 0.00 3.48 0.00 0.00 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.01 0.00 141 R 7.36 4.41 0.00 1.68 2.03 0.00 3.27 0.00 0.00 3.19 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.59 0.00 142 L 8.05 4.05 0.00 1.92 1.82 0.98 1.38 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 0.00 143 F 8.54 4.21 0.00 3.05 3.09 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 0.00 0.00 0.00 144 D 7.83 4.54 0.00 2.84 2.76 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 0.00 145 K 8.13 4.39 0.00 1.86 1.85 0.00 1.69 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.44 1.63 7.81 146 L 6.93 4.59 0.00 1.35 1.34 0.58 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 147 K 8.24 4.07 0.00 1.64 1.61 0.00 1.67 0.00 0.00 1.72 0.00 0.00 3.12 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.35 1.45 7.81