NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 46 A 4.2472 8.2649 123.5823 51.7129 19.6566 176.4280 47 E 3.9905 8.4830 121.6840 55.5760 29.6138 176.0343 48 L 4.2877 8.6970 123.5625 55.7128 42.6583 178.2835 49 Q 3.9595 7.8075 121.3126 59.1803 29.0506 177.9183 50 D 4.3821 8.0204 119.8852 56.5682 39.5484 178.1160 51 M 4.0684 7.9061 119.1860 58.3775 32.2267 178.0290 52 I 3.7172 7.9938 120.3863 64.4896 37.0335 178.0766 53 N 4.3686 8.0155 116.2747 55.6490 38.4623 176.5373 54 E 4.1797 7.8087 119.5130 58.1343 29.9145 177.9341 55 V 4.0066 7.7702 117.5982 63.7738 31.9932 175.3223 56 D 4.2539 8.1716 119.1283 54.8022 41.2122 176.1788 57 A 4.3151 8.8497 129.7936 53.1526 19.9910 176.9665 58 D 4.7549 8.0886 110.9552 52.7661 40.8622 177.0624 59 G 4.5224 8.6607 108.0089 45.2283 0.0000 173.7983 60 N 4.3811 8.8546 116.9485 52.9907 37.6986 176.9578 61 G 4.0238 9.3705 107.8384 45.8598 0.0000 173.0560 62 T 4.7287 7.2523 111.3952 60.1895 70.5849 173.3398 63 I 4.1507 8.4610 127.0325 61.3931 38.7240 174.9532 64 D 5.2604 8.5554 124.3422 52.5787 44.3761 176.9743 65 F 4.0693 9.0052 118.2653 60.3120 38.6906 176.0500 66 P 4.3762 0.0000 0.0000 65.6869 31.1696 178.5785 67 E 3.9942 8.2910 116.7819 59.3907 29.5701 178.8274 68 F 4.0284 9.0177 120.9796 61.4994 39.3378 177.2036 69 L 4.0554 8.2633 118.4931 58.0033 41.3874 179.7514 70 T 3.9015 8.1619 115.8987 66.9556 68.2980 176.9875 71 M 4.0306 8.3719 119.5683 58.8966 32.0126 177.8260 72 M 3.9033 8.0235 118.8099 57.8395 32.1883 177.6843 73 A 4.1978 8.3740 124.9550 53.3730 18.7777 179.0185 74 R 4.0054 7.5509 117.6472 58.8948 30.1695 176.9461 75 K 4.3525 7.9000 113.1466 56.8882 34.7924 175.6804 76 M 4.4235 7.8721 117.9308 52.9542 32.1672 174.4496 77 K 4.6493 8.5862 125.4431 54.6514 34.6373 174.3671 78 D 4.9131 8.0314 124.0940 54.6905 40.7532 178.8051 79 T 4.3100 8.6860 112.9725 63.0173 69.0186 174.2397 80 D 4.8872 8.4350 124.6183 50.5903 39.2596 173.8091 81 S 4.6703 7.8020 118.3925 56.7448 65.6666 173.0065 82 E 4.0515 8.8664 129.5672 59.2835 29.3491 178.4056 83 E 3.9288 8.1893 118.2340 59.6872 29.6142 179.1009 84 E 4.0621 8.1503 117.7904 59.5296 29.6142 179.3929 85 I 3.8621 8.3529 120.3833 64.3768 37.2829 178.5156 86 R 4.2031 8.6853 120.0807 59.4873 29.9284 178.3273 87 E 4.0347 8.7946 118.7272 59.3785 29.3722 179.1629 88 A 4.1773 8.1929 120.7507 55.2406 18.5345 179.5190 89 F 3.4543 8.1116 116.5173 60.6659 38.7635 178.1123 90 R 4.1011 7.8170 113.5438 58.6062 29.4548 178.8548 91 V 3.7836 7.5621 118.6998 65.9132 31.7423 177.6851 92 F 4.0301 8.9652 117.0919 59.7082 39.1980 175.8421 93 D 4.5332 7.2395 116.0324 53.9905 41.7261 176.3488 94 K 3.5826 8.9590 124.8577 59.0634 32.0917 178.0221 95 D 4.6542 9.0067 115.8435 53.1773 41.5040 176.3616 96 G 4.1236 7.9140 107.5689 46.4439 0.0000 174.1596 97 N 4.5468 8.6083 112.8221 52.8617 37.1013 175.2190 98 G 3.7633 8.9352 105.0357 46.4746 0.0000 173.2886 99 Y 5.2169 7.6532 114.2677 56.4040 42.5909 174.7735 100 I 4.2303 8.2271 121.9830 59.9339 39.6174 175.1628 101 S 4.8821 8.3971 121.7429 56.4990 65.3449 174.9085 102 A 3.9590 8.6835 122.5227 55.2851 18.2187 179.3228 103 A 3.9824 8.1187 118.7152 55.7117 18.2999 179.5905 104 E 3.9583 8.1440 116.2921 59.3601 29.5939 179.0947 105 L 4.1239 8.2867 119.5602 58.2752 41.6685 179.9909 106 R 3.9702 7.9779 117.3220 59.0964 29.7383 178.2147 107 H 4.0374 7.8940 117.5980 59.4832 29.8606 177.0278 108 V 3.6922 7.4757 118.7489 65.0135 31.7645 177.1753 109 M 4.0261 8.5329 118.8565 57.0065 32.0939 176.7421 110 T 4.3304 7.4936 115.2366 63.8337 71.8827 173.6298 111 N 4.7431 8.1308 119.0470 51.8508 41.0361 172.6787 112 L 4.5407 8.2857 120.3535 53.3248 43.4184 176.5544 113 G 3.8297 8.5855 113.6745 45.7599 0.0000 172.5085 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 46 A 8.26 4.25 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 47 E 8.48 3.99 0.00 2.17 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 2.40 2.45 0.00 48 L 8.70 4.29 0.00 1.69 1.70 0.93 1.00 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 49 Q 7.81 3.96 0.00 2.13 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.81 0.00 0.00 0.00 0.00 0.00 2.35 2.37 0.00 50 D 8.02 4.38 0.00 2.91 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 51 M 7.91 4.07 0.00 2.30 2.10 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.70 0.00 52 I 7.99 3.72 2.08 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 1.53 0.75 0.94 0.00 0.00 53 N 8.02 4.37 0.00 2.88 2.87 0.00 0.00 7.30 6.95 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 54 E 7.81 4.18 0.00 2.00 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 2.29 2.30 0.00 55 V 7.77 4.01 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 0.96 0.00 0.00 1.02 0.00 0.00 56 D 8.17 4.25 0.00 2.90 2.71 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 57 A 8.85 4.32 1.35 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 0.00 0.00 0.00 0.00 0.00 0.00 58 D 8.09 4.75 0.00 2.80 2.77 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.66 4.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.85 4.38 0.00 2.78 3.02 0.00 0.00 6.76 7.09 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 61 G 9.37 4.02 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 0.00 0.00 0.00 62 T 7.25 4.73 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 0.87 0.00 0.00 63 I 8.46 4.15 2.21 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.91 0.99 0.00 0.00 64 D 8.56 5.26 0.00 3.09 2.72 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 65 F 9.01 4.07 0.00 3.05 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 66 P 0.00 4.38 0.00 2.25 2.18 0.00 3.83 0.00 0.00 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.27 0.00 67 E 8.29 3.99 0.00 2.38 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 2.46 2.46 0.00 68 F 9.02 4.03 0.00 3.10 3.24 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 0.00 69 L 8.26 4.06 0.00 2.13 1.77 1.04 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 70 T 8.16 3.90 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 1.21 0.00 0.00 71 M 8.37 4.03 0.00 1.81 2.15 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.57 0.00 72 M 8.02 3.90 0.00 2.01 1.52 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.59 0.00 73 A 8.37 4.20 1.32 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 0.00 0.00 0.00 74 R 7.55 4.01 0.00 1.93 2.04 0.00 3.24 0.00 0.00 3.26 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.71 0.00 75 K 7.90 4.35 0.00 1.83 1.83 0.00 1.57 0.00 0.00 1.74 0.00 0.00 3.08 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.26 1.36 7.81 76 M 7.87 4.42 0.00 2.12 2.20 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.39 0.00 77 K 8.59 4.65 0.00 1.68 1.73 0.00 1.62 0.00 0.00 1.63 0.00 0.00 3.07 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.33 1.45 7.81 78 D 8.03 4.91 0.00 2.64 1.74 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 79 T 8.69 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 1.28 0.00 0.00 80 D 8.43 4.89 0.00 2.77 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 81 S 7.80 4.67 0.00 3.89 3.75 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 0.00 0.00 0.00 82 E 8.87 4.05 0.00 2.03 1.87 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 2.15 2.26 0.00 83 E 8.19 3.93 0.00 2.07 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 2.39 2.40 0.00 84 E 8.15 4.06 0.00 2.19 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 2.44 2.39 0.00 85 I 8.35 3.86 2.10 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.98 1.31 0.00 0.00 86 R 8.69 4.20 0.00 2.10 2.17 0.00 3.08 0.00 0.00 3.13 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.92 0.00 87 E 8.79 4.03 0.00 2.25 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 2.65 2.52 0.00 88 A 8.19 4.18 1.16 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 0.00 0.00 89 F 8.11 3.45 0.00 3.08 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 R 7.82 4.10 0.00 2.03 2.11 0.00 3.09 0.00 0.00 3.18 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.69 0.00 91 V 7.56 3.78 2.43 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 0.87 0.00 0.00 1.05 0.00 0.00 92 F 8.97 4.03 0.00 2.73 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 93 D 7.24 4.53 0.00 3.00 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 94 K 8.96 3.58 0.00 1.80 1.73 0.00 1.81 0.00 0.00 1.68 0.00 0.00 2.99 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.29 1.43 7.81 95 D 9.01 4.65 0.00 2.60 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 96 G 7.91 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 N 8.61 4.55 0.00 2.95 2.98 0.00 0.00 6.73 7.24 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 98 G 8.94 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 0.00 0.00 0.00 99 Y 7.65 5.22 0.00 2.90 2.80 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 0.00 100 I 8.23 4.23 1.27 0.00 0.00 -1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.48 -0.36 0.77 0.00 0.00 101 S 8.40 4.88 0.00 3.90 3.74 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 0.00 102 A 8.68 3.96 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 0.00 103 A 8.12 3.98 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.14 3.96 0.00 2.16 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 0.00 2.41 2.53 0.00 105 L 8.29 4.12 0.00 1.91 1.81 0.99 1.09 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 0.00 106 R 7.98 3.97 0.00 2.04 1.98 0.00 3.16 0.00 0.00 3.09 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.64 0.00 107 H 7.89 4.04 0.00 3.13 3.50 0.00 5.94 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 V 7.48 3.69 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.40 0.00 0.00 0.46 0.00 0.00 109 M 8.53 4.03 0.00 1.91 2.13 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.56 0.00 110 T 7.49 4.33 4.22 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 0.00 0.00 0.00 1.19 0.00 0.00 111 N 8.13 4.74 0.00 2.63 2.75 0.00 0.00 7.07 8.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 L 8.29 4.54 0.00 1.59 1.53 0.89 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 113 G 8.59 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 0.00 0.00 0.00