NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 62 A 4.2482 8.1233 122.4554 51.9465 20.4876 175.3647 63 M 4.8255 8.0356 120.3319 52.8886 35.4464 174.2845 64 F 4.7415 9.2972 121.3951 55.6112 42.8469 173.7809 65 Q 4.2606 8.9668 126.1147 55.5876 29.2032 175.4998 66 I 4.3027 8.0536 118.5422 60.6808 39.4358 174.8945 67 G 3.8510 6.9600 108.6387 44.4807 0.0000 172.2080 68 K 4.0052 8.4809 120.9288 57.8130 32.4889 176.1453 69 M 3.3941 8.9620 123.9198 56.0244 29.5234 175.7018 70 R 5.2779 7.6636 117.8216 54.9093 34.1765 173.9924 71 Y 5.1178 9.2610 120.6888 56.2004 42.8274 174.3326 72 V 4.8066 8.9924 122.6723 61.7253 33.6201 174.4352 73 S 5.2619 9.4397 122.9837 56.4656 65.0336 172.5655 74 V 5.2244 8.7644 127.0644 60.3436 33.5433 174.5909 75 R 4.6014 8.1522 122.0207 55.1827 32.6149 173.2634 76 D 4.8886 8.5526 119.6814 54.3284 42.9001 175.0874 77 F 4.7770 9.4529 127.3461 56.9110 41.0295 174.6512 78 K 3.5753 9.3017 130.2723 57.3848 29.2261 176.7204 79 G 4.0047 8.8824 104.6999 44.9814 0.0000 173.5239 80 K 4.7446 7.8064 118.7190 54.2503 36.1520 175.6807 81 V 4.3818 8.4821 123.5623 62.7183 32.6515 175.0475 82 L 5.0016 8.9285 126.9899 53.0120 45.3519 175.6397 83 I 4.4032 8.8385 123.9658 59.8312 39.2846 173.8527 84 D 5.2702 9.2364 128.2209 52.3522 43.7344 174.7541 85 I 4.9664 8.5418 127.0666 59.8228 39.5719 174.6546 86 R 5.0296 8.8606 126.0268 55.3589 34.1405 173.3912 87 E 5.1106 8.8775 123.5374 56.0604 31.0234 175.2937 88 Y 5.1799 9.4263 120.9437 56.1940 41.5401 174.8550 89 W 4.8364 9.6359 120.8586 55.3450 33.0285 174.4451 90 M 5.2532 8.6539 121.1836 53.8651 33.3346 175.4393 91 D 4.7753 9.0121 126.4386 52.0607 40.6333 175.4474 92 P 4.3582 0.0000 0.0000 64.7976 31.2717 177.3786 93 E 4.1903 8.3359 116.2056 56.4560 29.7618 177.1535 94 G 3.9547 8.4021 107.6900 45.3191 0.0000 173.4057 95 E 4.4014 8.4789 119.6846 55.3786 30.6351 175.3086 96 M 4.8707 8.4283 122.3323 55.0304 33.0829 175.8044 97 K 4.8739 9.4135 123.6368 53.5659 35.8735 173.8322 98 P 3.6536 0.0000 0.0000 62.6330 31.8241 176.7055 99 G 4.1345 8.4850 112.7710 45.2942 0.0000 173.6937 100 R 4.1642 8.7006 117.5083 57.7998 30.5833 177.5609 101 K 4.3532 7.8041 118.2746 55.1251 31.9322 175.6928 102 G 4.2452 7.9451 110.5015 45.6305 0.0000 169.6536 103 I 4.7447 8.5221 119.2963 59.4220 41.8048 173.7274 104 S 5.0099 8.7166 125.0525 57.2373 64.0667 173.4135 105 L 5.0273 9.0644 125.8976 53.0198 44.1948 176.6153 106 N 4.9986 9.1128 120.1687 51.2148 38.9821 174.4339 107 P 4.3998 0.0000 0.0000 65.7476 31.1928 178.6200 108 E 4.0109 8.2933 117.8251 59.1812 29.5561 178.7855 109 Q 4.0203 8.6551 118.3417 58.6581 28.8556 178.2410 110 W 4.4156 8.5673 129.6947 60.5836 30.6810 177.8738 111 S 3.8247 8.5241 113.4033 61.5110 61.6206 176.2269 112 Q 4.1052 7.9435 119.4813 58.7687 28.7008 178.1296 113 L 4.0425 8.0757 121.5531 58.1997 42.1382 179.3128 114 K 3.7715 7.6390 118.2116 59.1133 31.6387 179.1493 115 E 4.0200 7.9497 118.0387 58.4172 29.5906 178.1327 116 Q 4.3885 7.6533 116.6578 55.8177 29.0648 177.4454 117 I 3.6376 7.4556 122.8897 64.4366 37.1915 177.9981 118 S 4.0493 7.9774 113.3463 61.6736 62.2627 175.8786 119 D 4.3910 7.9990 120.9669 57.2013 40.6108 178.6741 120 I 3.7070 8.0627 120.9320 64.5249 37.2016 178.2281 121 D 4.3783 8.4105 120.0197 57.3062 40.3600 178.5157 122 D 4.3486 8.0125 118.5143 57.4226 41.1987 178.4618 123 A 4.1200 8.0080 121.1734 55.0056 18.3105 179.8639 124 V 3.5669 7.9770 116.9974 66.1813 31.3993 178.3717 125 R 4.0844 7.7354 115.9291 58.1745 29.9837 178.0977 126 K 4.2999 7.6949 116.5409 56.7252 32.4921 176.6705 127 L 4.3266 7.7055 124.5606 54.7359 41.9329 176.0927 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 62 A 8.12 4.25 1.22 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 0.00 0.00 0.00 63 M 8.04 4.83 0.00 1.70 1.67 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.38 0.00 64 F 9.30 4.74 0.00 2.94 2.99 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 65 Q 8.97 4.26 0.00 2.02 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.82 0.00 0.00 0.00 0.00 0.00 2.10 1.46 0.00 66 I 8.05 4.30 1.87 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.80 0.95 0.00 0.00 67 G 6.96 3.85 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 0.00 0.00 0.00 0.00 0.00 0.00 68 K 8.48 4.01 0.00 1.68 1.70 0.00 1.87 0.00 0.00 1.67 0.00 0.00 2.77 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.39 1.44 7.81 69 M 8.96 3.39 0.00 2.54 2.15 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.47 0.00 70 R 7.66 5.28 0.00 1.63 1.76 0.00 3.15 0.00 0.00 3.15 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.61 0.00 71 Y 9.26 5.12 0.00 2.68 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 72 V 8.99 4.81 2.23 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 0.84 0.00 0.00 0.95 0.00 0.00 73 S 9.44 5.26 0.00 3.94 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 74 V 8.76 5.22 2.23 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 1.11 0.00 0.00 0.86 0.00 0.00 75 R 8.15 4.60 0.00 1.91 1.99 0.00 3.07 0.00 0.00 3.30 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.66 0.00 76 D 8.55 4.89 0.00 2.86 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 77 F 9.45 4.78 0.00 3.02 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 78 K 9.30 3.58 0.00 1.46 1.57 0.00 1.52 0.00 0.00 1.46 0.00 0.00 2.53 0.00 0.00 2.89 0.00 0.00 0.00 0.00 0.79 0.21 7.81 79 G 8.88 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 K 7.81 4.74 0.00 1.90 1.72 0.00 1.70 0.00 0.00 1.63 0.00 0.00 2.85 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.37 1.36 7.81 81 V 8.48 4.38 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 0.78 0.00 0.00 0.96 0.00 0.00 82 L 8.93 5.00 0.00 1.61 1.48 0.83 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 83 I 8.84 4.40 1.66 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.23 0.43 0.13 0.00 0.00 84 D 9.24 5.27 0.00 2.69 2.52 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 85 I 8.54 4.97 1.92 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.62 0.97 0.00 0.00 86 R 8.86 5.03 0.00 2.01 1.77 0.00 2.71 0.00 0.00 3.14 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 1.64 0.00 87 E 8.88 5.11 0.00 2.02 1.86 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 2.32 2.42 0.00 88 Y 9.43 5.18 0.00 3.02 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 89 W 9.64 4.84 0.00 3.19 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 90 M 8.65 5.25 0.00 2.08 2.03 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.56 0.00 91 D 9.01 4.78 0.00 2.96 2.83 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 92 P 0.00 4.36 0.00 2.08 2.17 0.00 3.68 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.13 0.00 93 E 8.34 4.19 0.00 2.24 1.99 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 2.28 2.36 0.00 94 G 8.40 3.95 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 0.00 0.00 0.00 0.00 0.00 0.00 95 E 8.48 4.40 0.00 2.06 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 2.29 2.28 0.00 96 M 8.43 4.87 0.00 1.84 1.87 0.00 0.00 0.00 0.00 0.00 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.47 0.00 97 K 9.41 4.87 0.00 1.67 1.66 0.00 1.68 0.00 0.00 1.73 0.00 0.00 2.87 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.54 1.49 7.81 98 P 0.00 3.65 0.00 1.82 1.69 0.00 3.75 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.93 0.00 99 G 8.49 4.13 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 0.00 0.00 0.00 100 R 8.70 4.16 0.00 1.86 2.00 0.00 3.20 0.00 0.00 3.21 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.63 0.00 101 K 7.80 4.35 0.00 1.86 1.78 0.00 1.92 0.00 0.00 1.84 0.00 0.00 2.84 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.51 1.49 7.81 102 G 7.95 4.25 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 0.00 0.00 0.00 103 I 8.52 4.74 1.88 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.63 0.94 0.00 0.00 104 S 8.72 5.01 0.00 3.72 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 0.00 105 L 9.06 5.03 0.00 1.72 1.68 1.12 0.73 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 0.00 106 N 9.11 5.00 0.00 3.00 3.01 0.00 0.00 7.02 7.30 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 0.00 107 P 0.00 4.40 0.00 2.25 2.25 0.00 3.65 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.20 0.00 108 E 8.29 4.01 0.00 2.07 2.14 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 2.40 2.42 0.00 109 Q 8.66 4.02 0.00 2.53 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.56 0.00 0.00 0.00 0.00 0.00 2.42 2.48 0.00 110 W 8.57 4.42 0.00 3.32 3.32 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 0.00 111 S 8.52 3.82 0.00 3.95 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 0.00 112 Q 7.94 4.11 0.00 2.19 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.72 0.00 0.00 0.00 0.00 0.00 2.37 2.60 0.00 113 L 8.08 4.04 0.00 1.86 1.76 0.94 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 114 K 7.64 3.77 0.00 1.58 1.51 0.00 1.27 0.00 0.00 0.72 0.00 0.00 2.13 0.00 0.00 2.32 0.00 0.00 0.00 0.00 0.66 0.26 7.81 115 E 7.95 4.02 0.00 2.03 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 2.27 2.43 0.00 116 Q 7.65 4.39 0.00 2.17 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.80 0.00 0.00 0.00 0.00 0.00 2.41 2.50 0.00 117 I 7.46 3.64 1.89 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.80 0.90 0.00 0.00 118 S 7.98 4.05 0.00 3.85 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 0.00 119 D 8.00 4.39 0.00 2.83 2.68 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.06 3.71 1.99 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 0.86 0.91 0.00 0.00 121 D 8.41 4.38 0.00 2.86 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 0.00 122 D 8.01 4.35 0.00 2.82 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 0.00 123 A 8.01 4.12 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.98 3.57 2.23 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 1.02 0.00 0.00 1.01 0.00 0.00 125 R 7.74 4.08 0.00 2.00 1.97 0.00 3.20 0.00 0.00 3.22 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.83 0.00 126 K 7.69 4.30 0.00 1.87 1.84 0.00 1.65 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.43 1.63 7.81 127 L 7.71 4.33 0.00 1.62 1.53 0.92 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00