NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 62 A 4.2416 8.1233 122.4552 51.9512 20.5131 175.3868 63 M 4.8176 7.9427 120.2656 52.8927 35.6595 174.1647 64 F 4.7862 9.3070 121.4588 55.6263 43.0745 173.7696 65 Q 4.3923 9.0239 125.9359 55.5535 29.5831 175.4303 66 I 4.4246 8.3764 117.7386 59.5031 38.8193 174.8452 67 G 3.8293 6.9955 109.5800 45.3262 0.0000 172.4568 68 K 4.0831 8.4429 119.1046 57.8752 32.4593 177.1897 69 M 3.3671 8.9113 121.0754 56.0201 29.6113 175.8497 70 R 5.2580 7.4896 117.4745 54.9785 34.2576 173.9661 71 Y 5.1264 9.2383 120.6711 56.2701 42.9856 174.2058 72 V 4.8481 9.1348 122.3276 61.6100 33.7771 174.3726 73 S 5.2178 9.3234 123.0618 56.5412 64.8535 172.6126 74 V 4.9525 8.7699 127.4658 61.1965 33.1144 174.6500 75 R 4.7590 8.8728 123.4708 54.9048 33.7694 173.2489 76 D 5.1964 8.6898 119.3318 52.7668 42.6536 175.4090 77 F 4.6174 9.5778 129.9158 56.9204 39.9753 175.4211 78 K 3.8163 9.2398 130.1982 57.4577 29.1231 176.9615 79 G 4.0073 8.7399 106.6734 45.1067 0.0000 173.9200 80 K 4.6469 7.9005 119.1114 54.3655 34.7771 175.1301 81 V 4.5883 8.2047 122.1773 62.2497 32.7637 175.0828 82 L 4.9705 9.1082 126.8526 53.0241 45.9954 175.6958 83 I 4.4342 8.8787 124.2389 59.8458 39.0302 173.7483 84 D 5.3010 9.2507 128.2475 52.4417 43.4840 174.8649 85 I 4.8602 8.5445 127.0957 59.7772 39.4809 174.6905 86 R 5.0552 8.8491 126.0448 55.3558 34.1991 173.5021 87 E 5.0801 9.0409 123.1938 56.0990 31.0991 175.2720 88 Y 5.1891 9.3178 120.3230 56.2235 41.6771 175.1311 89 W 4.8307 9.9631 122.2351 55.5184 32.4967 174.4412 90 M 5.1615 8.6343 121.4748 54.0630 33.4359 175.6783 91 D 4.8299 9.2429 126.4536 51.7334 41.1185 175.2582 92 P 4.3164 0.0000 0.0000 64.7533 31.2353 177.2269 93 E 4.3301 8.4542 116.1293 55.9543 29.8582 176.6299 94 G 3.9398 8.5062 107.6612 45.3682 0.0000 173.2413 95 E 4.4505 8.5990 119.7565 55.5197 31.1559 175.5968 96 M 4.9392 8.5186 123.3962 54.9866 33.1325 175.8225 97 K 4.9177 9.6419 123.0175 53.5899 36.1117 173.8668 98 P 3.5190 0.0000 0.0000 62.7217 31.8917 176.6463 99 G 4.1212 8.5436 112.4652 45.1031 0.0000 173.7304 100 R 4.1162 8.6808 117.7035 58.4109 30.4013 177.4763 101 K 4.3376 7.8881 118.0269 55.2238 31.8084 175.9364 102 G 4.4864 7.9467 110.5644 45.6457 0.0000 169.4861 103 I 4.7758 8.5835 119.0793 59.4212 41.9106 173.7101 104 S 5.0257 8.6798 124.4368 57.0947 64.3207 173.3225 105 L 5.0308 8.9300 125.9947 52.9583 44.0955 176.7061 106 N 4.9729 9.3149 121.0171 51.2405 38.9610 174.3581 107 P 4.3886 0.0000 0.0000 65.7172 31.1701 178.5611 108 E 4.0805 8.3324 117.8004 59.1025 29.6785 178.6403 109 Q 4.0409 8.9050 118.7633 58.6050 28.7095 178.2500 110 W 4.4289 8.5689 129.5958 60.6191 30.6063 177.9715 111 S 3.8907 8.3279 113.0744 61.4533 61.6236 176.1798 112 Q 3.9370 8.0047 119.7655 58.6531 28.6763 178.3208 113 L 4.0166 7.9038 121.4325 58.1023 42.3023 179.1378 114 K 3.6522 7.8129 118.7355 59.4160 31.6724 179.1408 115 E 4.0264 8.2319 118.0910 58.3801 29.4229 177.7955 116 Q 4.6349 7.5344 117.3824 55.6603 29.6449 177.8618 117 I 3.6387 7.6398 122.1904 64.5078 36.9635 178.0433 118 S 4.0895 7.9531 113.5009 61.5105 62.2812 175.8553 119 D 4.3354 7.9721 121.1057 57.3030 40.5772 178.6002 120 I 3.6922 8.0772 120.7324 64.5465 37.1354 178.2373 121 D 4.3472 8.5203 120.1588 57.2598 40.6019 178.3596 122 D 4.2890 8.3344 118.4793 57.3514 41.2725 178.2294 123 A 4.0200 7.9891 121.2660 54.9353 18.0849 179.7716 124 V 3.5145 7.8204 116.5770 66.2596 31.7065 178.0147 125 R 4.0168 7.8573 117.1746 59.1086 30.0090 178.0382 126 K 4.2195 8.0487 116.8660 57.4407 32.4171 176.8643 127 L 4.3014 7.7892 123.3713 54.7028 41.8185 176.0718 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 4.24 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 63 M 7.94 4.82 0.00 1.66 1.63 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.38 0.00 64 F 9.31 4.79 0.00 2.97 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 65 Q 9.02 4.39 0.00 2.11 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.97 0.00 0.00 0.00 0.00 0.00 2.11 1.85 0.00 66 I 8.38 4.42 1.88 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.82 0.97 0.00 0.00 67 G 7.00 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 68 K 8.44 4.08 0.00 1.71 1.74 0.00 1.85 0.00 0.00 1.68 0.00 0.00 2.85 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.41 1.43 7.81 69 M 8.91 3.37 0.00 2.49 2.14 0.00 0.00 0.00 0.00 0.00 2.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.47 0.00 70 R 7.49 5.26 0.00 1.64 1.74 0.00 3.15 0.00 0.00 3.16 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.61 0.00 71 Y 9.24 5.13 0.00 2.65 2.65 0.00 0.00 0.00 0.00 0.00 0.00 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 9.13 4.85 2.26 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 0.95 0.00 0.00 0.98 0.00 0.00 73 S 9.32 5.22 0.00 3.99 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 8.77 4.95 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 0.85 0.00 0.00 0.92 0.00 0.00 75 R 8.87 4.76 0.00 1.93 1.99 0.00 2.86 0.00 0.00 3.12 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.67 0.00 76 D 8.69 5.20 0.00 2.73 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 77 F 9.58 4.62 0.00 3.03 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 9.24 3.82 0.00 1.52 1.67 0.00 0.61 0.00 0.00 0.61 0.00 0.00 2.73 0.00 0.00 2.34 0.00 0.00 0.00 0.00 0.99 1.15 7.81 79 G 8.74 4.01 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 0.00 0.00 0.00 80 K 7.90 4.65 0.00 1.87 1.74 0.00 1.71 0.00 0.00 1.61 0.00 0.00 2.91 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.37 1.52 7.81 81 V 8.20 4.59 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 0.78 0.00 0.00 0.96 0.00 0.00 82 L 9.11 4.97 0.00 1.54 1.44 0.75 0.60 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 83 I 8.88 4.43 1.56 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.40 0.25 -0.07 0.00 0.00 84 D 9.25 5.30 0.00 2.70 2.53 0.00 0.00 0.00 0.00 0.00 0.00 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 4.86 1.93 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.56 0.99 0.00 0.00 86 R 8.85 5.06 0.00 2.03 1.81 0.00 2.78 0.00 0.00 3.10 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 1.62 0.00 87 E 9.04 5.08 0.00 2.09 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 2.33 2.41 0.00 88 Y 9.32 5.19 0.00 2.96 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 9.96 4.83 0.00 3.22 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 90 M 8.63 5.16 0.00 2.09 2.03 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.57 0.00 91 D 9.24 4.83 0.00 2.92 2.85 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 92 P 0.00 4.32 0.00 2.08 2.17 0.00 3.68 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.14 0.00 93 E 8.45 4.33 0.00 2.12 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 2.25 2.35 0.00 94 G 8.51 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 95 E 8.60 4.45 0.00 2.22 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 2.29 0.00 96 M 8.52 4.94 0.00 1.87 1.78 0.00 0.00 0.00 0.00 0.00 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.43 0.00 97 K 9.64 4.92 0.00 1.66 1.65 0.00 1.69 0.00 0.00 1.74 0.00 0.00 3.20 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.56 1.50 7.81 98 P 0.00 3.52 0.00 1.82 1.68 0.00 3.76 0.00 0.00 3.77 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 8.54 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 0.00 100 R 8.68 4.12 0.00 1.86 2.01 0.00 3.18 0.00 0.00 3.23 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.64 0.00 101 K 7.89 4.34 0.00 1.87 1.79 0.00 1.93 0.00 0.00 1.84 0.00 0.00 2.85 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.53 1.50 7.81 102 G 7.95 4.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.58 4.78 1.89 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 1.25 1.62 0.95 0.00 0.00 104 S 8.68 5.03 0.00 3.70 3.70 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 0.00 105 L 8.93 5.03 0.00 1.71 1.68 1.17 0.49 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 0.00 106 N 9.31 4.97 0.00 2.97 3.00 0.00 0.00 6.85 8.42 0.00 0.00 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 4.39 0.00 2.24 2.24 0.00 3.64 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.18 0.00 108 E 8.33 4.08 0.00 2.12 2.13 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 2.40 2.48 0.00 109 Q 8.90 4.04 0.00 2.33 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.56 0.00 0.00 0.00 0.00 0.00 2.42 2.54 0.00 110 W 8.57 4.43 0.00 3.34 3.35 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 0.00 111 S 8.33 3.89 0.00 3.96 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 0.00 112 Q 8.00 3.94 0.00 2.23 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.73 0.00 0.00 0.00 0.00 0.00 2.68 2.52 0.00 113 L 7.90 4.02 0.00 1.75 1.68 0.89 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 114 K 7.81 3.65 0.00 1.59 1.55 0.00 1.38 0.00 0.00 0.99 0.00 0.00 2.29 0.00 0.00 2.58 0.00 0.00 0.00 0.00 0.63 0.39 7.81 115 E 8.23 4.03 0.00 1.99 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 2.29 2.44 0.00 116 Q 7.53 4.63 0.00 2.06 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.80 0.00 0.00 0.00 0.00 0.00 2.24 2.34 0.00 117 I 7.64 3.64 1.85 0.00 0.00 0.69 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 0.73 0.88 0.00 0.00 118 S 7.95 4.09 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 7.97 4.34 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 8.08 3.69 1.96 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.78 0.90 0.00 0.00 121 D 8.52 4.35 0.00 2.81 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 8.33 4.29 0.00 2.77 2.82 0.00 0.00 0.00 0.00 0.00 0.00 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 7.99 4.02 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 V 7.82 3.51 2.21 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 0.82 0.00 0.00 0.99 0.00 0.00 125 R 7.86 4.02 0.00 2.03 2.12 0.00 3.30 0.00 0.00 3.22 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.66 0.00 126 K 8.05 4.22 0.00 1.85 1.84 0.00 1.72 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.44 1.60 7.81 127 L 7.79 4.30 0.00 1.72 1.55 0.92 0.74 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