NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 59 N 4.6944 8.2833 119.2018 53.3631 39.5689 174.5042 60 E 3.8641 8.0422 122.3475 56.9754 29.8831 177.1114 61 S 4.1070 8.1933 114.2685 61.5524 63.4804 176.0240 62 L 3.9720 8.3649 124.4991 57.2884 41.8289 178.6831 63 K 3.9255 8.0649 119.6825 59.5950 31.9372 178.9208 64 K 4.0187 8.1261 117.6328 59.2969 32.2283 178.8350 65 F 4.3138 8.2248 120.9376 61.4237 39.2137 177.1998 66 L 4.1170 8.4519 116.9088 56.7532 41.4329 177.8091 67 N 4.6519 7.6017 115.5315 52.8922 39.4515 174.1339 68 T 4.5375 6.9457 109.7755 59.9197 71.3578 175.3885 69 K 3.7939 8.5933 124.5456 60.0400 32.1800 178.9468 70 D 4.3756 7.9687 118.6775 57.1792 40.6777 178.9053 71 G 2.1122 7.5987 106.2506 47.2139 0.0000 175.7921 72 R 3.8414 7.8641 121.4634 58.8098 29.9906 178.3930 73 L 3.8946 7.8277 120.2655 58.0110 42.1431 178.8485 74 V 3.5915 8.0456 118.3483 66.2652 31.4018 177.8593 75 A 4.2422 8.4633 120.4779 55.3892 18.1993 179.6994 76 S 4.1456 8.4965 113.9553 61.8296 62.9107 176.9899 77 L 4.0098 8.2321 121.7864 57.5868 41.3096 179.7276 78 V 3.5476 8.0153 118.0116 66.0240 31.4502 177.8862 79 A 3.6504 8.1356 120.6533 55.1357 18.1623 179.2443 80 E 3.8776 8.4852 117.9403 59.1570 29.5749 178.7486 81 F 4.1409 8.3888 120.8360 61.3376 39.4013 177.0892 82 L 4.0080 8.0894 118.5453 57.9794 41.4372 179.6254 83 Q 3.9034 8.3342 118.1993 58.8071 28.4178 178.2936 84 F 3.6996 8.2931 121.0597 60.7843 39.2857 176.3104 85 F 4.5909 7.3588 113.9333 56.0283 39.4242 175.3600 86 N 4.0792 7.7438 114.2957 54.3774 37.0613 176.3498 87 L 4.4227 7.8608 117.4482 54.0581 38.6524 176.6958 88 D 4.2464 7.6049 122.0838 57.1184 41.3066 178.4484 89 F 4.3705 7.7927 117.9816 60.6570 39.0371 177.6441 90 T 3.9916 8.0702 115.0234 66.7168 68.3136 176.0981 91 L 4.0898 8.2251 122.0029 58.2030 41.8555 178.8527 92 A 4.0527 7.9364 119.7995 54.7125 18.5327 179.0818 93 V 3.9557 7.7051 116.5619 65.1297 32.0476 177.6305 94 F 4.1140 8.7290 120.9453 61.5891 39.0902 177.1496 95 Q 4.1164 8.7211 118.8590 58.0558 28.7501 177.2124 96 P 4.2802 0.0000 0.0000 65.8177 31.1896 177.9508 97 E 3.9813 8.2371 118.5341 58.1977 29.6063 177.7326 98 T 4.1661 7.4486 107.1685 60.2015 69.7324 174.2965 99 S 3.7679 7.7127 116.3390 60.6693 61.1736 172.1763 100 T 4.7164 7.9368 105.8665 60.8993 69.1197 176.1869 101 L 4.1214 8.2234 123.5828 59.1499 41.9023 178.7903 102 Q 4.0901 8.0123 115.2097 56.3407 29.1170 176.1943 103 G 4.0938 8.3386 106.6657 45.8835 0.0000 173.9058 104 L 4.4728 8.0413 121.5241 53.1536 43.6557 176.3313 105 E 4.1147 8.5291 118.7049 56.6284 30.0043 178.1012 106 G 3.8535 8.4189 108.6919 43.9193 0.0000 174.6204 107 R 3.9045 8.5881 120.7667 59.9194 29.8872 178.5529 108 E 3.9891 8.1481 117.2015 58.8387 29.5534 178.5985 109 N 4.2700 8.1220 116.9795 56.7326 39.0691 176.6983 110 L 3.9810 8.1437 120.1856 57.7110 41.7156 179.3511 111 A 3.9663 8.2784 120.9875 55.0942 18.2461 179.4678 112 R 3.8349 8.1465 117.2666 59.8601 29.9026 178.3729 113 D 4.3750 7.9395 117.1211 57.3162 40.9692 178.2729 114 L 4.3311 8.0382 116.8801 54.8423 41.9037 177.9548 115 G 3.9011 7.5777 106.6050 45.7099 0.0000 173.3602 116 I 4.0096 7.6885 120.5825 60.3999 37.7502 175.4802 117 I 4.2883 8.1083 126.1389 59.3175 37.9617 175.5614 118 E 3.9521 8.6927 125.3785 56.8253 29.9785 176.1300 119 A 4.6269 8.8384 125.1605 50.7049 22.6768 176.6882 120 E 3.9800 8.8537 116.9997 59.5365 29.3515 178.5948 121 G 3.8282 8.0617 106.1012 46.5572 0.0000 173.7920 122 T 4.4186 7.8329 109.8633 62.5538 70.5805 177.1493 123 V 3.6827 7.9073 114.4209 63.8456 31.6372 176.8934 124 G 4.0065 8.0881 106.3849 45.6971 0.0000 172.9384 125 G 3.8460 7.5417 107.5331 42.3393 0.0000 170.8407 126 P 3.5164 0.0000 0.0000 61.5987 32.1605 177.3029 127 L 3.8911 9.0325 121.6196 58.3093 41.7820 179.3599 128 L 4.0368 7.9659 118.4499 57.4008 41.3888 178.9919 129 L 3.9462 7.7525 120.6310 58.1707 42.1311 178.6980 130 E 3.9141 8.0536 118.7793 59.0131 29.4420 178.5818 131 V 3.6255 7.5517 117.5025 66.3447 31.9991 177.8922 132 I 4.0011 8.1034 119.6850 64.1786 36.6884 178.2187 133 R 3.9919 8.1618 119.2581 59.1267 29.9034 177.7935 134 R 4.4777 7.6573 114.2799 55.6857 30.3992 176.2376 135 W 4.5475 7.8750 134.5478 57.5068 30.7131 175.7393 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 59 N 8.28 4.69 0.00 2.71 2.76 0.00 0.00 7.08 6.77 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 60 E 8.04 3.86 0.00 2.10 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 2.40 2.37 0.00 61 S 8.19 4.11 0.00 4.02 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 0.00 62 L 8.36 3.97 0.00 1.80 1.88 0.94 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 63 K 8.06 3.93 0.00 1.89 1.95 0.00 1.69 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.45 1.49 7.81 64 K 8.13 4.02 0.00 1.95 1.90 0.00 1.78 0.00 0.00 1.65 0.00 0.00 3.09 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.49 1.72 7.81 65 F 8.22 4.31 0.00 3.22 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 66 L 8.45 4.12 0.00 1.65 1.74 0.95 1.20 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 67 N 7.60 4.65 0.00 2.82 2.92 0.00 0.00 7.05 8.31 0.00 0.00 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 T 6.95 4.54 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 1.17 0.00 0.00 69 K 8.59 3.79 0.00 1.89 1.79 0.00 1.84 0.00 0.00 1.82 0.00 0.00 2.89 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.51 1.11 7.81 70 D 7.97 4.38 0.00 2.60 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 71 G 7.60 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 R 7.86 3.84 0.00 2.06 1.88 0.00 3.09 0.00 0.00 3.07 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.64 0.00 73 L 7.83 3.89 0.00 1.86 1.79 0.92 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 74 V 8.05 3.59 2.48 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 1.14 0.00 0.00 1.07 0.00 0.00 75 A 8.46 4.24 1.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 S 8.50 4.15 0.00 4.04 4.10 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.23 4.01 0.00 1.89 1.73 0.91 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 78 V 8.02 3.55 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 1.01 0.00 0.00 79 A 8.14 3.65 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 80 E 8.49 3.88 0.00 2.16 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 0.00 2.34 2.48 0.00 81 F 8.39 4.14 0.00 3.24 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 82 L 8.09 4.01 0.00 1.82 1.67 0.46 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 83 Q 8.33 3.90 0.00 2.07 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.75 0.00 0.00 0.00 0.00 0.00 2.34 2.59 0.00 84 F 8.29 3.70 0.00 3.00 2.73 0.00 0.00 0.00 0.00 0.00 0.00 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 F 7.36 4.59 0.00 2.76 2.87 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 0.00 0.00 0.00 86 N 7.74 4.08 0.00 2.80 2.79 0.00 0.00 6.88 7.16 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 87 L 7.86 4.42 0.00 1.78 1.67 0.98 1.21 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 88 D 7.60 4.25 0.00 2.21 2.40 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 89 F 7.79 4.37 0.00 3.13 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 T 8.07 3.99 4.46 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 91 L 8.23 4.09 0.00 1.85 1.83 0.93 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 92 A 7.94 4.05 1.49 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 93 V 7.71 3.96 2.19 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 1.06 0.00 0.00 1.07 0.00 0.00 94 F 8.73 4.11 0.00 3.26 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 95 Q 8.72 4.12 0.00 2.22 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.58 0.00 0.00 0.00 0.00 0.00 2.62 2.65 0.00 96 P 0.00 4.28 0.00 2.26 2.31 0.00 3.79 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 2.23 2.08 0.00 97 E 8.24 3.98 0.00 2.12 1.92 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 2.26 2.28 0.00 98 T 7.45 4.17 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 0.33 0.00 0.00 99 S 7.71 3.77 0.00 4.03 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 0.00 100 T 7.94 4.72 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 1.27 0.00 0.00 101 L 8.22 4.12 0.00 1.67 1.80 0.93 1.06 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 0.00 102 Q 8.01 4.09 0.00 2.06 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.56 0.00 0.00 0.00 0.00 0.00 2.37 2.30 0.00 103 G 8.34 4.09 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 0.00 0.00 0.00 104 L 8.04 4.47 0.00 1.74 1.72 1.15 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 105 E 8.53 4.11 0.00 1.95 1.89 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 2.32 2.38 0.00 106 G 8.42 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 0.00 107 R 8.59 3.90 0.00 1.90 1.99 0.00 3.43 0.00 0.00 3.37 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.76 0.00 108 E 8.15 3.99 0.00 2.02 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 2.40 2.31 0.00 109 N 8.12 4.27 0.00 2.75 3.05 0.00 0.00 7.25 6.66 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 0.00 110 L 8.14 3.98 0.00 1.89 1.70 0.97 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 111 A 8.28 3.97 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.15 3.83 0.00 2.02 2.13 0.00 3.11 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.68 0.00 113 D 7.94 4.38 0.00 2.97 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 0.00 114 L 8.04 4.33 0.00 1.62 1.72 0.92 0.81 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 0.00 115 G 7.58 3.90 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 0.00 0.00 0.00 0.00 0.00 0.00 116 I 7.69 4.01 1.87 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.60 0.91 0.00 0.00 117 I 8.11 4.29 1.87 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 1.42 0.54 0.91 0.00 0.00 118 E 8.69 3.95 0.00 1.95 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 2.32 2.32 0.00 119 A 8.84 4.63 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 0.00 120 E 8.85 3.98 0.00 2.09 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 0.00 2.29 2.33 0.00 121 G 8.06 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 0.00 122 T 7.83 4.42 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 1.23 0.00 0.00 123 V 7.91 3.68 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 0.74 0.00 0.00 1.00 0.00 0.00 124 G 8.09 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 0.00 125 G 7.54 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 0.00 126 P 0.00 3.52 0.00 2.25 1.83 0.00 3.43 0.00 0.00 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.25 0.00 127 L 9.03 3.89 0.00 1.80 1.69 0.89 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 128 L 7.97 4.04 0.00 1.79 1.70 0.89 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 129 L 7.75 3.95 0.00 1.79 1.75 0.96 0.83 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 0.00 130 E 8.05 3.91 0.00 2.09 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 0.00 2.37 2.43 0.00 131 V 7.55 3.63 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 0.87 0.00 0.00 0.97 0.00 0.00 132 I 8.10 4.00 1.97 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.00 0.98 0.00 0.00 133 R 8.16 3.99 0.00 1.92 2.15 0.00 3.26 0.00 0.00 3.24 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.71 0.00 134 R 7.66 4.48 0.00 2.02 1.98 0.00 3.22 0.00 0.00 3.18 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.73 0.00 135 W 7.88 4.55 0.00 3.45 3.14 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 0.00