NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 66 I 4.0285 8.0131 120.7872 61.9266 39.0308 174.6172 67 G 3.7914 8.7533 113.8593 43.2466 0.0000 171.4347 68 P 4.6885 0.0000 0.0000 61.2191 34.3408 172.7992 69 K 4.5131 8.1675 117.3616 54.6415 33.7537 176.5256 70 R 4.0205 8.8345 124.9843 58.8698 30.8386 177.0833 71 G 4.1858 7.5355 102.8687 44.1234 0.0000 171.8849 72 A 4.0611 8.0817 123.5905 52.7558 19.2974 178.2171 73 K 5.2225 6.9444 125.8788 56.9986 33.6632 174.1891 74 V 4.4288 7.4733 117.4421 58.8666 34.5771 175.9743 75 K 4.1676 8.7812 126.4393 56.5476 33.1624 175.6273 76 I 4.3534 7.7334 123.6188 58.7347 39.8406 176.4136 77 L 4.0377 7.6232 126.2565 53.5934 42.0328 175.7611 78 R 4.1373 7.8248 116.8981 56.7509 30.7231 178.3879 79 K 3.9050 8.9521 116.8396 56.2292 30.7177 176.0201 80 E 4.2550 8.0749 115.2681 58.6523 30.4627 177.1405 81 S 4.3167 8.1962 114.8270 58.0956 63.1954 173.7548 82 Y 4.3651 9.0699 129.0163 60.8783 39.2028 177.3820 83 W 4.7083 10.0805 119.3957 58.5611 30.7871 178.0389 84 Y 3.4594 7.8021 117.8064 58.3592 39.1863 172.1683 85 K 3.7980 9.5822 113.3029 59.0442 32.0467 177.5212 86 G 3.7141 7.7616 106.7294 46.2661 0.0000 172.4575 87 T 4.5831 8.3174 114.4634 59.8240 71.5714 172.4978 88 G 4.1484 8.2505 114.2701 45.4090 0.0000 174.1072 89 S 4.8340 9.7545 121.2247 56.1220 64.1745 172.6088 90 V 4.3273 8.3895 127.0752 62.7894 33.1941 173.9135 91 V 4.3021 8.3729 121.1138 61.4290 34.8946 171.4401 92 A 4.0377 7.9659 127.2415 51.9046 18.0449 178.2789 93 V 3.7272 8.4750 122.2959 61.1647 32.4111 177.1541 94 D 4.5361 8.6465 123.1797 54.8968 41.1926 176.0243 95 Q 4.5629 8.4600 118.9370 56.2229 29.1250 175.3491 96 D 4.8111 7.7585 118.3248 53.1130 42.7514 174.9691 97 P 4.4236 0.0000 0.0000 65.3707 31.7002 178.2455 98 N 4.4978 8.3482 115.1071 55.6727 37.8100 174.3611 99 T 4.8301 7.5328 116.7605 61.9634 70.1762 173.8968 100 R 4.4682 8.3878 116.7972 56.5710 31.4165 175.1504 101 Y 5.0373 7.3617 115.9933 56.4324 38.9601 175.1900 102 P 4.4687 0.0000 0.0000 62.2685 31.1311 179.2180 103 V 3.0355 8.4794 117.8873 63.2384 29.9257 173.9123 104 V 3.9720 8.0749 127.0076 63.0443 31.1902 175.1470 105 V 4.9285 8.5831 116.7859 60.1336 36.4904 174.3554 106 R 5.1758 12.0000 117.4634 54.9944 32.9269 173.8137 107 F 5.2432 8.8017 121.9943 56.6999 42.3276 174.0250 108 N 4.0882 6.8806 120.0820 55.1103 37.4494 176.2108 109 K 3.8334 7.0629 118.0208 56.5504 34.1614 174.0566 110 V 3.1940 8.5505 125.0086 63.0459 29.4879 177.4265 111 N 2.0000 7.9778 115.7681 52.5578 41.9326 172.1730 112 Y 4.0942 8.1294 115.5700 59.6496 38.1233 175.6847 113 A 4.8259 7.5864 121.4165 49.8496 21.8164 176.2885 114 N 4.3773 8.8715 116.7250 55.8585 38.6667 176.0817 115 V 4.3016 7.6614 116.7179 60.7447 33.1587 174.6464 116 S 4.8193 8.6104 121.3029 56.6846 65.1188 173.3375 117 T 5.1127 8.6522 114.7403 59.7409 71.5767 172.4002 118 N 5.2061 8.5739 120.3644 51.6943 43.0262 172.1468 119 N 5.4842 9.3372 121.3666 51.4939 39.3044 173.5468 120 Y 4.8199 9.7791 119.2566 56.3667 42.4840 173.6481 121 A 4.8639 8.4909 121.4298 49.8177 22.3241 176.1538 122 L 4.0368 8.5563 119.5942 58.0410 42.4330 177.0597 123 D 4.6655 7.9678 117.4861 54.6934 41.0931 176.2549 124 E 4.2096 8.7679 121.5222 57.1091 30.0061 176.4229 125 I 4.3284 8.5535 114.8108 58.8573 39.0643 175.3395 126 V 4.2645 8.1325 118.4858 60.1300 33.9957 175.8056 127 E 3.3157 9.3499 125.6833 59.0898 27.6823 176.8536 128 V 3.5562 8.2857 121.9484 64.3001 31.4970 170.5384 129 E 4.0825 8.5758 122.2739 56.7272 30.4823 174.5499 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 66 I 8.01 4.03 1.88 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 1.35 1.35 0.91 0.00 0.00 67 G 8.75 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.69 0.00 2.18 2.08 0.00 3.63 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.97 0.00 69 K 8.17 4.51 0.00 1.72 1.76 0.00 1.63 0.00 0.00 1.63 0.00 0.00 3.06 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.34 1.44 7.81 70 R 8.83 4.02 0.00 1.78 1.95 0.00 3.19 0.00 0.00 3.24 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.64 0.00 71 G 7.54 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 0.00 0.00 0.00 0.00 72 A 8.08 4.06 1.29 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 0.00 0.00 0.00 0.00 0.00 0.00 73 K 6.94 5.22 0.00 1.98 1.92 0.00 1.51 0.00 0.00 1.70 0.00 0.00 2.95 0.00 0.00 2.67 0.00 0.00 0.00 0.00 1.16 1.17 7.81 74 V 7.47 4.43 2.03 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 0.65 0.00 0.00 0.90 0.00 0.00 75 K 8.78 4.17 0.00 1.69 1.62 0.00 1.62 0.00 0.00 1.63 0.00 0.00 2.89 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.24 1.56 7.81 76 I 7.73 4.35 1.95 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.14 0.26 0.65 0.00 0.00 77 L 7.62 4.04 0.00 1.30 1.38 0.85 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 78 R 7.82 4.14 0.00 2.48 2.12 0.00 3.33 0.00 0.00 3.20 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.79 0.00 79 K 8.95 3.90 0.00 2.25 2.08 0.00 1.79 0.00 0.00 1.66 0.00 0.00 3.12 0.00 0.00 3.27 0.00 0.00 0.00 0.00 0.74 0.80 7.81 80 E 8.07 4.25 0.00 2.16 2.10 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 2.33 2.25 0.00 81 S 8.20 4.32 0.00 4.16 3.99 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 82 Y 9.07 4.37 0.00 3.53 4.28 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 83 W 10.08 4.71 0.00 3.32 3.12 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 84 Y 7.80 3.46 0.00 3.29 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 0.00 0.00 0.00 85 K 9.58 3.80 0.00 1.89 1.86 0.00 1.92 0.00 0.00 1.83 0.00 0.00 3.06 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.29 1.84 7.81 86 G 7.76 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 0.00 0.00 0.00 87 T 8.32 4.58 4.16 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 1.23 0.00 0.00 88 G 8.25 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 9.75 4.83 0.00 3.90 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 90 V 8.39 4.33 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 0.97 0.00 0.00 91 V 8.37 4.30 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 0.84 0.00 0.00 0.98 0.00 0.00 92 A 7.97 4.04 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 93 V 8.47 3.73 2.10 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 0.73 0.00 0.00 0.96 0.00 0.00 94 D 8.65 4.54 0.00 2.71 2.66 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 0.00 0.00 0.00 0.00 95 Q 8.46 4.56 0.00 2.14 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.86 0.00 0.00 0.00 0.00 0.00 2.24 2.30 0.00 96 D 7.76 4.81 0.00 2.67 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 P 0.00 4.42 0.00 2.03 2.10 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 2.02 2.06 0.00 98 N 8.35 4.50 0.00 2.82 2.94 0.00 0.00 5.87 7.71 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 99 T 7.53 4.83 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 1.13 0.00 0.00 100 R 8.39 4.47 0.00 1.62 1.82 0.00 2.81 0.00 0.00 3.07 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.95 0.00 101 Y 7.36 5.04 0.00 2.92 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 0.00 102 P 0.00 4.47 0.00 2.07 1.93 0.00 3.72 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.24 0.00 103 V 8.48 3.04 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 0.88 0.00 0.00 0.99 0.00 0.00 104 V 8.07 3.97 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 0.86 0.00 0.00 0.97 0.00 0.00 105 V 8.58 4.93 2.28 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 0.78 0.00 0.00 1.01 0.00 0.00 106 R 12.00 5.18 0.00 1.98 2.09 0.00 2.84 0.00 0.00 3.16 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.69 0.00 107 F 8.80 5.24 0.00 2.95 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 0.00 108 N 6.88 4.09 0.00 2.47 2.47 0.00 0.00 6.08 7.13 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 0.00 109 K 7.06 3.83 0.00 1.78 1.88 0.00 2.09 0.00 0.00 1.77 0.00 0.00 2.79 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.80 2.41 7.81 110 V 8.55 3.19 1.77 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 0.54 0.00 0.00 0.74 0.00 0.00 111 N 7.98 2.00 0.00 1.63 1.92 0.00 0.00 6.92 7.54 0.00 0.00 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 Y 8.13 4.09 0.00 3.23 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 0.00 113 A 7.59 4.83 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 0.00 114 N 8.87 4.38 0.00 2.70 2.89 0.00 0.00 6.69 7.68 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 0.00 115 V 7.66 4.30 2.10 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 0.87 0.00 0.00 0.93 0.00 0.00 116 S 8.61 4.82 0.00 4.69 4.08 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.65 5.11 4.59 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 1.32 0.00 0.00 118 N 8.57 5.21 0.00 2.56 2.36 0.00 0.00 6.52 6.59 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 0.00 119 N 9.34 5.48 0.00 2.89 2.76 0.00 0.00 6.69 7.43 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 0.00 120 Y 9.78 4.82 0.00 2.61 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 0.00 121 A 8.49 4.86 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 0.00 122 L 8.56 4.04 0.00 1.75 1.68 0.93 1.17 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 0.00 123 D 7.97 4.67 0.00 2.73 2.62 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.77 4.21 0.00 1.95 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 2.32 2.24 0.00 125 I 8.55 4.33 1.84 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 1.43 0.60 0.80 0.00 0.00 126 V 8.13 4.26 2.03 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 0.74 0.00 0.00 0.85 0.00 0.00 127 E 9.35 3.32 0.00 1.95 1.94 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 2.12 2.24 0.00 128 V 8.29 3.56 2.06 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 0.69 0.00 0.00 0.93 0.00 0.00 129 E 8.58 4.08 0.00 2.01 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.33 0.00