NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 62 M 4.5217 8.2893 120.3570 55.2194 33.4459 175.3022 63 S 4.2670 8.7981 116.5263 58.7913 63.4667 173.7617 64 S 4.2940 8.5950 114.1290 57.7175 64.9491 176.2456 65 G 3.9427 8.7762 106.8871 45.7118 0.0000 172.0980 66 Y 4.5284 8.0872 120.0001 54.4993 41.7818 172.6479 67 P 4.2358 0.0000 0.0000 64.6638 31.7729 176.5631 68 G 4.0965 9.3305 112.1007 44.6578 0.0000 172.1207 69 V 5.2173 7.6197 120.1887 61.2438 33.0557 175.1300 70 S 5.1603 9.4191 121.7519 56.4293 66.9495 172.9682 71 W 4.3699 8.9271 132.7097 57.3135 31.2053 174.9268 72 N 4.4476 8.6234 127.5026 52.1359 38.8387 175.7653 73 K 3.7062 8.5631 126.5977 59.5591 32.5959 178.4770 74 R 3.9738 8.0219 117.1499 59.7233 29.8308 177.3467 75 M 3.9442 8.0257 115.2637 55.8683 32.5860 175.6322 76 C 3.1564 7.0551 117.5899 59.1407 30.4484 171.9591 77 A 4.2033 5.8000 118.6696 50.1120 23.0772 176.6435 78 W 4.9905 8.8628 120.5266 56.4071 30.7997 175.4712 79 L 5.3229 9.4318 124.7259 52.9784 44.1477 175.2577 80 A 5.2165 9.1869 125.9326 50.8662 20.5141 175.7747 81 F 5.1848 9.4711 122.8664 56.3423 40.6260 175.7484 82 F 5.0991 8.6062 117.2369 55.6613 41.7272 172.7740 83 Y 4.6056 8.7702 117.9051 57.2259 39.2636 175.2566 84 D 4.8963 9.3483 124.3817 52.8391 42.5521 177.2600 85 G 3.9285 8.2021 118.4965 46.6752 0.0000 174.7285 86 A 4.2354 8.8555 127.9898 53.5306 19.0826 178.2740 87 S 4.3554 7.9115 113.4405 58.0683 63.1745 173.3063 88 R 4.1088 8.4307 126.7244 56.0337 30.6699 175.4895 89 R 4.6849 8.2421 124.1259 54.4365 35.0386 173.9566 90 S 4.8704 8.1131 113.3422 56.6678 66.2909 173.1906 91 R 4.5656 8.9873 121.9067 54.9141 32.8654 174.2003 92 T 4.6578 8.2365 122.7359 62.6805 70.1576 174.6342 93 F 4.7169 9.4933 124.9560 55.7555 41.1616 173.9571 94 H 4.6517 8.7092 120.3320 54.3616 29.7138 173.7489 95 P 4.4447 0.0000 0.0000 62.8545 31.8283 176.1299 96 K 3.9992 8.8482 121.3833 58.5996 32.5850 176.2432 97 H 4.1849 8.9298 118.5305 56.7470 26.7358 177.0357 98 F 4.2350 8.2321 122.4476 61.5494 39.1577 175.8661 99 N 4.1542 8.2672 115.4442 56.6735 38.3682 176.6503 100 M 3.9657 8.1117 119.2494 59.0804 32.1330 178.6846 101 D 4.3034 8.2176 118.4144 56.8506 40.9080 178.9217 102 K 3.6838 7.9844 120.8743 59.2890 32.1671 178.4964 103 E 3.8667 8.1462 119.6968 59.2914 29.5635 178.9788 104 K 3.9889 8.2925 118.4558 59.3048 32.0606 179.2412 105 A 4.0071 8.0585 121.2324 54.9597 18.2143 179.7112 106 R 3.8338 8.0765 117.4096 59.4215 30.1525 178.7408 107 L 3.9440 8.0124 118.5279 57.8804 41.6936 179.2007 108 A 4.0480 8.0780 120.3786 55.3650 18.2133 179.5958 109 A 4.0806 8.1325 119.1607 55.1400 18.4880 180.1135 110 V 3.5609 8.0616 116.9655 66.0873 31.3999 178.0316 111 E 3.9752 8.4004 117.7480 59.5342 29.4846 178.8914 112 F 4.3007 8.3277 120.5791 61.4057 39.5536 176.6601 113 M 3.8007 8.2234 117.9396 58.7244 31.5716 178.4291 114 K 4.2265 7.9987 119.7629 59.1597 31.9489 179.4375 115 T 3.8920 7.3927 115.5779 65.3644 68.2335 175.3787 116 V 4.1797 6.8039 118.1241 61.3794 32.3270 176.9210 117 E 4.3427 7.5268 121.7365 54.8991 27.7231 173.9941 118 N 4.9727 7.3688 116.6525 51.9407 40.8134 174.7360 119 N 4.6867 8.5128 114.0357 52.5696 38.1211 175.3017 120 G 3.8607 7.5836 108.4743 44.8944 0.0000 173.7911 121 R 4.0646 8.2180 118.2913 56.0305 30.5705 176.8181 122 K 4.4899 8.1207 119.9235 54.5953 34.3449 176.9988 123 K 4.1890 8.4036 118.0900 57.0050 32.0560 177.4074 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 M 8.29 4.52 0.00 2.17 2.09 0.00 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.74 0.00 63 S 8.80 4.27 0.00 4.27 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 64 S 8.60 4.29 0.00 3.75 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 65 G 8.78 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 66 Y 8.09 4.53 0.00 2.88 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 67 P 0.00 4.24 0.00 1.75 1.86 0.00 2.20 0.00 0.00 3.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.86 0.00 68 G 9.33 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 0.00 0.00 0.00 69 V 7.62 5.22 2.33 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 0.87 0.00 0.00 1.05 0.00 0.00 70 S 9.42 5.16 0.00 4.07 4.06 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 71 W 8.93 4.37 0.00 2.60 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 72 N 8.62 4.45 0.00 2.63 2.42 0.00 0.00 6.77 6.70 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 73 K 8.56 3.71 0.00 1.75 1.86 0.00 1.87 0.00 0.00 1.69 0.00 0.00 3.08 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.67 1.53 7.81 74 R 8.02 3.97 0.00 1.70 2.02 0.00 3.20 0.00 0.00 3.19 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.64 0.00 75 M 8.03 3.94 0.00 1.83 1.77 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.37 0.00 76 C 7.06 3.16 0.00 2.87 2.45 0.00 0.00 0.00 0.00 0.00 0.00 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 A 5.80 4.20 0.71 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 78 W 8.86 4.99 0.00 3.55 3.28 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 79 L 9.43 5.32 0.00 1.56 1.23 0.78 0.35 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 80 A 9.19 5.22 1.43 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 0.00 0.00 0.00 0.00 0.00 0.00 81 F 9.47 5.18 0.00 3.05 2.94 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 82 F 8.61 5.10 0.00 3.18 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 83 Y 8.77 4.61 0.00 3.00 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 84 D 9.35 4.90 0.00 2.75 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 85 G 8.20 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 0.00 0.00 0.00 0.00 86 A 8.86 4.24 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 87 S 7.91 4.36 0.00 3.98 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 88 R 8.43 4.11 0.00 1.58 1.69 0.00 3.02 0.00 0.00 3.13 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.85 0.00 89 R 8.24 4.68 0.00 0.67 1.21 0.00 3.05 0.00 0.00 3.07 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.41 0.00 90 S 8.11 4.87 0.00 2.72 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 R 8.99 4.57 0.00 1.98 1.92 0.00 2.78 0.00 0.00 2.95 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.94 0.00 92 T 8.24 4.66 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 1.00 0.00 0.00 93 F 9.49 4.72 0.00 3.16 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 94 H 8.71 4.65 0.00 3.09 3.25 0.00 5.73 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 P 0.00 4.44 0.00 2.46 2.23 0.00 3.57 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 2.22 2.43 0.00 96 K 8.85 4.00 0.00 1.83 1.72 0.00 1.96 0.00 0.00 1.80 0.00 0.00 3.11 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.55 1.49 7.81 97 H 8.93 4.18 0.00 3.39 3.37 0.00 5.63 0.00 0.00 0.00 0.00 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 F 8.23 4.24 0.00 3.33 3.13 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 99 N 8.27 4.15 0.00 2.78 2.84 0.00 0.00 7.06 7.66 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 0.00 100 M 8.11 3.97 0.00 2.05 2.29 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 2.74 2.67 0.00 101 D 8.22 4.30 0.00 2.74 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 0.00 102 K 7.98 3.68 0.00 0.83 1.49 0.00 1.41 0.00 0.00 1.41 0.00 0.00 2.88 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.27 1.23 7.81 103 E 8.15 3.87 0.00 2.11 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 0.00 2.28 2.37 0.00 104 K 8.29 3.99 0.00 1.80 1.82 0.00 1.70 0.00 0.00 1.63 0.00 0.00 2.94 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.44 1.43 7.81 105 A 8.06 4.01 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 0.00 106 R 8.08 3.83 0.00 1.98 2.06 0.00 3.10 0.00 0.00 3.15 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.67 0.00 107 L 8.01 3.94 0.00 1.89 1.70 0.91 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 108 A 8.08 4.05 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 0.00 109 A 8.13 4.08 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.06 3.56 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 1.03 0.00 0.00 1.01 0.00 0.00 111 E 8.40 3.98 0.00 2.23 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 2.36 2.34 0.00 112 F 8.33 4.30 0.00 3.17 3.22 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 0.00 113 M 8.22 3.80 0.00 2.31 2.18 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 2.63 0.00 114 K 8.00 4.23 0.00 1.98 1.80 0.00 1.72 0.00 0.00 1.72 0.00 0.00 2.95 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.43 1.54 7.81 115 T 7.39 3.89 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 1.11 0.00 0.00 116 V 6.80 4.18 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.48 0.00 0.00 0.83 0.00 0.00 117 E 7.53 4.34 0.00 2.14 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 2.23 2.37 0.00 118 N 7.37 4.97 0.00 2.73 2.72 0.00 0.00 6.26 8.04 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 0.00 119 N 8.51 4.69 0.00 2.83 2.94 0.00 0.00 5.98 7.00 0.00 0.00 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 G 7.58 3.86 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 0.00 0.00 0.00 121 R 8.22 4.06 0.00 1.82 1.88 0.00 3.36 0.00 0.00 3.23 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.60 0.00 122 K 8.12 4.49 0.00 1.73 1.78 0.00 1.73 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.38 1.49 7.81 123 K 8.40 4.19 0.00 1.80 1.75 0.00 1.80 0.00 0.00 1.76 0.00 0.00 3.11 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.46 1.45 7.81