NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 24 L 4.2823 8.1693 120.6281 54.1176 43.3871 178.3339 25 S 4.1854 8.8090 119.9657 58.6311 61.2643 174.3954 26 L 4.5712 7.9948 122.8127 54.0277 44.7151 178.3853 27 T 3.9998 8.5103 120.8988 66.3851 68.7411 176.0078 28 G 4.0565 7.9288 108.1472 45.9904 0.0000 173.4121 29 L 4.5311 7.7324 120.6146 56.1985 43.7779 178.7016 30 K 4.0270 7.3764 116.6959 58.7414 32.0304 178.4404 31 R 4.1860 7.7562 115.2073 57.7550 30.1704 177.9894 32 A 4.1463 7.7091 119.3785 54.9867 18.7414 178.0779 33 M 4.1339 9.1600 119.4278 56.2929 31.5760 179.3990 34 L 3.5890 7.5450 117.8879 58.1510 43.3074 180.1514 35 S 4.1029 8.3867 116.1325 61.6906 63.1459 176.4767 36 L 4.3583 7.9459 119.5349 58.1795 40.5990 178.5072 37 I 4.2252 7.2304 117.2707 60.4500 36.6897 175.7568 38 D 4.5504 7.8249 117.1703 53.4166 43.0550 176.8406 39 G 3.8722 8.7331 114.0600 46.4774 0.0000 171.2947 40 R 4.2593 7.9659 118.9503 54.6939 32.0328 175.1263 41 G 3.7854 8.6144 104.4904 44.0992 0.0000 171.7359 42 P 4.2832 0.0000 0.0000 62.9145 32.4628 177.0917 43 T 3.9400 8.7791 113.7755 65.3478 68.4061 176.2951 44 R 3.6814 7.9154 121.1160 58.6674 30.1880 177.9207 45 F 3.8292 8.2781 119.9554 61.3866 39.4809 177.0365 46 V 3.7377 8.1125 117.7660 66.0909 31.3291 178.0132 47 L 4.1488 8.2212 118.5405 57.6269 41.4224 179.1150 48 A 3.3158 8.6623 121.1187 55.0208 18.2440 179.2791 49 L 3.4682 8.1538 118.9707 58.0899 41.9117 178.9660 50 L 3.9010 7.8189 119.8415 57.9720 41.9460 178.5551 51 A 3.5122 8.0880 121.0619 55.1881 18.2292 179.4105 52 F 3.5310 7.8592 119.1051 61.2619 39.2843 177.2089 53 F 4.7403 8.6178 117.3300 59.6973 38.3789 177.0064 54 R 4.1365 7.1219 117.3007 58.0240 30.4587 177.9627 55 F 4.5334 7.8083 117.1953 60.0902 39.4565 176.0462 56 T 3.9237 6.9653 114.1676 63.2115 69.3231 175.7574 57 A 4.3322 8.2779 129.7299 51.5237 17.1136 177.0873 58 I 4.2792 7.4190 121.9715 58.4656 39.8502 176.3578 59 A 4.0216 8.2926 128.4966 50.7268 18.5229 175.6335 60 P 3.4458 0.0000 0.0000 62.2740 32.2630 177.0951 61 T 3.9996 8.1762 110.6040 61.5340 70.7654 175.3151 62 R 3.9995 8.7386 122.7352 59.9625 30.1756 179.0626 63 A 4.2078 8.0374 119.4998 54.9000 18.3599 179.8176 64 V 3.7332 7.6619 116.4729 66.1004 31.9521 177.8117 65 L 4.0936 8.2724 120.4105 58.4340 41.7072 178.4038 66 D 4.5201 8.5525 118.0057 57.7750 40.9723 178.9373 67 R 4.2416 7.9913 119.1395 58.0697 30.1073 178.3285 68 W 4.4867 8.0688 126.9961 60.5227 30.6649 177.4893 69 R 3.9512 7.6026 115.3942 56.9260 29.5862 177.0244 70 S 4.5682 8.1208 113.0073 58.3798 64.8395 174.8743 71 V 3.5739 7.7286 113.7162 61.4913 31.8875 175.6957 72 N 4.2163 8.7830 121.6223 53.6837 39.5342 175.0022 73 K 3.6848 8.7574 129.2186 59.9024 32.2110 177.7930 74 Q 3.9151 8.0319 118.7267 59.7467 29.1261 178.4694 75 T 3.8383 8.1058 116.3001 66.4358 68.4458 176.5700 76 A 4.0501 8.5868 123.1033 55.3769 18.3717 179.4529 77 M 3.9179 8.2962 116.7937 58.5637 32.2364 177.9723 78 K 3.7200 7.9450 119.8924 60.1248 32.2066 178.2311 79 H 3.8924 7.8691 115.4472 58.8682 28.7454 177.6659 80 L 3.8273 7.5883 120.6300 57.9778 41.4488 179.7334 81 L 4.1027 8.0027 118.7194 57.4790 41.5620 179.3184 82 S 4.1803 7.6142 113.4525 60.9051 62.1671 176.1472 83 F 4.5793 8.0033 120.7401 60.7164 38.8699 177.3253 84 K 3.9337 8.2314 118.0988 59.7764 32.0497 179.0873 85 K 3.9910 8.0245 119.3407 59.4751 32.0386 178.7136 86 E 3.9990 8.3544 118.8196 59.5754 29.4495 179.1030 87 L 4.0893 8.3756 119.4140 57.8242 41.5513 179.9084 88 G 3.6454 7.9302 105.1311 48.3787 0.0000 175.8912 89 T 3.8847 7.8100 118.3759 66.0849 68.1430 176.6972 90 L 4.0968 7.4698 119.9943 57.7958 41.9650 179.2312 91 T 3.9476 8.0325 115.9361 66.5018 68.3382 176.3693 92 S 4.0427 8.3374 114.8082 61.6639 62.0475 176.3320 93 A 3.9861 7.8429 122.5171 55.4392 18.0314 179.4716 94 I 3.9554 7.4260 115.3039 63.0974 37.3236 177.4024 95 N 4.5110 7.6823 117.6984 55.2071 38.9106 174.6107 96 R 4.0847 7.4336 119.8343 56.7060 29.4730 176.2551 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 24 L 8.17 4.28 0.00 1.65 0.89 0.92 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 25 S 8.81 4.19 0.00 4.05 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 26 L 7.99 4.57 0.00 1.67 1.58 0.99 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 27 T 8.51 4.00 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 1.21 0.00 0.00 28 G 7.93 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 0.00 0.00 0.00 29 L 7.73 4.53 0.00 1.71 1.67 0.91 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 30 K 7.38 4.03 0.00 1.78 1.85 0.00 1.75 0.00 0.00 2.02 0.00 0.00 3.06 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.54 1.59 7.81 31 R 7.76 4.19 0.00 1.65 1.99 0.00 2.86 0.00 0.00 2.43 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.51 0.00 32 A 7.71 4.15 1.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 M 9.16 4.13 0.00 2.00 2.05 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 2.61 2.78 0.00 34 L 7.55 3.59 0.00 1.86 1.55 0.85 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 35 S 8.39 4.10 0.00 3.84 3.97 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 0.00 0.00 0.00 36 L 7.95 4.36 0.00 2.04 2.12 1.03 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 0.00 0.00 0.00 0.00 0.00 0.00 37 I 7.23 4.23 1.88 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 1.21 0.57 0.92 0.00 0.00 38 D 7.82 4.55 0.00 2.52 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 39 G 8.73 3.87 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 0.00 0.00 0.00 40 R 7.97 4.26 0.00 1.79 1.91 0.00 3.13 0.00 0.00 3.24 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.73 0.00 41 G 8.61 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 42 P 0.00 4.28 0.00 2.31 2.08 0.00 3.45 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 2.09 2.15 0.00 43 T 8.78 3.94 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 1.26 0.00 0.00 44 R 7.92 3.68 0.00 1.50 1.98 0.00 3.37 0.00 0.00 3.38 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.88 0.00 45 F 8.28 3.83 0.00 3.22 3.05 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 0.00 0.00 0.00 46 V 8.11 3.74 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 1.10 0.00 0.00 1.01 0.00 0.00 47 L 8.22 4.15 0.00 2.13 2.03 1.04 1.26 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 48 A 8.66 3.32 0.94 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 49 L 8.15 3.47 0.00 1.80 1.49 0.78 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 50 L 7.82 3.90 0.00 1.97 1.62 0.09 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 51 A 8.09 3.51 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 F 7.86 3.53 0.00 2.74 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 53 F 8.62 4.74 0.00 3.20 2.89 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 0.00 0.00 0.00 54 R 7.12 4.14 0.00 1.78 1.86 0.00 3.05 0.00 0.00 3.10 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.59 0.00 55 F 7.81 4.53 0.00 2.83 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 T 6.97 3.92 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 1.14 0.00 0.00 57 A 8.28 4.33 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 58 I 7.42 4.28 1.97 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.71 0.40 0.00 0.00 59 A 8.29 4.02 nan 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 3.45 0.00 2.21 2.13 0.00 3.63 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.87 0.00 61 T 8.18 4.00 4.35 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 1.24 0.00 0.00 62 R 8.74 4.00 0.00 1.88 2.08 0.00 3.15 0.00 0.00 3.35 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.74 0.00 63 A 8.04 4.21 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 64 V 7.66 3.73 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 1.13 0.00 0.00 65 L 8.27 4.09 0.00 1.92 1.73 1.08 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 66 D 8.55 4.52 0.00 2.91 2.79 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 67 R 7.99 4.24 0.00 2.08 2.08 0.00 3.63 0.00 0.00 3.26 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.75 0.00 68 W 8.07 4.49 0.00 3.41 3.40 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 69 R 7.60 3.95 0.00 2.11 1.92 0.00 3.62 0.00 0.00 3.36 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.67 0.00 70 S 8.12 4.57 0.00 3.94 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 71 V 7.73 3.57 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 0.74 0.00 0.00 0.94 0.00 0.00 72 N 8.78 4.22 0.00 2.77 2.71 0.00 0.00 6.78 6.75 0.00 0.00 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 8.76 3.68 0.00 1.79 1.78 0.00 1.72 0.00 0.00 1.69 0.00 0.00 2.87 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.45 1.43 7.81 74 Q 8.03 3.92 0.00 2.17 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.69 0.00 0.00 0.00 0.00 0.00 2.41 2.49 0.00 75 T 8.11 3.84 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 1.23 0.00 0.00 76 A 8.59 4.05 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 77 M 8.30 3.92 0.00 2.11 2.13 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.58 0.00 78 K 7.94 3.72 0.00 1.78 1.82 0.00 1.51 0.00 0.00 1.43 0.00 0.00 2.86 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.33 1.44 7.81 79 H 7.87 3.89 0.00 3.23 2.76 0.00 5.69 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 L 7.59 3.83 0.00 1.72 1.82 1.15 0.97 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 81 L 8.00 4.10 0.00 1.75 1.69 0.91 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 82 S 7.61 4.18 0.00 3.81 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 83 F 8.00 4.58 0.00 3.36 3.08 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 84 K 8.23 3.93 0.00 2.16 1.95 0.00 1.75 0.00 0.00 1.62 0.00 0.00 2.96 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.53 1.58 7.81 85 K 8.02 3.99 0.00 2.14 1.85 0.00 1.54 0.00 0.00 1.66 0.00 0.00 3.07 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.46 1.55 7.81 86 E 8.35 4.00 0.00 2.33 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 2.45 2.57 0.00 87 L 8.38 4.09 0.00 1.87 1.71 0.91 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 88 G 7.93 3.65 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 0.00 0.00 0.00 89 T 7.81 3.88 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 1.22 0.00 0.00 90 L 7.47 4.10 0.00 1.78 1.70 0.91 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 91 T 8.03 3.95 4.33 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 0.00 0.00 0.00 1.19 0.00 0.00 92 S 8.34 4.04 0.00 4.05 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 93 A 7.84 3.99 1.46 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 0.00 0.00 0.00 94 I 7.43 3.96 1.96 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 1.39 0.56 0.90 0.00 0.00 95 N 7.68 4.51 0.00 2.64 2.83 0.00 0.00 7.16 8.37 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 96 R 7.43 4.08 0.00 2.00 1.90 0.00 3.31 0.00 0.00 3.48 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.72 0.00