NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 L 4.4234 8.0427 120.6337 55.0713 43.9297 178.5696 2 V 3.9150 8.1993 116.3016 65.0254 31.4986 175.8092 3 A 4.1446 8.5130 121.7527 55.1821 19.4868 177.8999 4 Y 4.2867 8.5589 117.1778 58.9840 38.9580 177.4841 5 G 4.9373 7.9427 119.8340 46.8844 0.0000 173.1034 6 I 3.7603 7.4207 121.4110 61.0064 37.8386 175.2435 7 A 4.2827 8.7005 126.3292 52.6214 19.8297 178.7474 8 Q 4.0466 8.7155 121.8058 59.2958 28.3957 179.2577 9 G 3.6179 8.0048 107.2699 47.9659 0.0000 175.6789 10 T 4.1977 7.9329 117.5518 65.5258 68.5282 176.5974 11 A 4.0020 8.0848 123.2994 55.4608 18.2170 179.2229 12 E 3.9563 7.6852 115.4095 59.6848 29.7232 179.8102 13 K 4.1425 7.6077 118.5910 59.5039 32.1721 179.5887 14 V 3.6569 8.3649 118.9048 66.0516 31.5652 178.0264 15 V 3.6197 8.3398 118.4434 66.1998 31.3671 177.8981 16 S 4.1457 7.9605 112.7689 61.4055 62.3168 176.1998 17 L 4.2015 8.0077 121.6617 57.5480 41.2829 179.4353 18 I 3.8776 7.7009 119.7561 64.2732 36.7877 177.7519 19 N 4.3995 7.7130 115.5398 56.4468 38.7362 176.3938 20 A 4.1496 7.6167 120.9277 53.2300 18.4997 178.5108 21 G 3.9240 8.3201 105.2194 45.2503 0.0000 174.0272 22 L 4.1842 7.4777 119.0346 54.5005 42.4746 176.8617 23 T 4.3109 8.1599 111.3043 60.7667 70.0446 175.7638 24 V 3.4611 8.5269 122.0924 65.0505 30.6760 178.3814 25 G 3.7212 7.7041 105.0820 47.9472 0.0000 175.7245 26 S 4.1639 8.0217 115.3120 60.8049 63.3184 176.5402 27 I 3.6985 7.5162 123.6823 64.4824 36.8517 178.3902 28 I 3.6570 7.5245 120.0037 64.2832 36.6672 178.1197 29 S 4.0686 7.5242 113.5347 61.6476 62.2011 176.1033 30 I 3.9348 7.4048 120.9177 63.9551 36.9399 177.9477 31 L 4.0943 7.8412 119.0665 55.7500 42.7018 177.3292 32 G 3.7578 7.9202 105.1135 44.9239 0.0000 171.4489 33 G 3.8787 6.9729 104.8776 45.5752 0.0000 173.2399 34 V 3.9799 8.2257 112.5430 60.9779 30.0708 176.8967 35 T 4.2233 7.4745 108.3145 61.5819 69.5977 174.8854 36 V 3.7908 7.7962 115.9138 63.4826 31.1975 175.7636 37 G 4.6361 8.3396 123.9539 45.7045 0.0000 173.6580 38 L 4.1874 7.0150 121.3271 57.9042 40.1688 179.1498 39 S 4.4566 8.2742 116.1801 61.5360 62.4403 176.4936 40 G 3.7276 8.0241 107.6269 46.8821 0.0000 175.2561 41 V 4.0858 7.3361 112.8927 62.1175 32.8207 177.7101 42 F 3.8224 8.5511 121.2527 61.3730 38.9178 177.2238 43 T 3.9041 7.4804 112.9781 66.7017 68.3195 176.2236 44 A 4.0842 7.8931 122.1184 54.9869 18.5347 179.6578 45 V 3.2718 7.5514 117.0206 65.6422 31.3439 177.9066 46 K 3.6930 7.6939 118.9045 59.7584 32.0372 178.6117 47 A 3.9534 7.5725 120.0004 54.8671 18.1251 179.2953 48 A 3.9229 7.7383 119.3033 55.3540 18.3371 179.6837 49 I 3.6162 7.4423 118.0543 64.7783 37.0711 178.6426 50 A 4.1220 7.8423 119.2759 54.6877 18.2959 179.0085 51 K 4.1217 7.8478 117.8670 59.6328 32.3197 176.5287 52 Q 4.3271 8.5102 116.2140 54.1779 32.3733 174.8413 53 G 4.1189 7.4140 105.7382 44.7538 0.0000 173.5370 54 I 3.6581 7.9543 115.5670 63.8307 37.2217 178.3408 55 K 3.8789 8.0584 119.8246 60.0543 32.3574 179.0322 56 K 3.9354 8.0900 119.5564 58.9461 31.7823 179.0086 57 A 4.0450 7.7495 120.6012 55.1118 18.1402 179.5443 58 I 3.6241 7.5162 118.0439 64.9807 37.2862 178.5259 59 Q 4.0399 7.7252 117.1591 58.8251 28.4338 177.1048 60 L 4.1827 7.6634 124.3103 55.0175 41.6619 176.6919 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 1 L 8.04 4.42 0.00 1.90 1.84 0.79 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 2 V 8.20 3.91 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 1.06 0.00 0.00 0.96 0.00 0.00 3 A 8.51 4.14 1.35 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 0.00 0.00 4 Y 8.56 4.29 0.00 2.93 3.26 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 0.00 0.00 0.00 0.00 5 G 7.94 4.94 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 6 I 7.42 3.76 2.01 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.39 1.00 0.00 0.00 7 A 8.70 4.28 1.30 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 0.00 0.00 0.00 8 Q 8.72 4.05 0.00 2.30 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.86 0.00 0.00 0.00 0.00 0.00 2.42 2.43 0.00 9 G 8.00 3.62 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 0.00 0.00 0.00 10 T 7.93 4.20 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 1.24 0.00 0.00 11 A 8.08 4.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 E 7.69 3.96 0.00 1.94 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 0.00 2.36 2.60 0.00 13 K 7.61 4.14 0.00 2.17 1.87 0.00 1.68 0.00 0.00 1.58 0.00 0.00 2.93 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.47 1.46 7.81 14 V 8.36 3.66 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 1.28 0.00 0.00 1.02 0.00 0.00 15 V 8.34 3.62 2.25 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 1.00 0.00 0.00 0.93 0.00 0.00 16 S 7.96 4.15 0.00 3.89 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 L 8.01 4.20 0.00 1.98 1.75 0.93 0.81 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 18 I 7.70 3.88 2.02 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.12 0.91 0.00 0.00 19 N 7.71 4.40 0.00 2.77 2.97 0.00 0.00 7.21 7.85 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 20 A 7.62 4.15 1.39 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 0.00 0.00 0.00 0.00 0.00 0.00 21 G 8.32 3.92 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 0.00 0.00 0.00 22 L 7.48 4.18 0.00 1.65 1.62 0.93 0.89 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 23 T 8.16 4.31 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 24 V 8.53 3.46 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 0.82 0.00 0.00 0.69 0.00 0.00 25 G 7.70 3.72 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 0.00 0.00 0.00 26 S 8.02 4.16 0.00 4.02 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 27 I 7.52 3.70 1.52 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 1.50 0.21 0.44 0.00 0.00 28 I 7.52 3.66 1.80 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.42 0.87 0.00 0.00 29 S 7.52 4.07 0.00 3.95 3.98 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 0.00 0.00 0.00 30 I 7.40 3.93 1.96 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.77 0.90 0.00 0.00 31 L 7.84 4.09 0.00 1.79 1.71 0.92 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 32 G 7.92 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 6.97 3.88 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 0.00 0.00 0.00 0.00 0.00 0.00 34 V 8.23 3.98 2.08 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 0.75 0.00 0.00 0.93 0.00 0.00 35 T 7.47 4.22 4.24 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 1.21 0.00 0.00 36 V 7.80 3.79 2.08 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 0.69 0.00 0.00 0.93 0.00 0.00 37 G 8.34 4.64 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 0.00 0.00 0.00 38 L 7.02 4.19 0.00 2.17 2.14 1.01 0.92 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 39 S 8.27 4.46 0.00 3.88 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 40 G 8.02 3.73 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 0.00 0.00 0.00 41 V 7.34 4.09 1.64 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 0.45 0.00 0.00 0.07 0.00 0.00 42 F 8.55 3.82 0.00 3.22 3.01 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 43 T 7.48 3.90 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 44 A 7.89 4.08 1.26 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 0.00 0.00 0.00 0.00 0.00 0.00 45 V 7.55 3.27 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 0.80 0.00 0.00 0.74 0.00 0.00 46 K 7.69 3.69 0.00 1.82 1.90 0.00 1.72 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.43 1.47 7.81 47 A 7.57 3.95 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 48 A 7.74 3.92 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 49 I 7.44 3.62 1.96 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.23 0.92 0.00 0.00 50 A 7.84 4.12 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 51 K 7.85 4.12 0.00 1.90 1.98 0.00 1.62 0.00 0.00 1.69 0.00 0.00 3.09 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.43 1.50 7.81 52 Q 8.51 4.33 0.00 2.09 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.67 0.00 0.00 0.00 0.00 0.00 2.27 2.41 0.00 53 G 7.41 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 54 I 7.95 3.66 1.85 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.63 0.89 0.00 0.00 55 K 8.06 3.88 0.00 1.99 2.11 0.00 1.50 0.00 0.00 1.81 0.00 0.00 2.96 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.48 1.53 7.81 56 K 8.09 3.94 0.00 1.98 1.88 0.00 1.68 0.00 0.00 1.64 0.00 0.00 2.95 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.45 1.59 7.81 57 A 7.75 4.04 1.31 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 0.00 0.00 0.00 0.00 0.00 0.00 58 I 7.52 3.62 1.98 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 1.78 0.95 0.92 0.00 0.00 59 Q 7.73 4.04 0.00 2.29 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.97 0.00 0.00 0.00 0.00 0.00 2.39 2.41 0.00 60 L 7.66 4.18 0.00 1.72 1.56 0.90 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00