NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 34 S 4.3504 8.1933 115.4042 57.9765 65.2994 174.4853 35 S 3.8673 7.6737 117.1347 57.7375 63.0885 174.5254 36 G 3.6615 7.6768 112.8083 48.1153 0.0000 175.6237 37 R 4.1407 7.6506 114.4094 57.4791 29.9323 176.8936 38 F 5.2095 8.2147 117.6442 56.9134 40.6244 177.0219 39 G 3.7149 7.5317 109.6024 47.2184 0.0000 174.1867 40 A 4.5326 8.6514 127.0608 52.0010 18.9273 177.0085 41 R 4.2097 7.4965 117.5358 57.0761 32.1038 176.0491 42 Y 3.9900 7.9342 117.0970 57.0713 36.7693 171.3726 43 G 4.0511 8.0985 103.0280 45.4857 0.0000 172.7626 44 R 3.6254 7.9119 113.8927 59.5498 29.8031 178.8809 45 V 3.5484 7.8618 117.5401 66.7819 31.8205 178.4073 46 S 4.1138 8.1398 114.0491 61.8450 62.8830 176.8552 47 R 4.3057 7.9192 117.9424 58.5121 29.5247 178.7183 48 R 3.9262 8.4802 120.7044 59.6182 30.1758 178.5723 49 R 4.0107 8.3217 118.0573 58.9483 29.9177 179.2379 50 V 3.5736 7.7448 118.2746 65.6990 31.5145 177.9903 51 A 4.5044 7.8097 121.4651 54.6754 18.3219 179.5144 52 E 3.9042 8.0645 116.7158 59.7239 29.6034 179.6673 53 I 3.7339 7.7493 119.7591 64.5181 37.1677 178.3846 54 E 4.0965 8.4808 119.4396 58.8324 29.0487 179.3402 55 S 4.0752 8.0033 112.9546 61.4489 62.4872 175.5386 56 E 4.3806 8.1150 123.2123 58.8428 29.1164 178.3857 57 M 4.5657 7.9229 119.0963 58.2015 32.5032 177.4029 58 N 4.7031 8.2117 113.9521 53.5690 39.4778 175.3377 59 E 4.1073 7.3106 120.5071 56.1833 30.2307 175.5334 60 D 4.4768 8.3825 120.7262 54.6075 41.5753 175.6428 61 H 5.0484 8.7188 120.3376 53.6240 31.8825 173.6841 62 A 4.6653 8.5514 124.5418 51.8265 18.7805 176.8465 63 C 4.2580 9.0129 124.9796 59.0380 31.6695 172.2874 64 P 4.2298 0.0000 0.0000 65.5313 30.9551 177.1950 65 N 4.1043 7.6157 116.2367 55.6900 40.1993 175.7865 66 C 4.8101 7.4182 117.7203 57.8873 28.5344 175.2262 67 G 4.1374 8.4684 105.0020 45.2000 0.0000 171.7254 68 E 4.0341 7.9779 120.1496 55.6243 30.6698 176.7997 69 D 5.3799 8.0498 123.9531 52.8623 38.8339 176.4151 70 R 4.7689 7.5797 113.9434 55.8681 32.8851 176.3285 71 V 4.8126 8.1908 119.1285 62.2320 32.6725 174.7050 72 D 5.3571 9.0460 126.7737 52.2801 44.9829 175.5800 73 R 3.3868 8.6108 120.6491 56.1161 30.7129 176.1618 74 Q 4.3807 7.6203 121.3316 56.2289 31.2218 175.9717 75 G 3.7160 6.5831 103.4398 45.9494 0.0000 172.1821 76 T 3.8687 8.4659 119.1603 65.2073 67.7760 174.8394 77 G 4.3667 8.6112 115.5534 45.8800 0.0000 171.1568 78 I 4.4964 6.7231 120.4083 59.2713 39.5133 174.8969 79 W 5.2104 8.5092 125.0418 55.1691 33.7630 174.0722 80 Q 5.7492 8.7844 121.6907 55.7653 32.7678 172.7045 81 C 5.1701 9.0782 127.2067 58.6642 32.2456 174.4791 82 S 4.1708 9.0953 122.1409 61.2640 62.3111 174.4194 83 Y 4.3422 7.5549 122.6493 59.2115 39.0282 175.3643 84 C 4.0805 7.9817 116.5399 58.0005 30.8582 173.9548 85 D 4.5870 8.4052 119.4399 55.2160 38.3592 173.3019 86 Y 4.5232 8.0241 121.4077 57.6742 39.4477 174.0978 87 K 5.0127 8.5780 129.4362 55.2129 33.2250 175.4260 88 F 5.0244 8.9518 122.3167 55.3425 41.9686 173.4689 89 T 4.6787 8.6135 109.7545 61.5947 69.9705 174.7236 90 G 4.1077 8.1789 109.8787 45.9950 0.0000 172.3518 91 G 4.3785 8.5845 108.8019 44.8157 0.0000 174.5238 92 S 3.9519 8.4624 113.5933 60.3937 62.1074 174.2948 93 Y 5.0618 7.8604 115.3143 57.2980 40.6139 175.1603 94 K 4.6276 7.9461 118.4018 53.6062 34.7468 175.1394 95 P 2.9700 0.0000 0.0000 63.8512 31.6480 175.8743 96 E 4.7307 7.4984 118.3121 54.7927 33.0092 174.7188 97 T 4.5779 8.1909 113.6091 59.4019 70.7765 173.7977 98 P 4.3616 0.0000 0.0000 65.9501 31.1037 179.2782 99 G 3.5275 7.7478 103.7604 47.6022 0.0000 176.1475 100 G 3.6500 8.0798 108.1133 47.4236 0.0000 175.6566 101 K 4.1763 7.4513 118.6116 58.4238 31.7734 178.9480 102 T 4.1329 7.6119 116.9503 65.9551 68.2290 176.6776 103 V 3.5993 7.3706 119.9935 66.1716 31.1986 178.0834 104 R 3.9563 7.9528 115.1601 59.5257 30.0363 178.2259 105 R 3.9992 7.3562 114.8238 58.4216 30.3853 176.9709 106 S 4.3693 7.5965 115.9064 58.2150 63.0436 173.7310 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 34 S 8.19 4.35 0.00 3.94 4.14 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 35 S 7.67 3.87 0.00 4.01 4.04 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 0.00 0.00 0.00 36 G 7.68 3.66 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 0.00 0.00 0.00 37 R 7.65 4.14 0.00 1.85 1.94 0.00 2.83 0.00 0.00 3.04 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.95 0.00 38 F 8.21 5.21 0.00 3.44 3.35 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 39 G 7.53 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 40 A 8.65 4.53 1.25 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 0.00 0.00 41 R 7.50 4.21 0.00 1.14 0.66 0.00 2.85 0.00 0.00 3.08 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.38 0.00 42 Y 7.93 3.99 0.00 3.04 2.99 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 43 G 8.10 4.05 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 0.00 0.00 0.00 44 R 7.91 3.63 0.00 1.88 1.91 0.00 3.18 0.00 0.00 3.28 8.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.75 0.00 45 V 7.86 3.55 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 1.16 0.00 0.00 0.94 0.00 0.00 46 S 8.14 4.11 0.00 3.91 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 R 7.92 4.31 0.00 2.32 2.54 0.00 2.98 0.00 0.00 3.48 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.74 0.00 48 R 8.48 3.93 0.00 1.96 2.19 0.00 3.11 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.68 0.00 49 R 8.32 4.01 0.00 1.96 1.95 0.00 3.18 0.00 0.00 3.10 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.73 0.00 50 V 7.74 3.57 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 1.15 0.00 0.00 1.08 0.00 0.00 51 A 7.81 4.50 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 52 E 8.06 3.90 0.00 2.07 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.59 0.00 53 I 7.75 3.73 1.80 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.65 0.61 0.00 0.00 54 E 8.48 4.10 0.00 2.02 1.97 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 2.25 2.50 0.00 55 S 8.00 4.08 0.00 4.00 4.04 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 0.00 0.00 0.00 56 E 8.11 4.38 0.00 2.15 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 2.38 2.23 0.00 57 M 7.92 4.57 0.00 2.33 2.41 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.92 2.57 0.00 58 N 8.21 4.70 0.00 2.83 2.88 0.00 0.00 7.09 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 E 7.31 4.11 0.00 2.03 1.78 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 2.33 2.58 0.00 60 D 8.38 4.48 0.00 2.54 2.70 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 0.00 0.00 0.00 0.00 61 H 8.72 5.05 0.00 3.10 3.12 0.00 5.62 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 62 A 8.55 4.67 1.25 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 0.00 0.00 63 C 9.01 4.26 0.00 3.09 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 P 0.00 4.23 0.00 1.89 1.92 0.00 3.53 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 1.84 0.00 65 N 7.62 4.10 0.00 2.26 2.67 0.00 0.00 6.92 7.65 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 66 C 7.42 4.81 0.00 3.24 2.65 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 67 G 8.47 4.14 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 0.00 0.00 0.00 68 E 7.98 4.03 0.00 1.85 1.78 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 1.86 2.18 0.00 69 D 8.05 5.38 0.00 2.55 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 70 R 7.58 4.77 0.00 1.83 1.98 0.00 3.21 0.00 0.00 3.46 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.58 0.00 71 V 8.19 4.81 2.31 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 1.16 0.00 0.00 1.21 0.00 0.00 72 D 9.05 5.36 0.00 2.68 2.56 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 73 R 8.61 3.39 0.00 1.18 1.51 0.00 2.99 0.00 0.00 3.03 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.50 0.00 74 Q 7.62 4.38 0.00 1.78 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.51 0.00 0.00 0.00 0.00 0.00 2.13 2.30 0.00 75 G 6.58 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 76 T 8.47 3.87 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 1.08 0.00 0.00 77 G 8.61 4.37 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 0.00 78 I 6.72 4.50 1.59 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.61 0.73 0.00 0.00 79 W 8.51 5.21 0.00 1.78 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 80 Q 8.78 5.75 0.00 2.10 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.95 0.00 0.00 0.00 0.00 0.00 2.34 2.24 0.00 81 C 9.08 5.17 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 82 S 9.10 4.17 0.00 4.10 4.07 0.00 0.00 0.00 0.00 0.00 0.00 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 7.55 4.34 0.00 2.92 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 C 7.98 4.08 0.00 3.05 2.95 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 85 D 8.41 4.59 0.00 2.91 2.91 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 86 Y 8.02 4.52 0.00 3.05 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 87 K 8.58 5.01 0.00 1.81 1.68 0.00 1.77 0.00 0.00 1.73 0.00 0.00 2.88 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.30 1.36 7.81 88 F 8.95 5.02 0.00 2.95 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 0.00 0.00 0.00 0.00 89 T 8.61 4.68 4.27 0.00 0.00 0.00 0.00 0.00 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 90 G 8.18 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 0.00 0.00 0.00 91 G 8.58 4.38 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 0.00 92 S 8.46 3.95 0.00 3.53 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 Y 7.86 5.06 0.00 3.16 2.98 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 94 K 7.95 4.63 0.00 1.79 1.56 0.00 1.74 0.00 0.00 1.93 0.00 0.00 3.04 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.59 1.48 7.81 95 P 0.00 2.97 0.00 1.72 0.60 0.00 3.07 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.21 0.00 96 E 7.50 4.73 0.00 1.82 1.80 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 2.18 2.21 0.00 97 T 8.19 4.58 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 98 P 0.00 4.36 0.00 2.18 2.16 0.00 3.60 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.17 0.00 99 G 7.75 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 G 8.08 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 0.00 101 K 7.45 4.18 0.00 1.87 1.88 0.00 1.69 0.00 0.00 1.69 0.00 0.00 3.14 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.59 1.63 7.81 102 T 7.61 4.13 4.37 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 1.21 0.00 0.00 103 V 7.37 3.60 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.97 0.00 0.00 104 R 7.95 3.96 0.00 1.83 1.98 0.00 3.29 0.00 0.00 3.22 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.67 0.00 105 R 7.36 4.00 0.00 1.99 2.03 0.00 3.11 0.00 0.00 3.27 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.60 0.00 106 S 7.60 4.37 0.00 3.95 3.80 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