NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 101 M 4.3588 8.1627 120.6117 55.4394 34.0509 173.7189 102 L 4.8712 8.6377 128.5537 51.6877 42.9572 173.8549 103 I 5.1637 9.2262 121.5221 58.6684 41.1835 174.1094 104 K 5.2028 8.5565 120.9285 54.4571 35.7838 175.8932 105 V 4.8070 8.6491 123.3233 59.7432 34.4724 174.2429 106 K 4.6279 9.2990 127.7781 55.2923 33.6304 176.1838 107 T 4.4131 8.5166 122.0839 61.3204 69.0239 174.0918 108 L 4.3303 8.3985 122.4520 55.8463 41.6076 176.6927 109 T 4.5740 7.3170 104.0139 60.6644 69.6397 173.5892 110 G 3.9245 8.4347 109.0756 47.0555 0.0000 176.2228 111 K 3.7728 8.3694 121.4458 58.6747 32.4336 173.1015 112 E 3.7283 8.3007 128.5166 55.6525 27.4469 172.6387 113 I 4.5883 8.3452 119.4902 58.9102 40.8568 174.0596 114 E 4.9488 8.5913 124.1612 55.1618 31.1533 175.1334 115 I 4.7447 9.2650 126.5678 59.7442 42.0676 173.7157 116 D 5.3133 8.6587 125.1259 53.2349 41.8568 176.0073 117 I 4.7293 8.6784 123.6472 59.7931 41.7868 174.2367 118 E 4.7235 9.2932 124.7911 53.9068 31.6027 175.8542 119 P 3.7982 0.0000 0.0000 65.2346 31.8252 177.4729 120 T 4.1522 7.6315 111.0275 63.0634 67.9811 174.5367 121 D 4.5630 8.7048 122.6214 54.2506 41.7011 175.9030 122 K 4.7271 8.2664 120.9973 55.6094 33.6921 178.2323 123 V 3.5800 8.9718 121.6144 66.3031 31.4411 177.8962 124 E 3.8961 7.9580 118.8660 59.7512 29.2798 179.1079 125 R 4.0320 8.0569 118.2360 59.2898 30.2730 178.1746 126 I 3.6567 7.7754 119.2136 64.6099 36.9309 178.2950 127 K 4.2528 7.9083 120.0383 58.8370 31.8647 179.2863 128 E 3.9669 7.7522 117.7880 59.2609 29.3343 179.5372 129 R 3.8743 8.1688 118.2833 59.1827 30.0837 179.0992 130 V 3.5314 7.6026 117.6489 65.9940 31.4391 177.3618 131 E 4.1463 8.3943 119.1635 59.5701 29.2594 178.0972 132 E 3.7362 8.3107 118.0448 59.5092 29.6083 178.6724 133 K 4.2078 7.8576 116.7090 58.3232 32.6696 178.1405 134 E 4.5679 8.9829 116.8219 55.2216 30.6046 176.8920 135 G 3.7578 8.7766 107.8017 46.0855 0.0000 173.4691 136 I 4.1278 7.5702 120.6050 58.6713 37.3502 174.1107 137 P 4.3888 0.0000 0.0000 62.4681 31.8600 176.0015 138 P 4.3528 0.0000 0.0000 65.3622 31.6579 178.5720 139 Q 3.9973 8.2472 116.8592 58.5025 28.6578 177.1735 140 Q 4.5164 7.9571 113.1753 55.7957 29.0867 174.8889 141 Q 4.4128 7.7433 118.1325 55.1833 30.1155 174.9561 142 R 4.5827 8.2579 120.1317 54.5173 33.4995 174.1753 143 L 4.9224 8.3885 124.3221 53.7588 44.1011 176.1122 144 I 4.8882 8.5740 122.5017 59.7983 41.4278 173.5451 145 Y 4.7808 8.8494 128.5579 56.3569 41.1475 175.5230 146 S 3.5028 9.1442 120.5385 59.2472 61.7647 170.8076 147 G 4.3358 8.0287 115.7871 46.4202 0.0000 173.0066 148 K 4.0607 7.7842 119.7867 56.1735 32.4704 176.1050 149 Q 4.8438 8.4036 122.1397 54.4214 28.9308 174.2556 150 M 3.1055 7.8758 124.3381 55.6192 32.7279 175.8318 151 N 4.6886 10.4225 124.9221 52.4772 40.3769 175.2939 152 D 4.8717 8.8189 123.9483 53.9008 39.3024 176.9876 153 E 4.3720 9.0682 121.7400 56.8242 31.2789 176.0912 154 K 4.3791 7.7931 118.1288 55.6100 33.9672 175.1318 155 T 4.8939 9.7973 114.3488 60.2344 69.3487 174.9791 156 A 4.0579 8.8406 129.2905 55.5553 18.8786 180.1691 157 A 3.9979 7.9964 117.6763 55.5363 18.1693 179.2854 158 D 4.2928 7.7358 116.1444 57.3634 40.8223 178.0567 159 Y 4.5948 7.4486 113.8979 56.5677 38.6160 175.5652 160 K 3.9038 8.5222 117.8837 57.4440 30.3341 175.7746 161 I 3.7031 7.6853 118.0819 60.8576 38.1363 176.3530 162 L 4.3581 8.9141 124.9380 53.7402 45.2050 179.0837 163 G 3.8342 9.1821 113.0656 46.7536 0.0000 174.0642 164 G 3.6793 8.8661 112.3667 47.5374 0.0000 174.0792 165 S 4.2849 7.6608 114.5806 58.5723 64.0530 173.9612 166 V 4.9376 8.6292 121.4443 61.3245 33.4437 174.5290 167 L 5.0518 9.0008 128.0921 53.6514 44.5142 175.0808 168 H 5.3708 8.7146 118.4930 53.9836 31.9567 173.1307 169 L 4.9199 8.7013 123.9453 54.5234 42.4063 176.5051 170 V 4.6256 8.4772 122.0274 60.6612 35.1522 173.5491 171 L 4.4034 8.1052 120.3861 54.2606 44.6947 173.4659 172 A 4.7444 8.2505 123.3582 50.1698 21.8745 175.4295 173 L 4.8168 8.2703 121.1736 53.0404 44.4330 177.1982 174 R 4.0175 8.7101 121.7664 59.1190 30.3889 177.5331 175 G 3.8902 7.8852 104.4325 46.0397 0.0000 173.3630 176 G 3.7363 8.2235 106.7918 46.1838 0.0000 173.5197 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 101 M 8.16 4.36 0.00 2.45 2.00 0.00 0.00 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.52 0.00 102 L 8.64 4.87 0.00 1.71 1.55 0.99 0.87 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 0.00 103 I 9.23 5.16 1.81 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.70 0.91 0.00 0.00 104 K 8.56 5.20 0.00 1.71 1.67 0.00 1.60 0.00 0.00 1.90 0.00 0.00 3.00 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.33 1.33 7.81 105 V 8.65 4.81 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 0.78 0.00 0.00 0.95 0.00 0.00 106 K 9.30 4.63 0.00 1.67 1.73 0.00 1.64 0.00 0.00 1.66 0.00 0.00 2.83 0.00 0.00 3.25 0.00 0.00 0.00 0.00 1.40 1.37 7.81 107 T 8.52 4.41 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 1.34 0.00 0.00 108 L 8.40 4.33 0.00 1.63 1.64 0.97 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 109 T 7.32 4.57 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 0.00 110 G 8.43 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 0.00 111 K 8.37 3.77 0.00 1.73 1.84 0.00 1.87 0.00 0.00 1.73 0.00 0.00 2.93 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.42 1.42 7.81 112 E 8.30 3.73 0.00 2.14 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 2.16 2.27 0.00 113 I 8.35 4.59 1.86 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 1.27 0.50 0.95 0.00 0.00 114 E 8.59 4.95 0.00 1.99 1.86 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 2.21 2.43 0.00 115 I 9.26 4.74 1.85 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 1.21 0.59 0.89 0.00 0.00 116 D 8.66 5.31 0.00 2.54 2.59 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 0.00 117 I 8.68 4.73 1.84 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.48 0.94 0.00 0.00 118 E 9.29 4.72 0.00 1.99 1.82 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 2.22 2.39 0.00 119 P 0.00 3.80 0.00 2.16 2.13 0.00 3.57 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 2.12 2.11 0.00 120 T 7.63 4.15 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 0.00 121 D 8.70 4.56 0.00 2.76 2.57 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.27 4.73 0.00 1.83 1.73 0.00 1.69 0.00 0.00 1.76 0.00 0.00 3.02 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.52 1.43 7.81 123 V 8.97 3.58 2.11 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 0.95 0.00 0.00 1.12 0.00 0.00 124 E 7.96 3.90 0.00 2.33 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 2.32 2.36 0.00 125 R 8.06 4.03 0.00 1.93 2.00 0.00 3.36 0.00 0.00 3.16 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.82 0.00 126 I 7.78 3.66 1.97 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.13 0.87 0.00 0.00 127 K 7.91 4.25 0.00 2.02 1.84 0.00 1.67 0.00 0.00 1.73 0.00 0.00 2.94 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.59 1.44 7.81 128 E 7.75 3.97 0.00 2.25 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 2.33 2.54 0.00 129 R 8.17 3.87 0.00 1.98 1.96 0.00 3.29 0.00 0.00 3.08 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.77 0.00 130 V 7.60 3.53 2.35 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 1.02 0.00 0.00 0.99 0.00 0.00 131 E 8.39 4.15 0.00 2.17 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 2.31 2.33 0.00 132 E 8.31 3.74 0.00 2.03 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 0.00 2.33 2.39 0.00 133 K 7.86 4.21 0.00 1.89 1.83 0.00 1.72 0.00 0.00 1.70 0.00 0.00 3.07 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.44 1.61 7.81 134 E 8.98 4.57 0.00 1.86 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 2.43 0.00 135 G 8.78 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 0.00 136 I 7.57 4.13 1.87 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 1.41 0.62 0.91 0.00 0.00 137 P 0.00 4.39 0.00 2.17 2.01 0.00 3.60 0.00 0.00 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.13 0.00 138 P 0.00 4.35 0.00 2.17 2.10 0.00 3.60 0.00 0.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.11 0.00 139 Q 8.25 4.00 0.00 2.04 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 7.34 0.00 0.00 0.00 0.00 0.00 2.37 2.36 0.00 140 Q 7.96 4.52 0.00 2.17 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.52 6.68 0.00 0.00 0.00 0.00 0.00 2.42 2.30 0.00 141 Q 7.74 4.41 0.00 2.30 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.88 6.78 0.00 0.00 0.00 0.00 0.00 2.31 2.52 0.00 142 R 8.26 4.58 0.00 1.83 1.80 0.00 3.27 0.00 0.00 3.33 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.56 0.00 143 L 8.39 4.92 0.00 1.51 1.49 0.87 0.72 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 0.00 144 I 8.57 4.89 1.89 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 1.10 0.72 0.96 0.00 0.00 145 Y 8.85 4.78 0.00 2.94 2.77 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 0.00 0.00 0.00 0.00 146 S 9.14 3.50 0.00 3.88 3.43 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 0.00 147 G 8.03 4.34 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 0.00 148 K 7.78 4.06 0.00 2.11 1.97 0.00 1.83 0.00 0.00 1.79 0.00 0.00 3.04 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.55 1.74 7.81 149 Q 8.40 4.84 0.00 2.03 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.70 6.79 0.00 0.00 0.00 0.00 0.00 2.27 2.39 0.00 150 M 7.88 3.11 0.00 1.47 1.84 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.91 0.00 151 N 10.42 4.69 0.00 2.75 2.89 0.00 0.00 6.52 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 0.00 152 D 8.82 4.87 0.00 2.93 2.87 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 0.00 153 E 9.07 4.37 0.00 1.88 2.14 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 2.24 2.30 0.00 154 K 7.79 4.38 0.00 2.01 1.86 0.00 1.56 0.00 0.00 1.31 0.00 0.00 2.79 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.39 1.39 7.81 155 T 9.80 4.89 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 1.32 0.00 0.00 156 A 8.84 4.06 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 0.00 157 A 8.00 4.00 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 0.00 158 D 7.74 4.29 0.00 2.72 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 0.00 0.00 0.00 0.00 159 Y 7.45 4.59 0.00 2.94 3.10 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 0.00 160 K 8.52 3.90 0.00 2.03 1.98 0.00 1.78 0.00 0.00 1.76 0.00 0.00 3.05 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.42 1.45 7.81 161 I 7.69 3.70 1.83 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.37 0.24 0.69 0.00 0.00 162 L 8.91 4.36 0.00 1.66 1.54 0.95 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 163 G 9.18 3.83 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 0.00 0.00 0.00 164 G 8.87 3.68 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 0.00 0.00 0.00 165 S 7.66 4.28 0.00 3.87 4.21 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 0.00 166 V 8.63 4.94 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 0.77 0.00 0.00 0.95 0.00 0.00 167 L 9.00 5.05 0.00 1.57 1.54 0.82 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 168 H 8.71 5.37 0.00 3.13 3.17 0.00 5.80 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 169 L 8.70 4.92 0.00 1.65 1.60 0.92 0.69 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 0.00 170 V 8.48 4.63 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 0.66 0.00 0.00 0.93 0.00 0.00 171 L 8.11 4.40 0.00 1.56 1.54 0.92 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 172 A 8.25 4.74 1.19 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 0.00 173 L 8.27 4.82 0.00 1.60 1.56 0.92 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 174 R 8.71 4.02 0.00 1.80 1.98 0.00 3.22 0.00 0.00 3.23 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.62 0.00 175 G 7.89 3.89 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 0.00 0.00 0.00 176 G 8.22 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00