NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 66 S 4.2512 8.3231 116.7949 59.4408 64.2251 174.2183 67 G 3.7116 8.5468 112.0940 44.1195 0.0000 171.8042 68 S 4.2972 8.6123 115.1207 58.6345 64.5309 173.2981 69 G 4.0184 7.7618 109.1175 45.9188 0.0000 173.8838 70 R 3.9661 8.2541 114.8229 58.5486 29.6203 178.5842 71 G 3.7839 8.0115 106.7421 47.6599 0.0000 174.8072 72 R 3.8763 7.6046 119.0513 57.3975 30.1112 178.0641 73 G 3.8560 8.1155 104.2409 45.4924 0.0000 173.5835 74 A 4.3160 7.7502 121.8377 51.8424 19.1280 177.4308 75 I 4.5087 8.4185 121.8806 59.6663 39.6477 175.8258 76 D 4.5080 8.6655 122.2234 56.6499 41.7961 177.8305 77 R 4.6071 7.5142 117.6700 56.0284 30.6561 177.6167 78 E 4.0840 8.1423 119.2627 58.5828 29.7587 176.7268 79 Q 4.0981 8.0920 117.5876 58.1312 28.6276 177.9898 80 S 4.0098 8.0680 116.1385 61.7363 62.6714 176.5829 81 A 3.9602 7.8300 123.9955 54.6484 17.9904 179.5107 82 A 3.9382 7.8414 118.8945 55.2951 18.4483 179.8160 83 I 3.2954 7.7119 118.5327 64.1137 37.0291 178.5483 84 R 3.8878 8.2967 120.0590 59.4331 29.8827 178.1894 85 E 3.9013 8.3771 119.1349 59.0000 29.6606 178.3757 86 W 4.1286 8.5879 128.5061 60.5513 30.6875 177.7263 87 A 3.5651 8.5672 120.8668 54.9716 17.8254 179.5577 88 R 3.7253 8.1053 117.2551 59.7408 29.9773 178.9913 89 R 3.8818 8.0235 116.8454 58.7090 30.0830 177.7932 90 N 4.4249 7.3853 113.5489 52.0804 38.7175 175.6773 91 G 3.8110 7.3832 108.2063 46.4220 0.0000 173.7883 92 H 4.6184 7.7852 116.2112 54.3489 29.6052 174.9068 93 N 4.5074 8.5580 121.6077 53.5329 39.3002 174.7023 94 V 4.5163 7.8579 123.5790 60.1511 34.3262 174.1270 95 S 4.3734 8.3987 116.5929 58.1797 63.0425 174.3201 96 T 4.0800 8.3899 115.1820 64.0665 68.9305 174.5567 97 R 4.6363 7.2684 118.1330 55.0532 34.8334 176.3131 98 G 3.8228 8.5310 106.0184 45.7073 0.0000 173.8272 99 R 4.1607 8.4388 119.9969 56.1999 30.9228 175.7400 100 I 4.5383 7.7884 120.4142 58.6616 39.7687 174.2195 101 P 4.3563 0.0000 0.0000 62.3000 31.9968 177.6656 102 A 4.0687 8.6617 123.9013 55.3104 18.2284 179.7808 103 D 4.3798 8.1213 117.2435 57.5137 40.8041 178.8360 104 V 3.8498 7.9806 118.7143 65.6248 31.5025 178.2086 105 I 3.6033 7.6837 119.2981 64.2871 36.9410 177.6241 106 D 4.2734 8.5425 119.0668 57.2584 41.0486 178.0353 107 A 4.0518 8.1790 121.3036 55.3574 18.4196 178.9837 108 Y 2.3900 7.8749 118.0539 60.6219 38.7940 177.9601 109 H 3.9669 8.3897 118.3644 58.0560 28.6458 177.6438 110 A 3.9126 8.2963 122.7452 55.0927 17.8414 179.5538 111 A 3.9629 7.7849 119.5412 55.4755 18.1375 179.8691 112 T 3.9228 7.6255 107.9580 63.6634 68.7239 176.4476 113 L 4.1345 7.4941 122.0780 57.1165 43.0213 177.7561 114 E 4.2285 8.3005 118.0187 58.3908 29.4490 178.1071 115 H 4.2301 7.6602 118.4894 58.2157 30.0228 175.2097 116 H 5.0512 7.8364 113.6815 55.4914 28.9056 173.8490 117 H 4.8108 8.3093 117.9596 58.4188 32.9145 173.8947 118 H 4.8181 8.5143 117.6418 55.4507 30.2745 172.1712 119 H 4.8590 8.0158 114.8845 54.5197 32.9817 172.3802 120 H 4.3803 7.8050 118.2696 55.8597 28.4136 173.1172 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 66 S 8.32 4.25 0.00 3.88 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 67 G 8.55 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 68 S 8.61 4.30 0.00 3.87 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 69 G 7.76 4.02 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 0.00 0.00 0.00 70 R 8.25 3.97 0.00 2.00 2.20 0.00 2.97 0.00 0.00 3.34 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.63 0.00 71 G 8.01 3.78 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 0.00 0.00 0.00 0.00 0.00 0.00 72 R 7.60 3.88 0.00 1.77 2.01 0.00 3.25 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 1.66 1.67 0.00 73 G 8.12 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 74 A 7.75 4.32 1.24 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 0.00 0.00 0.00 75 I 8.42 4.51 1.86 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 1.18 0.94 0.95 0.00 0.00 76 D 8.67 4.51 0.00 2.61 2.67 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.51 4.61 0.00 1.89 1.89 0.00 3.18 0.00 0.00 3.26 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.59 0.00 78 E 8.14 4.08 0.00 2.11 1.94 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 2.37 2.39 0.00 79 Q 8.09 4.10 0.00 2.06 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.62 0.00 0.00 0.00 0.00 0.00 2.45 2.38 0.00 80 S 8.07 4.01 0.00 4.03 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 81 A 7.83 3.96 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 82 A 7.84 3.94 1.33 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 0.00 0.00 83 I 7.71 3.30 1.77 0.00 0.00 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.17 0.79 0.00 0.00 84 R 8.30 3.89 0.00 1.93 2.10 0.00 3.15 0.00 0.00 3.09 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.65 0.00 85 E 8.38 3.90 0.00 2.19 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 2.33 2.33 0.00 86 W 8.59 4.13 0.00 3.57 3.45 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 87 A 8.57 3.57 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.11 3.73 0.00 1.92 2.05 0.00 3.09 0.00 0.00 3.14 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.63 0.00 89 R 8.02 3.88 0.00 1.78 1.86 0.00 3.24 0.00 0.00 3.23 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.78 0.00 90 N 7.39 4.42 0.00 1.69 1.98 0.00 0.00 6.00 7.13 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 91 G 7.38 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 0.00 0.00 0.00 92 H 7.79 4.62 0.00 3.04 3.17 0.00 5.66 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 N 8.56 4.51 0.00 2.67 2.74 0.00 0.00 6.82 7.72 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 94 V 7.86 4.52 2.12 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 0.72 0.00 0.00 0.96 0.00 0.00 95 S 8.40 4.37 0.00 3.86 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 96 T 8.39 4.08 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 97 R 7.27 4.64 0.00 1.75 1.81 0.00 3.29 0.00 0.00 3.23 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.60 0.00 98 G 8.53 3.82 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 0.00 0.00 0.00 99 R 8.44 4.16 0.00 1.81 1.87 0.00 3.17 0.00 0.00 3.22 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.65 0.00 100 I 7.79 4.54 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 1.42 0.56 0.93 0.00 0.00 101 P 0.00 4.36 0.00 2.20 1.98 0.00 3.63 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.09 0.00 102 A 8.66 4.07 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 0.00 103 D 8.12 4.38 0.00 2.72 2.76 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 0.00 104 V 7.98 3.85 2.26 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 1.47 0.00 0.00 1.04 0.00 0.00 105 I 7.68 3.60 1.98 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 1.45 0.46 0.81 0.00 0.00 106 D 8.54 4.27 0.00 2.81 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 0.00 107 A 8.18 4.05 1.68 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 0.00 108 Y 7.87 2.39 0.00 2.06 2.76 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 0.00 109 H 8.39 3.97 0.00 3.29 3.18 0.00 5.70 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 A 8.30 3.91 1.37 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 0.00 111 A 7.78 3.96 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 0.00 112 T 7.63 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 0.50 0.00 0.00 113 L 7.49 4.13 0.00 1.56 1.74 0.85 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 114 E 8.30 4.23 0.00 2.09 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 2.36 2.43 0.00 115 H 7.66 4.23 0.00 3.30 3.38 0.00 5.89 0.00 0.00 0.00 0.00 6.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 H 7.84 5.05 0.00 3.27 3.37 0.00 5.73 0.00 0.00 0.00 0.00 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 H 8.31 4.81 0.00 2.99 3.36 0.00 5.69 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 H 8.51 4.82 0.00 3.01 3.17 0.00 5.78 0.00 0.00 0.00 0.00 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 H 8.02 4.86 0.00 3.04 3.18 0.00 5.94 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 0.00 120 H 7.81 4.38 0.00 3.10 3.11 0.00 5.81 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