NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 94 T 4.3623 8.0176 117.3745 63.5172 70.0552 174.6562 95 D 4.2899 8.5474 126.0982 55.0302 39.7204 177.1821 96 R 3.8411 8.0971 120.5206 59.5026 30.4868 179.0939 97 M 3.9530 7.9936 117.2922 58.5868 32.3682 177.7119 98 A 4.0087 7.8543 120.4242 55.4286 18.5217 179.8818 99 R 3.9083 8.1700 116.4608 59.4078 30.1283 179.3137 100 L 4.0465 7.8364 118.2320 57.2882 41.5407 179.5154 101 L 4.0451 8.2772 119.7191 57.6640 41.3603 179.4226 102 G 3.7471 7.8749 104.4051 48.0655 0.0000 174.9406 103 E 4.1599 8.1094 120.5316 58.0310 29.9442 177.2134 104 L 4.5841 8.3917 116.5111 54.0099 43.8599 175.7290 105 L 4.3814 7.9272 121.3346 54.7189 41.8737 176.3563 106 V 4.0251 8.7665 127.8647 65.3884 32.1074 175.8514 107 S 4.8311 7.6962 112.7380 57.5576 66.3594 172.5088 108 T 5.1886 8.2133 109.4805 60.5583 71.9797 172.0878 109 D 4.7270 8.6129 121.1549 54.4846 45.3901 173.0782 110 D 5.1396 8.4158 117.5738 53.0594 42.3349 175.2517 111 S 4.4357 9.3175 113.7303 58.3726 66.7901 174.1690 112 G 3.7520 8.3481 117.4939 47.3075 0.0000 173.7827 113 N 5.0370 8.7610 122.1122 52.2424 37.4938 173.4737 114 L 5.2978 8.0316 118.8040 53.4074 45.0795 175.1846 115 A 5.0185 8.8392 125.3742 50.4553 21.6190 175.8525 116 V 4.6375 8.8203 122.4639 61.2135 33.9431 174.2460 117 L 5.0813 8.9006 128.6516 53.0560 44.3216 175.7965 118 R 5.2141 8.6831 121.8793 54.7267 32.8000 175.1348 119 T 5.4355 8.5325 111.5174 57.8883 73.1380 171.3475 120 P 4.4043 0.0000 0.0000 61.5562 32.7813 174.5214 121 P 4.2903 0.0000 0.0000 64.7632 31.5128 177.1870 122 G 3.9515 8.9597 111.2176 45.2393 0.0000 174.4018 123 A 4.4116 7.8962 120.3941 52.8078 19.0355 178.9643 124 A 3.9165 7.9063 119.6973 55.5687 18.4743 179.3563 125 H 4.0234 8.2134 114.1450 58.9526 28.6221 177.2904 126 Y 4.3232 8.0275 120.8819 60.7154 38.7799 177.6657 127 L 3.7344 7.9218 120.9306 58.0877 42.1685 178.6623 128 A 3.9219 8.1036 120.8013 55.1228 18.1578 179.4196 129 S 4.0142 8.2535 111.4358 61.6508 62.5878 176.4107 130 A 3.9126 7.5920 123.2629 54.9646 17.8197 179.6295 131 I 3.6915 7.4834 117.5460 64.6786 37.5670 177.8731 132 D 4.5526 8.4059 119.9911 57.7508 40.5089 179.4010 133 R 4.0038 8.0758 116.6514 58.8661 30.0626 178.6793 134 A 4.0129 7.8252 119.3507 52.4509 19.5675 177.0171 135 A 3.7054 7.6141 119.3681 53.2296 16.7296 177.3611 136 L 4.1785 7.3520 121.7475 53.4777 42.9269 177.5039 137 P 4.2430 0.0000 0.0000 65.4383 31.5849 177.1306 138 Q 4.3740 8.0055 115.0251 55.4915 28.8300 174.2260 139 V 4.5851 7.3974 119.1803 61.3366 32.2021 175.8644 140 V 3.7605 8.9620 129.5633 65.4455 32.1903 175.7563 141 G 4.1857 7.2737 105.5530 46.2420 0.0000 171.9644 142 T 5.3201 8.1420 107.3614 59.7682 72.0127 173.5927 143 I 4.6362 8.4805 122.9300 59.5335 40.7160 174.1683 144 A 4.9193 8.6168 128.1917 49.5775 20.4461 176.7716 145 G 4.0700 8.8521 112.2604 45.8611 0.0000 174.9170 146 D 4.6015 8.7893 120.5795 55.7583 41.9637 176.9085 147 D 5.0765 7.7774 114.0123 51.7850 41.9132 174.9649 148 T 5.1056 7.8144 115.2988 62.1930 73.1096 172.5687 149 I 4.8814 8.9620 126.0723 59.4730 40.6987 174.3894 150 L 4.9296 8.5957 126.5960 53.4148 43.6845 175.5741 151 V 4.7414 8.7934 124.3357 61.0753 34.1675 174.2290 152 V 4.6492 8.6616 128.4220 61.6796 32.8922 174.6407 153 A 4.6960 8.8925 130.9883 51.4152 19.8572 176.7462 154 R 4.1181 8.8811 123.5019 55.4912 31.1637 175.7645 155 E 4.1089 8.9671 125.8613 56.9129 29.8517 175.3290 156 P 4.6509 0.0000 0.0000 62.6612 32.0671 176.0690 157 T 4.0421 7.5089 116.4828 64.6862 69.0087 174.3774 158 T 4.6130 8.7611 116.4346 60.1266 72.0063 176.1698 159 G 3.7348 8.6567 108.8450 48.1582 0.0000 175.7684 160 A 4.1452 8.0015 122.5187 55.1804 18.4298 179.6129 161 Q 3.9385 8.1388 116.4440 58.9829 28.7016 179.0571 162 L 3.7856 7.9599 119.8252 57.6850 41.6096 179.3518 163 A 4.3172 8.5180 121.2909 55.1974 18.3241 179.9122 164 G 3.5387 8.2857 104.2944 48.0739 0.0000 175.5872 165 M 3.9522 7.9045 120.5787 58.4285 32.0242 178.4247 166 F 4.3656 8.1277 117.9832 60.5237 38.8663 177.2664 167 E 4.0318 8.3888 117.6593 59.8082 29.3681 178.7147 168 N 4.3822 8.0650 115.5018 56.5772 39.1430 176.1835 169 L 4.0392 7.6487 119.5043 58.0260 41.9616 178.0603 170 R 4.2088 7.5568 121.4850 56.9500 30.1500 175.5843 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 94 T 8.02 4.36 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 1.26 0.00 0.00 95 D 8.55 4.29 0.00 2.98 2.92 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 96 R 8.10 3.84 0.00 1.89 1.94 0.00 3.17 0.00 0.00 3.24 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.65 0.00 97 M 7.99 3.95 0.00 2.28 2.21 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.69 0.00 98 A 7.85 4.01 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 99 R 8.17 3.91 0.00 1.86 1.99 0.00 3.13 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.91 0.00 100 L 7.84 4.05 0.00 1.57 1.56 0.28 0.61 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 0.00 101 L 8.28 4.05 0.00 1.87 1.74 1.11 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 102 G 7.87 3.75 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 E 8.11 4.16 0.00 2.07 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 2.35 2.37 0.00 104 L 8.39 4.58 0.00 1.72 1.63 1.02 0.51 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 0.00 105 L 7.93 4.38 0.00 1.58 1.68 0.90 0.86 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 0.00 106 V 8.77 4.03 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 0.81 0.00 0.00 0.98 0.00 0.00 107 S 7.70 4.83 0.00 3.89 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 0.00 108 T 8.21 5.19 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 1.30 0.00 0.00 109 D 8.61 4.73 0.00 2.78 2.53 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 0.00 110 D 8.42 5.14 0.00 2.75 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 0.00 111 S 9.32 4.44 0.00 3.84 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 0.00 112 G 8.35 3.75 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 N 8.76 5.04 0.00 2.89 3.04 0.00 0.00 5.73 6.67 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 0.00 114 L 8.03 5.30 0.00 1.74 1.58 0.93 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 115 A 8.84 5.02 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 0.00 116 V 8.82 4.64 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 0.95 0.00 0.00 0.93 0.00 0.00 117 L 8.90 5.08 0.00 1.42 1.36 -0.05 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 118 R 8.68 5.21 0.00 1.70 1.78 0.00 3.20 0.00 0.00 3.20 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.67 0.00 119 T 8.53 5.44 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 1.16 0.00 0.00 120 P 0.00 4.40 0.00 2.10 2.02 0.00 3.64 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.12 0.00 121 P 0.00 4.29 0.00 2.03 2.03 0.00 3.70 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.11 0.00 122 G 8.96 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 0.00 0.00 0.00 123 A 7.90 4.41 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 A 7.91 3.92 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 0.00 125 H 8.21 4.02 0.00 3.30 3.44 0.00 5.82 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 Y 8.03 4.32 0.00 2.93 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 0.00 127 L 7.92 3.73 0.00 1.76 1.58 0.83 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 128 A 8.10 3.92 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 0.00 129 S 8.25 4.01 0.00 4.00 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 0.00 130 A 7.59 3.91 1.21 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 0.00 0.00 131 I 7.48 3.69 1.99 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.63 1.04 0.00 0.00 132 D 8.41 4.55 0.00 2.86 2.73 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 0.00 133 R 8.08 4.00 0.00 1.88 1.99 0.00 3.16 0.00 0.00 3.23 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.81 0.00 134 A 7.83 4.01 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 0.00 135 A 7.61 3.71 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 0.00 136 L 7.35 4.18 0.00 1.73 1.57 0.90 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 137 P 0.00 4.24 0.00 2.02 2.11 0.00 3.63 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.10 0.00 138 Q 8.01 4.37 0.00 2.02 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.89 6.87 0.00 0.00 0.00 0.00 0.00 2.35 2.24 0.00 139 V 7.40 4.59 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 0.79 0.00 0.00 1.00 0.00 0.00 140 V 8.96 3.76 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 0.78 0.00 0.00 0.96 0.00 0.00 141 G 7.27 4.19 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 0.00 142 T 8.14 5.32 4.20 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 0.00 0.00 0.00 1.26 0.00 0.00 143 I 8.48 4.64 1.86 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 1.24 0.91 0.00 0.00 144 A 8.62 4.92 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 0.00 145 G 8.85 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 0.00 0.00 0.00 146 D 8.79 4.60 0.00 2.69 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 0.00 147 D 7.78 5.08 0.00 2.95 2.78 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 0.00 148 T 7.81 5.11 4.22 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 1.19 0.00 0.00 149 I 8.96 4.88 1.74 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.73 0.88 0.00 0.00 150 L 8.60 4.93 0.00 1.59 1.58 0.92 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 151 V 8.79 4.74 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 1.12 0.00 0.00 0.81 0.00 0.00 152 V 8.66 4.65 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 0.96 0.00 0.00 0.94 0.00 0.00 153 A 8.89 4.70 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 0.00 154 R 8.88 4.12 0.00 1.91 1.82 0.00 3.18 0.00 0.00 3.16 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.61 0.00 155 E 8.97 4.11 0.00 1.99 1.91 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 2.33 2.34 0.00 156 P 0.00 4.65 0.00 2.16 2.14 0.00 3.77 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.96 0.00 157 T 7.51 4.04 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 1.24 0.00 0.00 158 T 8.76 4.61 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 1.26 0.00 0.00 159 G 8.66 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 0.00 160 A 8.00 4.15 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 0.00 161 Q 8.14 3.94 0.00 2.28 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.76 0.00 0.00 0.00 0.00 0.00 2.36 2.39 0.00 162 L 7.96 3.79 0.00 1.96 1.79 1.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 163 A 8.52 4.32 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 0.00 164 G 8.29 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 M 7.90 3.95 0.00 1.83 1.89 0.00 0.00 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.54 0.00 166 F 8.13 4.37 0.00 3.32 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 0.00 167 E 8.39 4.03 0.00 2.14 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 2.56 2.52 0.00 168 N 8.06 4.38 0.00 2.70 2.97 0.00 0.00 7.26 7.28 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 0.00 169 L 7.65 4.04 0.00 1.83 1.81 0.91 0.97 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 0.00 170 R 7.56 4.21 0.00 2.07 1.97 0.00 3.47 0.00 0.00 3.28 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.86 0.00