NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 101 M 4.3940 8.1627 120.2752 55.3048 34.2651 173.8441 102 L 4.6519 8.7102 123.3751 50.5033 42.7899 173.8225 103 I 4.9994 8.6834 119.7046 58.3225 41.3214 174.1766 104 K 5.1531 8.3266 121.7093 55.0000 35.6188 176.5877 105 V 4.7206 8.1898 122.1066 60.5745 33.6751 173.4301 106 K 4.2739 8.4684 127.4391 56.7899 33.2189 177.8599 107 T 4.5903 8.9844 120.5827 60.7597 68.5576 174.6539 108 L 4.0671 8.4218 123.8487 57.3246 42.0317 177.2498 109 T 4.3269 7.9800 106.5888 61.3276 69.0488 175.5113 110 G 3.9175 8.1522 111.2459 45.2091 0.0000 173.8209 111 K 4.0965 7.5696 121.3889 56.3626 33.1485 175.0293 112 E 5.0761 8.7985 129.1290 54.6787 31.1903 174.8240 113 I 4.6646 8.1438 119.9871 59.1927 40.8445 174.8442 114 E 5.5589 8.5793 123.1726 55.2359 31.0184 175.2947 115 I 4.6241 7.8479 119.8971 60.0915 42.2131 174.5688 116 D 4.6538 8.6795 125.0490 53.4630 40.7133 175.7656 117 I 4.8638 8.2767 123.1870 59.3883 41.4607 174.6284 118 E 4.6072 9.5079 127.2220 53.5318 31.2248 175.1523 119 P 4.3778 0.0000 0.0000 65.3093 31.7771 177.0993 120 T 4.1123 7.7320 111.6924 64.0550 67.8648 174.7715 121 D 4.4382 8.5625 122.4671 54.1390 41.5006 176.4429 122 K 4.6516 8.4387 122.7223 55.8828 34.2497 178.3273 123 V 3.5397 9.0728 121.4827 66.2420 31.1339 177.7039 124 E 3.8973 8.2560 117.4687 59.7479 29.6169 178.6088 125 R 4.0379 7.8260 117.7672 59.2257 30.2914 178.0219 126 I 3.6803 7.6181 119.7567 64.5712 37.1966 178.4335 127 K 4.0868 8.1489 119.0284 59.4622 31.6149 179.0045 128 E 3.9910 8.2103 119.4848 58.9780 29.4474 179.3044 129 R 3.9164 7.8010 118.3159 59.0706 30.1513 178.6796 130 V 3.5180 7.7788 117.5566 66.1314 31.4351 177.0660 131 E 4.1791 7.9763 118.5394 59.6583 29.2124 178.2025 132 E 3.9573 7.5963 117.5347 59.2797 29.5960 178.5948 133 K 4.0982 7.7620 118.2667 59.0427 32.5812 177.8190 134 E 4.4698 8.9429 117.4997 55.9270 30.7200 177.2218 135 G 3.9178 8.4270 106.0074 44.8750 0.0000 173.4757 136 I 3.8386 7.3526 120.3875 60.1044 37.0026 174.0827 137 P 4.2654 0.0000 0.0000 62.3133 31.8697 176.1180 138 P 4.3208 0.0000 0.0000 65.2802 31.7072 178.4598 139 Q 3.9358 8.2410 118.9445 58.8028 29.0056 176.7004 140 Q 4.5116 7.8784 113.2214 55.8952 28.8374 174.7553 141 Q 4.3951 7.5641 117.3487 55.2489 30.0228 175.6490 142 R 4.5075 8.2763 120.6923 54.4550 33.1152 174.1044 143 L 4.9739 8.2855 124.0598 53.7122 44.2920 176.0528 144 I 4.6942 8.7429 122.4127 59.8503 41.4135 173.5309 145 Y 4.6267 9.0240 128.8821 55.7313 40.4119 175.7310 146 S 3.3903 9.0888 125.2274 59.4411 60.0518 173.8163 147 G 4.0845 7.9307 108.3537 45.6967 0.0000 172.7036 148 K 4.2135 7.8421 120.4450 55.8361 32.6135 175.9115 149 Q 4.8663 8.3735 122.7954 53.6643 28.6585 174.3598 150 M 3.2955 8.2338 123.8469 56.0177 32.9155 175.4204 151 N 4.7085 10.1261 124.2406 51.9407 40.3031 175.4771 152 D 5.0634 8.3115 129.1516 51.6882 38.3713 175.1590 153 E 4.7028 7.5856 116.5782 57.3690 36.0688 174.8756 154 K 4.3923 7.9836 118.2584 55.6338 33.7318 175.6630 155 T 4.7957 9.2666 115.2349 60.5488 68.7055 175.5040 156 A 4.2088 8.7344 127.5562 54.3643 18.8191 180.0716 157 A 4.0605 8.0815 119.1439 55.0615 18.8221 179.2436 158 D 3.8533 7.5935 113.9645 56.8611 40.9721 177.1181 159 Y 4.5583 7.7526 113.9043 56.8892 38.9239 175.3780 160 K 3.8730 8.9807 119.2402 57.4787 29.8469 176.1963 161 I 3.5817 7.6131 120.3292 61.0758 36.8713 176.2025 162 L 4.3834 8.0807 126.5930 53.3090 43.0858 181.0833 163 G 3.4763 8.7308 112.2919 46.7695 0.0000 173.9034 164 G 3.8145 8.6433 110.5417 46.2120 0.0000 173.9508 165 S 4.4671 8.0171 115.8217 58.2418 64.5002 173.2481 166 V 4.8333 8.4726 121.1063 61.3572 33.3056 175.1459 167 L 4.7879 9.0014 128.0405 54.1057 44.4833 175.3312 168 H 5.0595 8.6595 116.0836 54.2549 32.6896 173.0699 169 L 4.7666 8.8522 125.2073 54.4356 41.8578 176.7265 170 V 4.5825 8.8537 123.6383 60.0171 34.7194 173.9370 171 L 4.5404 8.0642 120.9625 54.1727 44.9313 174.0135 172 R 4.6037 8.1666 120.0627 54.5246 32.9113 173.7850 173 L 4.7641 8.3319 124.4101 53.2273 43.8463 176.7730 174 R 4.1009 8.5446 120.9360 58.5904 30.6073 177.4441 175 G 3.8661 7.7589 105.5776 44.8316 0.0000 173.5588 176 G 3.4675 8.6191 107.3148 45.5588 0.0000 172.7734 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 4.39 0.00 1.97 2.23 0.00 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.54 0.00 102 L 8.71 4.65 0.00 1.66 1.54 0.92 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 103 I 8.68 5.00 1.90 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.67 0.86 0.00 0.00 104 K 8.33 5.15 0.00 1.73 1.69 0.00 1.66 0.00 0.00 1.88 0.00 0.00 2.83 0.00 0.00 3.36 0.00 0.00 0.00 0.00 1.33 1.33 7.81 105 V 8.19 4.72 2.03 0.00 0.00 0.00 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 0.90 0.00 0.00 106 K 8.47 4.27 0.00 1.63 1.80 0.00 1.70 0.00 0.00 1.62 0.00 0.00 2.80 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.46 1.35 7.81 107 T 8.98 4.59 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 108 L 8.42 4.07 0.00 1.65 1.69 0.93 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 109 T 7.98 4.33 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 8.15 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 7.57 4.10 0.00 1.91 1.70 0.00 1.60 0.00 0.00 1.67 0.00 0.00 2.90 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.43 1.38 7.81 112 E 8.80 5.08 0.00 2.00 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 2.20 2.27 0.00 113 I 8.14 4.66 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 1.39 0.57 0.92 0.00 0.00 114 E 8.58 5.56 0.00 1.86 1.90 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 2.25 2.16 0.00 115 I 7.85 4.62 1.84 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.15 0.89 0.00 0.00 116 D 8.68 4.65 0.00 2.54 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 0.00 117 I 8.28 4.86 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 1.09 0.57 0.91 0.00 0.00 118 E 9.51 4.61 0.00 1.93 1.77 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 2.21 2.24 0.00 119 P 0.00 4.38 0.00 2.07 2.14 0.00 3.72 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.11 0.00 120 T 7.73 4.11 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 8.56 4.44 0.00 2.78 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 K 8.44 4.65 0.00 1.81 1.75 0.00 1.69 0.00 0.00 1.76 0.00 0.00 2.91 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.55 1.50 7.81 123 V 9.07 3.54 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 0.96 0.00 0.00 0.99 0.00 0.00 124 E 8.26 3.90 0.00 2.11 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.40 0.00 125 R 7.83 4.04 0.00 1.92 2.03 0.00 3.41 0.00 0.00 3.33 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.71 0.00 126 I 7.62 3.68 1.95 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 1.49 1.04 0.86 0.00 0.00 127 K 8.15 4.09 0.00 2.03 1.85 0.00 1.66 0.00 0.00 1.72 0.00 0.00 2.89 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.59 1.42 7.81 128 E 8.21 3.99 0.00 2.21 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.35 0.00 129 R 7.80 3.92 0.00 2.03 1.93 0.00 3.35 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 1.85 1.76 0.00 130 V 7.78 3.52 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 1.02 0.00 0.00 0.98 0.00 0.00 131 E 7.98 4.18 0.00 2.23 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 2.31 2.33 0.00 132 E 7.60 3.96 0.00 2.11 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 0.00 2.33 2.34 0.00 133 K 7.76 4.10 0.00 1.96 1.80 0.00 1.71 0.00 0.00 1.69 0.00 0.00 3.14 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.43 1.51 7.81 134 E 8.94 4.47 0.00 1.99 1.96 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 0.00 2.25 2.43 0.00 135 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 0.00 136 I 7.35 3.84 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 1.41 0.57 0.91 0.00 0.00 137 P 0.00 4.27 0.00 2.17 2.00 0.00 3.60 0.00 0.00 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.12 0.00 138 P 0.00 4.32 0.00 2.17 2.10 0.00 3.60 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.07 0.00 139 Q 8.24 3.94 0.00 2.01 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 7.43 0.00 0.00 0.00 0.00 0.00 2.34 2.35 0.00 140 Q 7.88 4.51 0.00 2.22 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.55 6.44 0.00 0.00 0.00 0.00 0.00 2.44 2.31 0.00 141 Q 7.56 4.40 0.00 2.20 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.19 6.88 0.00 0.00 0.00 0.00 0.00 2.32 2.50 0.00 142 R 8.28 4.51 0.00 1.93 1.83 0.00 3.27 0.00 0.00 3.33 7.11 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 8.29 4.97 0.00 1.53 1.51 0.87 0.71 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 8.74 4.69 2.01 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 1.11 1.10 0.96 0.00 0.00 145 Y 9.02 4.63 0.00 2.76 2.84 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 0.00 146 S 9.09 3.39 0.00 3.65 3.60 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 0.00 147 G 7.93 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 0.00 0.00 0.00 148 K 7.84 4.21 0.00 2.22 2.00 0.00 1.87 0.00 0.00 1.80 0.00 0.00 3.02 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.51 1.68 7.81 149 Q 8.37 4.87 0.00 2.04 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.79 6.76 0.00 0.00 0.00 0.00 0.00 2.28 2.24 0.00 150 M 8.23 3.30 0.00 1.24 1.84 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 1.84 0.00 151 N 10.13 4.71 0.00 2.84 2.85 0.00 0.00 6.56 5.25 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 0.00 152 D 8.31 5.06 0.00 2.88 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 0.00 153 E 7.59 4.70 0.00 1.91 2.07 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 2.22 2.40 0.00 154 K 7.98 4.39 0.00 2.27 1.94 0.00 1.76 0.00 0.00 1.35 0.00 0.00 2.87 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.42 1.42 7.81 155 T 9.27 4.80 4.26 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 1.39 0.00 0.00 156 A 8.73 4.21 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 8.08 4.06 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 0.00 158 D 7.59 3.85 0.00 2.65 2.40 0.00 0.00 0.00 0.00 0.00 0.00 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 7.75 4.56 0.00 2.98 3.19 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 0.00 160 K 8.98 3.87 0.00 2.02 2.03 0.00 1.76 0.00 0.00 1.75 0.00 0.00 2.99 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.40 1.45 7.81 161 I 7.61 3.58 1.95 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 0.28 0.30 0.68 0.00 0.00 162 L 8.08 4.38 0.00 1.83 1.60 0.96 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 163 G 8.73 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.64 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 0.00 165 S 8.02 4.47 0.00 3.95 4.09 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 0.00 0.00 0.00 166 V 8.47 4.83 2.15 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 0.75 0.00 0.00 0.95 0.00 0.00 167 L 9.00 4.79 0.00 1.54 1.55 0.82 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 168 H 8.66 5.06 0.00 3.28 3.15 0.00 5.80 0.00 0.00 0.00 0.00 6.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 169 L 8.85 4.77 0.00 1.69 1.63 0.91 0.71 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 8.85 4.58 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 0.67 0.00 0.00 0.93 0.00 0.00 171 L 8.06 4.54 0.00 1.56 1.54 0.92 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 172 R 8.17 4.60 0.00 1.74 1.72 0.00 3.26 0.00 0.00 3.22 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.63 0.00 173 L 8.33 4.76 0.00 1.66 1.55 0.92 0.95 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 0.00 174 R 8.54 4.10 0.00 1.80 1.98 0.00 3.21 0.00 0.00 3.23 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.62 0.00 175 G 7.76 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 0.00 0.00 0.00 176 G 8.62 3.47 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 0.00