NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 27 L 4.2319 8.1849 122.4854 54.7716 42.2882 175.1956 28 R 4.4909 8.5054 122.5490 51.9442 34.2289 169.8674 29 V 3.7634 8.3102 118.8005 65.0606 32.6021 174.2068 30 G 4.1564 9.3070 114.8162 45.6815 0.0000 174.3443 31 S 4.0914 8.0006 114.8008 59.0829 63.7776 174.4336 32 R 4.7548 8.6026 122.5653 55.7646 31.5402 175.9097 33 V 4.2293 8.5502 115.5708 59.4215 36.7971 173.8001 34 E 4.8502 8.4306 123.1501 54.1662 32.8162 175.1479 35 V 4.1265 8.9127 127.3195 62.3348 32.4372 175.2593 36 I 3.7294 7.9169 129.1711 63.6290 37.1156 175.6824 37 G 4.2705 9.2418 120.9572 46.0073 0.0000 175.1779 38 K 3.8935 7.7850 119.4151 56.6573 32.3737 179.0085 39 G 4.7265 8.1119 105.5338 44.1084 0.0000 172.9444 40 H 4.5502 7.5984 117.9582 55.6787 29.6019 174.7977 41 R 4.9758 8.8198 122.6126 55.3333 32.7009 175.8413 42 G 4.3494 8.9060 108.5419 45.8786 0.0000 170.9943 43 T 5.0679 8.5323 116.0039 61.3633 71.7806 174.2547 44 V 3.9509 8.7974 126.8041 63.0936 31.4404 175.9444 45 A 4.2643 8.7312 130.9021 53.2511 19.6818 176.4621 46 Y 4.7479 7.2305 115.7735 56.4613 42.6072 174.0799 47 V 4.4177 7.8793 125.2003 61.5751 34.3076 174.6516 48 G 3.7525 7.3709 115.4241 46.1036 0.0000 170.9758 49 A 4.8636 8.3419 122.9669 52.0167 19.4915 176.7619 50 T 4.8972 8.0210 108.5871 60.4186 71.7808 173.2260 51 L 4.4144 8.7586 120.7048 55.6544 42.5061 178.2499 52 F 4.4717 6.2345 111.2312 58.5745 38.3032 175.3831 53 A 4.4677 6.9621 120.6352 51.4882 21.3062 175.7701 54 T 4.0611 8.5097 111.5771 61.9991 69.7933 174.5827 55 G 3.7470 8.4245 108.4477 44.4555 0.0000 172.5824 56 K 4.3310 8.0169 120.0501 55.8715 32.6832 175.9871 57 W 5.0382 9.1837 126.7716 54.9181 33.0660 174.7130 58 V 4.5945 9.3898 123.4068 61.1506 33.4560 174.7388 59 G 3.3694 9.3094 117.2874 45.2089 0.0000 172.1500 60 V 4.5911 8.4816 126.6326 60.9267 34.6116 174.7029 61 I 4.5838 8.8675 129.3435 59.8471 38.1416 175.1776 62 L 4.5364 9.2160 128.4556 54.5027 42.2184 178.7352 63 D 4.3090 9.1535 122.9004 56.5379 41.0589 176.7038 64 E 4.7292 7.2463 114.3223 54.1593 32.6813 176.2709 65 A 4.1416 8.1780 123.4000 52.2733 16.8871 178.0898 66 K 4.4739 7.6417 115.9162 55.7234 33.3361 176.9913 67 G 4.5242 8.2350 108.7416 44.6815 0.0000 173.2440 68 K 4.7626 8.9823 117.9247 56.3631 34.1320 176.0147 69 N 4.8092 7.5007 116.5931 51.9603 40.3082 174.7749 70 D 4.5649 8.5790 119.7580 53.8692 40.5890 176.9434 71 G 2.9198 9.1417 109.9575 46.6835 0.0000 174.1040 72 T 4.9681 7.8240 116.7760 61.6477 70.1983 173.5799 73 V 4.2840 8.5205 126.0632 62.3639 34.0444 175.4011 74 Q 3.6121 9.8104 125.4196 56.9274 26.3163 174.6350 75 G 3.9716 8.4404 106.1174 45.0571 0.0000 173.7762 76 R 4.1957 7.6336 120.2131 54.4424 30.8212 174.9536 77 K 4.6004 8.2161 126.3344 55.3469 32.9703 175.5479 78 Y 4.3035 8.7370 123.8425 58.7188 40.2100 175.0301 79 F 4.8780 7.3595 112.2857 56.4596 40.2066 171.8428 80 T 4.8141 8.4639 116.5013 62.4695 71.3084 173.5661 81 C 4.6737 7.9044 120.5224 57.9416 32.8379 173.0715 82 D 4.8023 8.6257 117.9474 53.7190 42.1353 176.2311 83 E 4.2369 8.6277 120.2186 57.8511 30.1440 177.0710 84 G 4.0194 9.0632 111.8766 45.6025 0.0000 174.6378 85 H 4.7707 8.3058 115.9718 56.5184 29.9847 175.1839 86 G 4.4086 7.9001 107.2696 45.9986 0.0000 172.6787 87 I 5.0146 8.7047 122.5984 59.6048 42.1101 173.0657 88 F 5.3790 8.9182 126.5881 56.0031 41.0038 175.2719 89 V 5.0526 8.9390 115.5309 59.5033 36.5749 175.5273 90 R 4.2289 8.7090 120.9658 55.8855 30.8979 178.2144 91 Q 4.1320 8.5003 118.3613 58.6651 28.8103 178.7001 92 S 4.2761 7.8860 112.7512 60.8939 63.7255 175.3066 93 Q 4.1908 8.2241 120.2080 57.2236 28.8628 175.2903 94 I 5.1508 7.1350 109.3090 58.8760 40.7050 174.7504 95 Q 4.6888 8.7358 120.8186 54.2607 32.3698 176.3706 96 V 3.8408 7.9153 118.9505 60.7722 33.6596 176.2161 97 F 4.9758 8.5611 118.8213 58.4255 39.4527 174.9142 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 27 L 8.18 4.23 0.00 1.56 1.65 0.86 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 28 R 8.51 4.49 0.00 1.87 1.74 0.00 3.23 0.00 0.00 3.12 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.64 0.00 29 V 8.31 3.76 2.05 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 0.77 0.00 0.00 0.94 0.00 0.00 30 G 9.31 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 S 8.00 4.09 0.00 3.87 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 R 8.60 4.75 0.00 1.85 2.02 0.00 3.37 0.00 0.00 3.39 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.70 0.00 33 V 8.55 4.23 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.60 0.00 0.00 0.81 0.00 0.00 34 E 8.43 4.85 0.00 1.47 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.34 0.00 35 V 8.91 4.13 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 0.91 0.00 0.00 0.95 0.00 0.00 36 I 7.92 3.73 1.87 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 1.15 0.76 0.91 0.00 0.00 37 G 9.24 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 0.00 0.00 0.00 0.00 38 K 7.79 3.89 0.00 1.76 1.63 0.00 1.61 0.00 0.00 1.77 0.00 0.00 2.95 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.51 1.39 7.81 39 G 8.11 4.73 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 40 H 7.60 4.55 0.00 3.06 3.24 0.00 5.61 0.00 0.00 0.00 0.00 6.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 R 8.82 4.98 0.00 1.90 2.03 0.00 3.26 0.00 0.00 3.47 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 1.95 0.00 42 G 8.91 4.35 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 0.00 43 T 8.53 5.07 4.23 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 0.00 0.00 0.00 1.20 0.00 0.00 44 V 8.80 3.95 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 0.93 0.00 0.00 0.83 0.00 0.00 45 A 8.73 4.26 0.81 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 46 Y 7.23 4.75 0.00 2.96 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 47 V 7.88 4.42 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 0.78 0.00 0.00 0.83 0.00 0.00 48 G 7.37 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 49 A 8.34 4.86 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 50 T 8.02 4.90 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 1.08 0.00 0.00 51 L 8.76 4.41 0.00 1.63 1.77 0.92 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 52 F 6.23 4.47 0.00 3.00 3.23 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 0.00 0.00 0.00 0.00 53 A 6.96 4.47 1.70 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 0.00 0.00 54 T 8.51 4.06 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 1.23 0.00 0.00 55 G 8.42 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 56 K 8.02 4.33 0.00 1.71 1.60 0.00 1.67 0.00 0.00 1.64 0.00 0.00 2.68 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.37 1.44 7.81 57 W 9.18 5.04 0.00 3.57 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 V 9.39 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 0.89 0.00 0.00 0.93 0.00 0.00 59 G 9.31 3.37 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 60 V 8.48 4.59 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 0.95 0.00 0.00 0.82 0.00 0.00 61 I 8.87 4.58 1.91 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.53 1.01 0.00 0.00 62 L 9.22 4.54 0.00 1.71 1.59 0.85 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 63 D 9.15 4.31 0.00 2.77 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 64 E 7.25 4.73 0.00 1.97 1.84 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 2.28 2.26 0.00 65 A 8.18 4.14 1.13 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 0.00 0.00 0.00 0.00 0.00 0.00 66 K 7.64 4.47 0.00 1.43 1.50 0.00 1.75 0.00 0.00 1.68 0.00 0.00 3.06 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.25 1.09 7.81 67 G 8.23 4.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 K 8.98 4.76 0.00 1.54 1.75 0.00 1.69 0.00 0.00 1.70 0.00 0.00 2.94 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.33 1.33 7.81 69 N 7.50 4.81 0.00 2.77 2.88 0.00 0.00 5.72 8.07 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 70 D 8.58 4.56 0.00 2.77 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 71 G 9.14 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 0.00 0.00 0.00 72 T 7.82 4.97 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 1.22 0.00 0.00 73 V 8.52 4.28 1.64 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 0.30 0.00 0.00 0.55 0.00 0.00 74 Q 9.81 3.61 0.00 2.23 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.43 0.00 0.00 0.00 0.00 0.00 2.24 2.22 0.00 75 G 8.44 3.97 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 0.00 0.00 0.00 0.00 0.00 0.00 76 R 7.63 4.20 0.00 1.82 1.80 0.00 2.86 0.00 0.00 2.89 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.50 0.00 77 K 8.22 4.60 0.00 1.68 1.59 0.00 1.56 0.00 0.00 0.65 0.00 0.00 2.97 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.36 1.42 7.81 78 Y 8.74 4.30 0.00 3.44 2.47 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 79 F 7.36 4.88 0.00 3.28 3.15 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 0.00 80 T 8.46 4.81 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 1.21 0.00 0.00 81 C 7.90 4.67 0.00 2.94 3.07 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 82 D 8.63 4.80 0.00 2.68 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 83 E 8.63 4.24 0.00 2.05 1.95 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 2.28 2.25 0.00 84 G 9.06 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 85 H 8.31 4.77 0.00 3.39 3.52 0.00 5.61 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 86 G 7.90 4.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.70 5.01 1.90 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.96 0.92 0.00 0.00 88 F 8.92 5.38 0.00 2.48 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 V 8.94 5.05 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 0.80 0.00 0.00 1.00 0.00 0.00 90 R 8.71 4.23 0.00 1.80 1.73 0.00 2.86 0.00 0.00 2.70 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.38 0.00 91 Q 8.50 4.13 0.00 2.19 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.77 6.91 0.00 0.00 0.00 0.00 0.00 2.35 2.31 0.00 92 S 7.89 4.28 0.00 3.98 4.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.22 4.19 0.00 2.30 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.06 6.72 0.00 0.00 0.00 0.00 0.00 2.40 2.51 0.00 94 I 7.13 5.15 1.79 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 1.27 0.62 0.89 0.00 0.00 95 Q 8.74 4.69 0.00 2.04 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.73 0.00 0.00 0.00 0.00 0.00 2.31 2.16 0.00 96 V 7.92 3.84 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 0.88 0.00 0.00 0.98 0.00 0.00 97 F 8.56 4.98 0.00 3.03 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