NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 P 4.3751 0.0000 0.0000 62.8741 32.9434 175.1235 2 A 4.5834 8.2225 117.6715 51.6891 18.5344 174.2524 3 I 4.3755 8.2766 123.2021 62.9676 40.5521 175.5274 4 Y 4.5273 7.6529 115.4046 58.0638 39.5749 175.4559 5 I 4.4350 7.9550 118.8631 61.1331 37.5581 177.1111 6 G 4.0567 7.4815 106.9728 44.1400 0.0000 174.4546 7 A 4.1933 8.0016 118.2849 52.0280 18.9190 177.2345 8 T 4.6208 7.1827 113.2679 61.7173 70.1598 173.6346 9 V 4.0301 8.2037 118.3325 63.1602 34.4386 174.6858 10 G 3.8990 8.2468 110.3830 45.7025 0.0000 171.9247 11 P 4.3865 0.0000 0.0000 66.0721 31.8077 177.8677 12 S 4.2438 8.2594 114.4364 60.1105 62.8969 175.9132 13 V 3.6393 7.9025 121.9670 65.0828 31.3712 178.2789 14 W 4.2168 8.1347 126.7307 60.5980 30.7144 177.7683 15 A 3.7474 8.1664 120.4989 55.1619 17.7187 179.1179 16 Y 3.9860 7.8681 118.0259 60.7890 39.1234 178.0125 17 L 3.8595 7.8637 120.4208 58.1256 40.3890 179.5288 18 V 3.1575 7.0414 119.2800 65.7447 31.5427 177.7070 19 A 3.8794 7.6451 120.4469 55.0209 18.0019 179.6584 20 L 3.6813 7.4208 117.1819 58.0011 41.8972 180.0001 21 V 3.6517 7.5095 117.4825 65.3181 31.3596 178.4160 22 G 3.4073 7.8474 105.6554 47.8331 0.0000 175.4550 23 A 3.9609 7.6910 123.4637 54.8524 18.3331 179.6443 24 A 3.9378 7.8060 118.9173 55.0185 18.2331 179.4769 25 A 4.0634 7.6976 117.7600 54.0916 18.5980 178.9018 26 V 4.0025 7.3687 114.8154 63.9680 32.1519 177.0483 27 T 4.2464 7.4284 113.4097 65.4299 68.9154 176.2998 28 A 4.3309 7.7153 121.2330 53.0680 18.5721 177.2535 29 A 4.0302 7.6108 120.2622 51.5642 18.4445 176.8508 30 N 4.3725 8.9344 120.2772 54.7790 38.8186 174.4112 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 1 P 0.00 4.38 0.00 2.22 2.19 0.00 3.69 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.99 0.00 2 A 8.22 4.58 1.27 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 3 I 8.28 4.38 1.98 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.71 1.02 0.00 0.00 4 Y 7.65 4.53 0.00 2.87 2.96 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 0.00 0.00 0.00 5 I 7.96 4.44 1.89 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.81 0.93 0.00 0.00 6 G 7.48 4.06 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 0.00 0.00 0.00 0.00 0.00 0.00 7 A 8.00 4.19 1.14 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 0.00 0.00 0.00 0.00 0.00 8 T 7.18 4.62 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 9 V 8.20 4.03 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 0.67 0.00 0.00 0.82 0.00 0.00 10 G 8.25 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 0.00 0.00 0.00 11 P 0.00 4.39 0.00 2.34 2.34 0.00 3.74 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 2.11 2.03 0.00 12 S 8.26 4.24 0.00 4.09 4.10 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 13 V 7.90 3.64 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 1.21 0.00 0.00 0.95 0.00 0.00 14 W 8.13 4.22 0.00 3.63 3.30 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 15 A 8.17 3.75 1.44 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 0.00 0.00 16 Y 7.87 3.99 0.00 3.08 3.20 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 0.00 17 L 7.86 3.86 0.00 1.92 2.02 0.77 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 18 V 7.04 3.16 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 0.87 0.00 0.00 -0.26 0.00 0.00 19 A 7.65 3.88 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 20 L 7.42 3.68 0.00 1.51 1.49 0.58 0.67 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 21 V 7.51 3.65 1.98 0.00 0.00 0.00 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 0.82 0.00 0.00 22 G 7.85 3.41 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 23 A 7.69 3.96 1.27 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 24 A 7.81 3.94 1.26 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 0.00 0.00 0.00 25 A 7.70 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 26 V 7.37 4.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 0.93 0.00 0.00 27 T 7.43 4.25 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 28 A 7.72 4.33 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 29 A 7.61 4.03 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 30 N 8.93 4.37 0.00 2.68 2.75 0.00 0.00 7.08 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00