NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 T 4.2952 8.1631 117.3744 63.4568 68.8773 173.0664 2 G 3.7757 8.1779 116.0567 43.7023 0.0000 171.9974 3 A 4.0050 8.5953 123.5478 53.6811 20.7820 178.1720 4 G 4.2618 7.3483 113.2192 45.2085 0.0000 176.4333 5 T 3.8839 8.9217 119.1898 66.0938 68.3774 174.1087 6 P 4.2693 0.0000 0.0000 65.5127 31.3980 177.5163 7 S 4.6094 8.0902 112.9469 58.5463 62.8795 174.9154 8 Q 4.2072 8.0404 121.1811 57.9276 28.8760 178.5694 9 G 3.6281 7.4265 106.5098 48.0783 0.0000 174.9135 10 K 4.1767 7.9068 117.7798 58.1682 32.5674 178.1442 11 K 4.4093 7.3748 119.2690 56.7603 29.0863 176.1209 12 N 5.0658 7.9216 119.1387 52.5492 38.4206 175.2162 13 T 4.4789 7.9417 114.4178 63.3652 70.1754 174.3829 14 T 4.5221 8.1716 121.4791 62.5801 70.0974 172.9257 15 T 4.2450 7.7185 111.8598 62.7688 70.7448 172.8465 16 H 4.9554 8.6645 121.0724 54.9032 30.1692 175.0717 17 T 4.6448 9.2273 114.4778 58.8813 72.5570 172.7661 18 K 4.2972 8.7321 122.4967 57.0002 32.6319 175.5723 19 C 4.0128 10.2838 129.8274 59.2919 31.8481 174.2838 20 R 3.6459 8.3478 126.9975 59.4707 29.7043 177.5159 21 R 3.7136 6.7631 116.8151 58.8681 30.3379 176.9073 22 C 4.1701 7.7470 111.7525 58.6794 30.4321 174.3412 23 G 3.7740 8.2452 107.9936 45.7583 0.0000 172.6984 24 E 4.5529 7.9005 118.0952 53.6988 32.6800 175.9535 25 K 4.6702 8.0670 123.4930 55.2978 29.8982 176.1598 26 S 4.8499 7.6352 113.2694 58.5165 66.3705 174.4872 27 Y 5.0425 8.9726 124.0186 56.3879 38.9191 173.9451 28 H 4.3175 8.9699 127.9427 56.0033 29.1528 175.6365 29 T 3.5456 8.7828 119.4722 63.2128 67.3758 174.6646 30 K 4.3048 7.5518 118.3129 57.5065 33.2679 177.1511 31 K 4.2789 7.8749 115.9777 55.2296 34.3478 176.0079 32 K 3.3246 8.8661 117.6381 56.3258 29.7103 175.4740 33 V 4.8568 7.0282 117.1687 62.0177 35.5240 173.1021 34 C 5.3118 9.1771 128.7908 59.3090 32.3339 174.2954 35 S 4.1480 9.3510 120.7406 60.6437 63.1440 174.6259 36 S 4.4303 8.4099 115.0855 60.0550 63.0173 174.2624 37 C 4.2078 7.8989 115.3008 58.8865 30.4596 175.5437 38 G 3.9712 8.3606 108.4814 45.9079 0.0000 172.8988 39 F 4.1173 7.9998 122.1260 60.0845 39.5472 175.6915 40 G 3.6555 8.2792 115.6591 44.7669 0.0000 173.5845 41 K 4.3152 8.0718 118.6192 57.0772 34.0003 175.9797 42 S 4.7061 7.6544 110.1899 56.0431 65.1128 173.5520 43 A 4.1295 8.5538 128.5801 54.2060 18.6154 177.9798 44 K 4.3703 7.5121 115.2476 54.9673 33.1671 176.8697 45 R 4.0783 8.6106 121.9963 56.8691 30.5555 176.3773 46 R 3.9441 8.6689 125.3161 56.5635 30.6351 175.3302 47 D 4.6611 7.8633 124.5553 53.3426 44.1807 173.8034 48 Y 4.4246 8.2236 122.0952 55.9230 41.0793 176.4136 49 E 4.1230 8.7459 121.5933 57.6647 30.1062 177.4576 50 W 4.9277 7.3063 115.8835 56.4547 28.4976 177.3271 51 Q 4.2861 7.4423 117.1317 57.1470 28.2971 175.3282 52 S 4.6485 7.4205 111.0485 56.3635 66.1851 173.5598 53 K 4.1479 8.4349 120.2411 56.2378 32.4248 177.6627 54 A 4.0931 8.6740 122.7943 55.5939 18.8047 179.5489 55 G 3.9517 7.6796 103.7323 43.7860 0.0000 173.2931 56 E 4.4036 7.6548 122.7773 56.8296 29.5560 174.8528 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 T 8.16 4.30 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 2 G 8.18 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 3 A 8.60 4.01 1.29 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 0.00 0.00 0.00 4 G 7.35 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 0.00 0.00 0.00 0.00 5 T 8.92 3.88 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 6 P 0.00 4.27 0.00 2.21 2.31 0.00 3.59 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 1.99 0.00 7 S 8.09 4.61 0.00 4.02 3.93 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 0.00 0.00 0.00 0.00 8 Q 8.04 4.21 0.00 2.26 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.80 0.00 0.00 0.00 0.00 0.00 2.59 2.45 0.00 9 G 7.43 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 K 7.91 4.18 0.00 1.76 1.88 0.00 1.76 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.43 1.45 7.81 11 K 7.37 4.41 0.00 1.88 1.79 0.00 1.65 0.00 0.00 1.76 0.00 0.00 3.04 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.48 1.39 7.81 12 N 7.92 5.07 0.00 2.75 2.81 0.00 0.00 6.30 7.71 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 13 T 7.94 4.48 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 1.19 0.00 0.00 14 T 8.17 4.52 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 1.18 0.00 0.00 15 T 7.72 4.24 4.13 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 1.16 0.00 0.00 16 H 8.66 4.96 0.00 3.11 3.52 0.00 5.65 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 17 T 9.23 4.64 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 1.24 0.00 0.00 18 K 8.73 4.30 0.00 1.80 1.86 0.00 1.68 0.00 0.00 1.64 0.00 0.00 2.95 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.42 1.52 7.81 19 C 10.28 4.01 0.00 3.12 2.77 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 0.00 0.00 0.00 20 R 8.35 3.65 0.00 1.39 1.24 0.00 3.09 0.00 0.00 3.08 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.51 0.00 21 R 6.76 3.71 0.00 0.87 1.48 0.00 3.38 0.00 0.00 3.32 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.54 0.00 22 C 7.75 4.17 0.00 3.09 3.02 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 23 G 8.25 3.77 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 0.00 0.00 0.00 0.00 0.00 0.00 24 E 7.90 4.55 0.00 1.92 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.24 0.00 25 K 8.07 4.67 0.00 1.79 1.77 0.00 1.74 0.00 0.00 1.73 0.00 0.00 2.98 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.57 1.50 7.81 26 S 7.64 4.85 0.00 3.86 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 Y 8.97 5.04 0.00 3.11 2.95 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 28 H 8.97 4.32 0.00 3.20 3.13 0.00 5.85 0.00 0.00 0.00 0.00 6.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 T 8.78 3.55 4.04 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 0.00 0.00 0.00 1.13 0.00 0.00 30 K 7.55 4.30 0.00 1.76 1.82 0.00 1.74 0.00 0.00 1.64 0.00 0.00 3.07 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.20 1.26 7.81 31 K 7.87 4.28 0.00 1.74 1.84 0.00 1.80 0.00 0.00 1.65 0.00 0.00 2.45 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.34 1.48 7.81 32 K 8.87 3.32 0.00 1.94 2.02 0.00 1.67 0.00 0.00 1.30 0.00 0.00 3.05 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.32 1.51 7.81 33 V 7.03 4.86 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 0.96 0.00 0.00 0.98 0.00 0.00 34 C 9.18 5.31 0.00 3.27 3.08 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 35 S 9.35 4.15 0.00 3.97 4.12 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 36 S 8.41 4.43 0.00 3.91 3.85 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 37 C 7.90 4.21 0.00 3.17 3.18 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 0.00 0.00 0.00 0.00 38 G 8.36 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 39 F 8.00 4.12 0.00 3.05 2.91 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 0.00 0.00 0.00 40 G 8.28 3.66 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 0.00 0.00 0.00 41 K 8.07 4.32 0.00 1.68 1.96 0.00 1.78 0.00 0.00 1.69 0.00 0.00 2.84 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.35 1.34 7.81 42 S 7.65 4.71 0.00 3.81 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 43 A 8.55 4.13 1.28 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 0.00 0.00 0.00 0.00 0.00 0.00 44 K 7.51 4.37 0.00 1.72 1.70 0.00 1.71 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.40 1.38 7.81 45 R 8.61 4.08 0.00 1.64 1.87 0.00 3.36 0.00 0.00 3.16 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.58 0.00 46 R 8.67 3.94 0.00 1.83 2.00 0.00 3.42 0.00 0.00 3.49 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.79 0.00 47 D 7.86 4.66 0.00 2.53 2.25 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 0.00 0.00 0.00 0.00 48 Y 8.22 4.42 0.00 1.78 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 49 E 8.75 4.12 0.00 2.02 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 0.00 2.29 2.25 0.00 50 W 7.31 4.93 0.00 3.53 3.32 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 51 Q 7.44 4.29 0.00 1.93 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.70 0.00 0.00 0.00 0.00 0.00 1.99 1.84 0.00 52 S 7.42 4.65 0.00 4.07 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 53 K 8.43 4.15 0.00 1.79 1.84 0.00 1.80 0.00 0.00 1.75 0.00 0.00 2.82 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.48 1.41 7.81 54 A 8.67 4.09 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 55 G 7.68 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 56 E 7.65 4.40 0.00 1.89 1.76 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 2.11 2.21 0.00