NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 101 M 4.4550 8.3044 118.1942 54.9113 32.5957 175.2428 102 V 3.4838 8.4449 120.7756 64.6038 31.8599 174.6937 103 I 4.5170 8.0236 121.6780 59.4220 40.2027 174.1614 104 A 4.7380 8.7100 128.3515 50.2109 21.4635 177.3960 105 T 3.8941 8.6179 116.3126 67.0262 68.4372 176.3138 106 D 4.9304 7.8690 116.7689 54.4928 39.6638 176.5780 107 D 4.5671 8.3136 119.8451 55.8461 41.5356 176.7458 108 L 4.7661 8.1641 119.2406 55.4270 44.2716 176.3354 109 E 5.3246 7.9430 114.6475 54.9506 33.4762 174.4418 110 T 4.8758 9.0755 110.4797 59.8076 73.0550 173.1066 111 T 4.2917 8.4715 118.9747 63.8039 69.4074 173.8958 112 C 4.3641 8.9764 127.8322 58.9273 32.1453 172.5255 113 P 4.4952 0.0000 0.0000 64.3416 31.7021 176.9426 114 N 4.4606 8.2313 117.9061 56.1283 39.3508 175.1670 115 C 4.5804 7.9169 109.7792 57.1220 30.3210 173.6986 116 N 3.9720 9.3150 115.5490 54.6065 36.2388 175.1539 117 G 4.0903 8.3668 105.7954 45.2489 0.0000 175.5044 118 S 4.0900 7.8539 114.3430 59.3600 63.4047 175.6296 119 G 3.9535 8.3975 107.5809 45.6786 0.0000 172.5830 120 R 4.8703 7.8648 116.7738 54.2684 34.4035 175.3698 121 E 4.6785 8.7783 121.1899 56.1111 29.5148 174.4360 122 E 3.9531 7.4246 117.8514 55.0391 30.6889 175.7936 123 P 4.6982 0.0000 0.0000 62.6726 31.7471 174.9527 124 E 4.6906 7.7440 118.5223 53.9624 32.1713 173.4321 125 P 4.6238 0.0000 0.0000 62.1506 32.3900 175.7781 126 C 4.1163 8.5765 120.8750 59.1250 31.7104 172.4404 127 P 4.2744 0.0000 0.0000 65.5611 31.1656 177.8073 128 K 4.1150 8.0827 118.3331 58.4440 32.5081 176.7899 129 C 4.7113 7.8486 110.5450 56.7959 30.3097 173.9144 130 L 3.6439 8.9218 118.5641 56.0875 39.2196 175.5605 131 G 4.4625 8.4792 104.4946 45.6893 0.0000 175.3075 132 K 4.0253 7.9612 119.8835 57.0110 32.4763 178.5703 133 G 4.0223 8.6034 106.1035 45.0884 0.0000 172.7638 134 V 5.0552 7.3147 111.2849 59.3901 35.6822 174.7631 135 I 4.6516 8.9718 116.2931 58.9530 40.8827 174.6360 136 L 4.8243 8.3965 123.1056 54.7823 42.6426 176.9897 137 T 4.3666 8.6050 113.0578 60.6321 70.8363 175.6640 138 A 3.9574 8.7298 123.1073 55.5578 18.3250 179.5942 139 Q 3.9849 8.1355 117.5264 59.2595 29.1717 178.5524 140 G 3.6130 8.2728 106.8337 47.8483 0.0000 175.6721 141 S 4.1489 8.3989 115.9350 61.3839 62.5525 176.3565 142 T 3.9196 8.1918 118.6926 66.5746 68.1259 176.7352 143 L 4.0782 7.9101 120.7118 57.8131 41.7517 179.3016 144 L 3.9920 8.1243 120.3430 58.3000 41.9945 178.5077 145 H 4.1375 8.5043 118.3345 59.0707 29.9659 176.9685 146 F 4.2340 8.2288 122.0181 61.4369 39.2563 177.0126 147 I 3.4476 8.0274 119.3346 64.3574 36.9753 178.4641 148 K 3.8370 8.0016 119.1084 59.3244 31.6514 179.2049 149 K 3.6284 7.5903 118.4664 59.8327 32.2133 178.1595 150 H 4.3016 7.5637 113.8422 57.3854 28.8344 176.7669 151 I 4.1590 7.8052 120.4931 60.5517 37.4379 176.4994 152 H 4.0532 8.6985 115.3904 56.5283 26.7781 174.4256 153 E 4.3574 7.4990 126.1576 56.5593 31.3833 175.2288 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 8.30 4.46 0.00 2.14 2.14 0.00 0.00 0.00 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.54 0.00 102 V 8.44 3.48 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 0.78 0.00 0.00 0.92 0.00 0.00 103 I 8.02 4.52 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 1.34 0.79 0.91 0.00 0.00 104 A 8.71 4.74 1.25 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 0.00 0.00 105 T 8.62 3.89 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 0.00 106 D 7.87 4.93 0.00 2.78 2.79 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 0.00 107 D 8.31 4.57 0.00 2.87 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 0.00 108 L 8.16 4.77 0.00 1.72 1.68 0.93 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 0.00 109 E 7.94 5.32 0.00 2.08 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 0.00 2.42 2.30 0.00 110 T 9.08 4.88 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 0.00 111 T 8.47 4.29 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 0.00 112 C 8.98 4.36 0.00 3.01 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 0.00 113 P 0.00 4.50 0.00 2.22 2.15 0.00 3.81 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.95 0.00 114 N 8.23 4.46 0.00 2.68 2.87 0.00 0.00 6.88 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 C 7.92 4.58 0.00 3.11 3.10 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 0.00 116 N 9.31 3.97 0.00 2.91 2.93 0.00 0.00 7.18 6.96 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 0.00 117 G 8.37 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 0.00 0.00 0.00 118 S 7.85 4.09 0.00 4.02 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 G 8.40 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 0.00 120 R 7.86 4.87 0.00 1.79 1.78 0.00 3.27 0.00 0.00 3.15 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.68 0.00 121 E 8.78 4.68 0.00 1.92 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 2.19 2.24 0.00 122 E 7.42 3.95 0.00 2.01 1.85 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 2.32 2.30 0.00 123 P 0.00 4.70 0.00 2.17 2.12 0.00 3.72 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 1.94 1.97 0.00 124 E 7.74 4.69 0.00 2.01 1.88 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 2.22 2.35 0.00 125 P 0.00 4.62 0.00 2.18 2.04 0.00 3.77 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.95 0.00 126 C 8.58 4.12 0.00 2.98 2.87 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 0.00 127 P 0.00 4.27 0.00 2.08 2.11 0.00 3.81 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.08 0.00 128 K 8.08 4.11 0.00 1.71 1.83 0.00 1.71 0.00 0.00 1.76 0.00 0.00 3.04 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.42 1.43 7.81 129 C 7.85 4.71 0.00 3.22 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 0.00 130 L 8.92 3.64 0.00 1.84 1.78 0.92 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 131 G 8.48 4.46 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 0.00 132 K 7.96 4.03 0.00 1.90 1.88 0.00 1.74 0.00 0.00 1.71 0.00 0.00 2.81 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.38 7.81 133 G 8.60 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 0.00 134 V 7.31 5.06 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 0.78 0.00 0.00 0.98 0.00 0.00 135 I 8.97 4.65 1.87 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 1.35 1.07 0.91 0.00 0.00 136 L 8.40 4.82 0.00 1.56 1.64 0.94 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 137 T 8.60 4.37 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 1.20 0.00 0.00 138 A 8.73 3.96 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 Q 8.14 3.98 0.00 2.17 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.85 0.00 0.00 0.00 0.00 0.00 2.42 2.49 0.00 140 G 8.27 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 S 8.40 4.15 0.00 3.90 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 0.00 142 T 8.19 3.92 4.37 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 1.20 0.00 0.00 143 L 7.91 4.08 0.00 1.77 1.77 0.93 0.45 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 0.00 144 L 8.12 3.99 0.00 1.93 1.71 0.94 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 145 H 8.50 4.14 0.00 3.39 3.51 0.00 5.65 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 146 F 8.23 4.23 0.00 3.23 3.26 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 0.00 147 I 8.03 3.45 1.89 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.78 0.89 0.00 0.00 148 K 8.00 3.84 0.00 1.80 1.79 0.00 1.66 0.00 0.00 1.55 0.00 0.00 2.89 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.43 1.59 7.81 149 K 7.59 3.63 0.00 1.60 1.73 0.00 1.55 0.00 0.00 1.55 0.00 0.00 3.00 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.12 1.29 7.81 150 H 7.56 4.30 0.00 2.77 3.14 0.00 5.69 0.00 0.00 0.00 0.00 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 I 7.81 4.16 1.91 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 1.47 0.92 0.89 0.00 0.00 152 H 8.70 4.05 0.00 3.22 3.38 0.00 5.63 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 153 E 7.50 4.36 0.00 1.97 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 2.13 2.25 0.00