NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 77 I 4.1758 8.0093 121.4596 60.7959 38.6831 175.6282 78 S 4.0252 8.6311 120.6233 56.6096 64.2267 173.0783 79 P 4.4396 0.0000 0.0000 66.1658 31.1823 179.8396 80 Q 4.0331 8.0383 116.5480 58.5507 28.8630 177.7852 81 A 3.9674 8.1387 122.9227 55.3006 18.5945 179.7323 82 R 3.7045 8.5690 116.4560 59.3006 29.9657 179.3118 83 A 3.9728 7.6556 120.4260 55.0067 18.4615 179.1519 84 F 4.1113 8.3315 119.3129 61.6871 39.3708 177.0262 85 L 3.3968 7.7888 118.4759 57.8907 41.1268 179.6514 86 E 4.2131 8.0082 120.3603 59.8636 29.3096 179.7751 87 E 3.9582 8.2347 118.6469 61.2545 29.7453 181.2837 88 V 3.7551 7.8004 119.8953 65.8374 31.2859 177.9372 89 F 5.0362 8.4027 123.4271 61.5222 39.3128 177.7413 90 R 4.1714 8.1970 119.6033 60.8342 29.1498 181.1448 91 R 4.4762 7.2975 114.2145 57.2854 31.3614 177.1866 92 K 4.5410 7.9217 117.1047 54.9697 36.1782 177.0748 93 Q 3.3879 8.3894 120.9651 56.7169 29.3871 175.9781 94 S 4.8065 7.6167 112.0110 56.5730 66.7797 173.2267 95 L 5.0547 8.1665 120.8364 52.0223 45.2996 176.4287 96 N 4.6083 8.6615 120.9998 52.2122 38.6339 175.8689 97 S 4.0550 8.6809 112.5008 61.5783 62.8346 176.0327 98 K 3.8154 8.1138 123.0982 59.2441 32.0628 177.8384 99 E 3.8958 8.5805 118.5952 59.6830 29.4756 179.2414 100 K 3.8210 8.2428 121.6759 60.4526 31.9933 179.2919 101 E 4.0212 8.0474 118.2638 61.2804 29.7328 181.7479 102 E 4.1475 8.2166 119.9159 59.0984 29.4690 179.2829 103 V 3.9295 8.5235 117.9568 66.4402 31.6220 178.1144 104 A 4.0083 8.1907 120.0411 55.2492 18.0304 179.4131 105 K 3.7718 7.9304 115.5193 60.0994 32.2556 179.0207 106 K 3.7686 7.7250 116.7655 60.0028 31.9958 178.9643 107 C 4.2376 7.8410 116.9022 61.0143 28.1864 175.3429 108 G 3.8852 8.0202 108.0593 45.1727 0.0000 173.0000 109 I 4.4129 7.1648 112.2153 58.7476 40.2359 175.7258 110 T 4.2116 8.4472 112.1183 61.0143 70.6189 173.7607 111 P 4.4037 0.0000 0.0000 64.8403 31.2518 178.8947 112 L 3.9731 7.8670 119.4513 58.2400 42.0742 178.5792 113 Q 4.0960 8.2847 118.3232 59.1562 28.6931 179.4853 114 V 3.8612 7.9267 119.6928 64.4879 31.3909 178.4658 115 R 3.9493 8.3039 119.8991 59.6307 30.0104 178.8931 116 V 3.7042 8.2186 112.4447 64.0391 31.5050 178.1492 117 W 4.0743 8.6394 128.4225 60.8733 30.4583 178.1190 118 F 4.2409 8.9154 117.5011 60.3773 38.3383 177.8481 119 I 3.7753 7.9693 119.6068 64.5570 36.9680 178.1291 120 N 4.1847 8.4156 117.5937 56.0370 38.2489 177.1191 121 K 3.1308 7.4722 120.8908 59.4626 31.8090 178.8660 122 R 4.0441 8.0088 116.9560 59.6341 30.1384 178.4420 123 M 4.1194 8.2369 117.0276 58.2193 32.2119 177.7049 124 R 4.3489 8.3926 119.4884 58.2755 31.1153 177.2390 125 S 4.1718 8.4660 119.0701 58.2841 63.4708 175.2990 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 77 I 8.01 4.18 1.98 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.10 0.91 0.00 0.00 78 S 8.63 4.03 0.00 4.26 4.03 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 0.00 0.00 0.00 0.00 79 P 0.00 4.44 0.00 2.29 2.38 0.00 3.69 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 2.08 2.04 0.00 80 Q 8.04 4.03 0.00 2.27 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.93 0.00 0.00 0.00 0.00 0.00 2.38 2.34 0.00 81 A 8.14 3.97 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 0.00 0.00 82 R 8.57 3.70 0.00 2.02 2.10 0.00 3.21 0.00 0.00 3.34 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 2.03 0.00 83 A 7.66 3.97 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 F 8.33 4.11 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 85 L 7.79 3.40 0.00 0.39 0.13 -0.02 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 86 E 8.01 4.21 0.00 2.21 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 2.71 2.56 0.00 87 E 8.23 3.96 0.00 1.96 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 2.19 0.00 88 V 7.80 3.76 2.13 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 1.11 0.00 0.00 0.14 0.00 0.00 89 F 8.40 5.04 0.00 3.21 3.29 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 90 R 8.20 4.17 0.00 1.95 1.84 0.00 3.31 0.00 0.00 3.22 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.54 0.00 91 R 7.30 4.48 0.00 1.99 1.98 0.00 3.08 0.00 0.00 3.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.79 0.00 92 K 7.92 4.54 0.00 1.68 1.68 0.00 1.61 0.00 0.00 1.58 0.00 0.00 2.98 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.30 1.36 7.81 93 Q 8.39 3.39 0.00 1.84 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.79 0.00 0.00 0.00 0.00 0.00 2.07 1.16 0.00 94 S 7.62 4.81 0.00 3.77 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 L 8.17 5.05 0.00 1.31 1.41 0.30 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.54 0.00 0.00 0.00 0.00 0.00 0.00 96 N 8.66 4.61 0.00 2.92 2.96 0.00 0.00 6.01 7.64 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 97 S 8.68 4.05 0.00 4.06 4.15 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 98 K 8.11 3.82 0.00 1.87 2.01 0.00 1.62 0.00 0.00 1.81 0.00 0.00 3.03 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.50 1.60 7.81 99 E 8.58 3.90 0.00 1.97 1.94 0.00 0.00 0.00 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 2.56 0.00 100 K 8.24 3.82 0.00 1.90 1.97 0.00 1.63 0.00 0.00 1.91 0.00 0.00 2.97 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.44 1.42 7.81 101 E 8.05 4.02 0.00 2.05 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 0.00 2.24 2.22 0.00 102 E 8.22 4.15 0.00 2.14 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 0.00 2.61 2.49 0.00 103 V 8.52 3.93 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 1.18 0.00 0.00 1.01 0.00 0.00 104 A 8.19 4.01 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.93 3.77 0.00 1.91 1.88 0.00 1.72 0.00 0.00 1.69 0.00 0.00 3.02 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.48 1.73 7.81 106 K 7.72 3.77 0.00 1.62 1.04 0.00 1.01 0.00 0.00 1.38 0.00 0.00 2.90 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.24 0.85 7.81 107 C 7.84 4.24 0.00 2.95 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.02 3.89 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 0.00 0.00 0.00 0.00 0.00 0.00 109 I 7.16 4.41 2.04 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 1.49 0.76 0.92 0.00 0.00 110 T 8.45 4.21 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 1.23 0.00 0.00 111 P 0.00 4.40 0.00 2.20 2.15 0.00 3.62 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.15 0.00 112 L 7.87 3.97 0.00 1.78 1.69 0.96 1.00 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 0.00 113 Q 8.28 4.10 0.00 2.36 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.58 0.00 0.00 0.00 0.00 0.00 2.44 2.42 0.00 114 V 7.93 3.86 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 0.99 0.00 0.00 1.17 0.00 0.00 115 R 8.30 3.95 0.00 2.10 2.21 0.00 3.13 0.00 0.00 3.20 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.73 0.00 116 V 8.22 3.70 2.13 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 0.80 0.00 0.00 1.00 0.00 0.00 117 W 8.64 4.07 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 0.00 118 F 8.92 4.24 0.00 3.50 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 0.00 119 I 7.97 3.78 2.05 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 1.59 0.69 0.93 0.00 0.00 120 N 8.42 4.18 0.00 2.39 2.62 0.00 0.00 6.73 7.37 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 0.00 121 K 7.47 3.13 0.00 0.79 1.20 0.00 0.61 0.00 0.00 0.61 0.00 0.00 2.48 0.00 0.00 2.55 0.00 0.00 0.00 0.00 0.30 0.21 7.81 122 R 8.01 4.04 0.00 2.01 2.10 0.00 3.37 0.00 0.00 3.58 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.32 0.00 123 M 8.24 4.12 0.00 2.02 2.11 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.59 0.00 124 R 8.39 4.35 0.00 1.64 1.82 0.00 3.10 0.00 0.00 3.09 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.58 0.00 125 S 8.47 4.17 0.00 3.52 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00