NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 7 R 4.8635 8.0132 119.1034 56.2777 32.6740 177.5527 8 K 4.2715 7.8411 118.7069 58.4440 31.9247 177.5623 9 Q 4.0883 7.8861 118.3277 58.3658 29.3631 177.4209 10 D 4.4335 7.9109 119.9965 56.0413 39.8411 178.7314 11 T 3.5576 8.5019 111.9223 64.5483 68.9163 176.9004 12 Q 3.7492 7.8477 120.8546 58.6516 28.8744 178.7081 13 R 3.9880 7.9194 119.2100 58.7784 29.8902 178.5221 14 A 3.8314 7.5550 121.1745 54.9625 18.6151 179.6314 15 L 3.8740 7.6101 118.4952 58.8689 40.4728 179.0299 16 H 3.9850 8.6062 119.6701 59.1036 29.7781 177.2174 17 L 3.5391 7.6218 120.7381 57.4763 41.3235 179.4807 18 L 4.0087 8.0103 119.2915 57.8497 41.7011 179.4106 19 E 3.9703 8.0739 118.4471 59.5708 29.5336 179.3607 20 E 4.0620 8.0076 118.3054 59.2742 29.2473 179.0938 21 Y 4.4390 7.9257 116.9663 61.0229 38.3237 177.9781 22 R 4.1326 8.6604 117.4210 59.6484 29.2136 178.9689 23 S 4.1818 7.8185 114.6791 60.6190 62.9679 175.9638 24 K 4.3713 7.7270 117.7111 57.7756 32.8541 177.8596 25 L 4.2198 7.7604 121.8850 59.3815 42.7456 180.6385 26 S 4.3838 7.9895 116.4415 58.9679 63.1664 175.7306 27 Q 3.7520 8.9720 125.8201 58.0281 26.2114 173.4386 28 T 4.6154 7.3934 110.7551 61.8370 71.1065 175.0350 29 E 5.1555 7.7307 115.5675 55.9420 31.2238 176.5363 30 D 4.7884 7.3755 116.4955 53.2821 42.5119 177.1088 31 R 4.4272 8.0062 123.4136 59.2751 30.8158 178.8156 32 Q 4.0241 8.0965 117.2311 58.7969 28.7214 178.6769 33 L 3.9537 7.8886 121.0713 58.2362 42.2664 179.1498 34 R 3.9900 7.9527 115.7808 59.1989 29.1520 178.6451 35 S 4.1068 7.9269 113.9891 61.2532 62.4251 176.2770 36 S 4.1009 7.9106 116.6308 61.5845 62.4734 176.4910 37 I 3.7328 7.4240 122.3406 63.9627 37.0422 177.8942 38 E 4.1240 8.5941 119.9719 59.5528 29.4165 179.5501 39 R 3.8476 8.1193 116.0551 59.5410 29.2327 178.9592 40 V 3.4060 7.6855 118.5212 65.5138 31.3971 178.0372 41 I 3.8097 7.9463 120.4363 64.1939 36.9683 178.2440 42 S 4.0874 7.9630 114.3563 61.8887 62.5623 176.4537 43 I 3.5633 7.4811 122.2212 63.7709 36.7505 178.2732 44 F 3.4361 7.4992 118.2874 60.1368 39.0109 177.2094 45 Q 4.2830 8.6085 114.9178 56.0174 29.2800 176.0183 46 S 4.2062 7.6734 116.8456 58.8729 63.2493 174.6997 47 N 4.4256 8.7415 122.8544 56.3749 38.6884 177.2200 48 L 4.0597 7.8499 121.5351 57.8842 42.4151 177.9743 49 F 4.0391 8.3584 120.1384 61.8274 39.2594 176.8026 50 Q 4.0277 8.2213 116.7283 59.0216 28.5920 178.9953 51 A 3.9591 7.5689 120.1447 55.1802 18.4297 179.6555 52 L 3.8161 7.9107 117.3696 58.0935 41.4808 179.7611 53 I 3.5668 7.3005 118.3169 64.5386 37.0946 177.9042 54 D 4.5164 7.9426 119.6897 57.0577 40.5337 178.8409 55 I 3.6670 7.5613 120.5406 64.4483 37.0383 178.2838 56 Q 4.1644 8.1686 118.3672 59.5204 27.7716 178.5730 57 E 3.8880 7.4379 119.8768 59.3994 29.4747 178.7191 58 F 4.7174 8.3574 115.5798 57.6114 41.2220 174.5932 59 Y 4.5700 7.6176 117.9282 55.7688 38.1329 174.4307 60 E 4.0138 8.1320 119.1017 56.5769 28.4334 176.7731 61 V 3.7891 7.9810 115.8294 61.1213 30.7715 176.0366 62 T 4.2095 8.2453 122.3623 62.4245 68.8832 174.5215 63 L 4.5011 8.4088 129.1077 53.7262 43.2431 175.7586 64 L 4.5934 8.4514 124.4974 56.5197 42.4097 176.7407 65 D 4.7307 8.0224 116.7358 53.8503 41.0435 175.9080 66 N 4.5052 8.0199 122.6736 53.2007 37.2153 174.7338 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 7 R 8.01 4.86 0.00 1.90 2.09 0.00 3.42 0.00 0.00 3.39 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.64 0.00 8 K 7.84 4.27 0.00 1.89 1.88 0.00 1.96 0.00 0.00 1.78 0.00 0.00 3.01 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.54 1.46 7.81 9 Q 7.89 4.09 0.00 2.05 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.91 0.00 0.00 0.00 0.00 0.00 2.44 2.35 0.00 10 D 7.91 4.43 0.00 2.86 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 11 T 8.50 3.56 4.34 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 1.53 0.00 0.00 12 Q 7.85 3.75 0.00 2.31 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 7.07 0.00 0.00 0.00 0.00 0.00 2.38 2.38 0.00 13 R 7.92 3.99 0.00 1.93 1.93 0.00 3.04 0.00 0.00 3.10 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.62 0.00 14 A 7.56 3.83 1.15 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 0.00 0.00 15 L 7.61 3.87 0.00 1.89 1.21 0.89 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 16 H 8.61 3.99 0.00 3.42 3.20 0.00 5.79 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 L 7.62 3.54 0.00 1.81 1.10 0.97 0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 18 L 8.01 4.01 0.00 1.79 1.76 1.16 0.95 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 19 E 8.07 3.97 0.00 2.20 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 2.30 2.30 0.00 20 E 8.01 4.06 0.00 2.01 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 0.00 2.31 2.31 0.00 21 Y 7.93 4.44 0.00 3.07 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 22 R 8.66 4.13 0.00 2.01 2.24 0.00 2.80 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.72 0.00 23 S 7.82 4.18 0.00 4.14 3.99 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 0.00 0.00 0.00 0.00 24 K 7.73 4.37 0.00 1.98 1.96 0.00 1.85 0.00 0.00 1.86 0.00 0.00 3.03 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.75 1.49 7.81 25 L 7.76 4.22 0.00 1.94 1.82 0.94 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 26 S 7.99 4.38 0.00 3.93 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 27 Q 8.97 3.75 0.00 2.19 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.19 6.98 0.00 0.00 0.00 0.00 0.00 2.27 2.39 0.00 28 T 7.39 4.62 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 1.25 0.00 0.00 29 E 7.73 5.16 0.00 2.05 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 2.03 2.16 0.00 30 D 7.38 4.79 0.00 2.67 2.60 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.01 4.43 0.00 1.82 1.97 0.00 3.58 0.00 0.00 3.30 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.53 0.00 32 Q 8.10 4.02 0.00 2.09 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.90 0.00 0.00 0.00 0.00 0.00 2.45 2.42 0.00 33 L 7.89 3.95 0.00 1.87 1.86 0.93 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 34 R 7.95 3.99 0.00 2.26 2.20 0.00 3.02 0.00 0.00 3.10 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.65 0.00 35 S 7.93 4.11 0.00 4.07 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 36 S 7.91 4.10 0.00 4.12 4.11 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.42 3.73 2.07 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.84 1.01 0.00 0.00 38 E 8.59 4.12 0.00 2.15 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 0.00 2.33 2.33 0.00 39 R 8.12 3.85 0.00 1.98 2.17 0.00 2.75 0.00 0.00 3.06 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.69 0.00 40 V 7.69 3.41 2.29 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 0.90 0.00 0.00 0.93 0.00 0.00 41 I 7.95 3.81 2.02 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 1.79 0.85 0.95 0.00 0.00 42 S 7.96 4.09 0.00 4.02 4.11 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.48 3.56 1.66 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.58 0.57 0.00 0.00 44 F 7.50 3.44 0.00 3.10 2.80 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 45 Q 8.61 4.28 0.00 2.17 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.91 0.00 0.00 0.00 0.00 0.00 2.62 2.37 0.00 46 S 7.67 4.21 0.00 4.08 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 47 N 8.74 4.43 0.00 2.85 2.82 0.00 0.00 6.69 6.68 0.00 0.00 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 L 7.85 4.06 0.00 1.75 1.69 0.93 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 49 F 8.36 4.04 0.00 3.25 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 50 Q 8.22 4.03 0.00 2.14 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.67 6.94 0.00 0.00 0.00 0.00 0.00 2.78 2.63 0.00 51 A 7.57 3.96 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 L 7.91 3.82 0.00 1.67 1.52 0.88 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 53 I 7.30 3.57 1.93 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 1.08 0.07 0.87 0.00 0.00 54 D 7.94 4.52 0.00 2.99 2.71 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 0.00 0.00 0.00 0.00 55 I 7.56 3.67 1.93 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.84 0.59 0.00 0.00 56 Q 8.17 4.16 0.00 2.26 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.51 6.66 0.00 0.00 0.00 0.00 0.00 2.28 2.46 0.00 57 E 7.44 3.89 0.00 2.23 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 0.00 2.51 2.68 0.00 58 F 8.36 4.72 0.00 3.05 2.86 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 0.00 0.00 0.00 0.00 59 Y 7.62 4.57 0.00 2.93 2.88 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 60 E 8.13 4.01 0.00 1.93 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 2.30 2.39 0.00 61 V 7.98 3.79 2.10 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 0.82 0.00 0.00 0.98 0.00 0.00 62 T 8.25 4.21 4.25 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 1.22 0.00 0.00 63 L 8.41 4.50 0.00 1.60 1.72 0.93 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 64 L 8.45 4.59 0.00 1.76 1.73 0.93 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 65 D 8.02 4.73 0.00 2.67 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 0.00 66 N 8.02 4.51 0.00 2.83 2.81 0.00 0.00 6.01 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00