NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 19 E 4.2393 8.3027 118.7903 56.3897 31.4794 177.5124 20 I 3.6417 7.6088 117.9092 62.2353 38.1308 173.4483 21 D 4.8361 7.2350 116.9111 53.4881 45.6873 174.3492 22 Y 4.3920 8.5319 119.2935 59.0022 38.7275 177.7621 23 K 3.5401 6.6010 118.3690 58.8318 33.6560 176.8507 24 D 4.6051 7.2760 122.2135 53.7509 39.3176 176.7191 25 I 4.0918 7.3897 113.0286 62.2240 38.1619 177.4223 26 A 4.0138 7.3453 120.8261 55.0963 18.5601 178.9865 27 T 4.3229 8.0436 106.8032 63.0718 69.5105 177.2251 28 L 4.2580 7.8219 122.4124 57.4591 41.5915 178.8201 29 K 4.0017 7.6327 117.1350 59.5190 32.3178 178.2044 30 N 4.3508 7.7796 117.6705 55.7314 39.0286 174.4625 31 Y 4.9665 8.2749 118.6755 56.9921 39.1481 175.8628 32 I 4.9036 7.7357 112.7387 59.5112 40.4195 174.6355 33 T 3.9636 9.0097 118.1847 61.4602 69.8177 174.6003 34 E 4.4860 8.6688 120.3698 56.9866 29.0216 177.9371 35 S 5.2829 7.5674 113.7131 56.6228 64.9833 173.8806 36 G 3.7823 7.9208 108.6997 45.2662 0.0000 174.3316 37 K 4.3117 7.8549 120.5816 55.7563 33.3099 176.9952 38 I 4.2721 8.3748 124.3640 61.7769 37.9076 175.3543 39 V 4.4122 7.8640 124.9154 60.3274 33.4291 174.0537 40 P 4.3460 0.0000 0.0000 62.7259 31.8686 177.6193 41 S 4.3352 8.8778 117.6317 61.2241 62.9006 176.0500 42 R 4.2124 8.0041 115.1105 57.3640 29.6330 176.5083 43 I 4.3032 8.0283 119.3445 63.3325 38.7880 177.1339 44 T 4.0069 7.9850 107.5065 62.2150 69.0546 175.4690 45 G 3.8794 8.3617 109.9897 45.8910 0.0000 173.6466 46 T 3.9146 7.7397 115.2629 61.3207 66.9777 174.9422 47 R 4.0877 8.4381 125.3598 56.6003 31.3434 176.6194 48 A 3.9337 8.5332 120.5645 54.7223 18.2620 179.4800 49 K 3.8146 8.1300 116.0424 59.9677 32.2956 178.6701 50 Y 3.9243 7.7752 113.3801 61.2764 37.9303 177.9798 51 Q 4.1390 8.1319 120.3893 59.3648 28.8650 179.3362 52 R 3.8776 7.9053 118.3483 59.3008 30.4033 178.2736 53 Q 3.9098 7.6575 117.8771 59.7072 28.7106 179.0052 54 L 3.8367 8.5972 121.1735 57.2385 42.0350 178.5101 55 A 3.9598 8.2504 120.1317 56.6456 18.5605 179.3055 56 R 3.4707 8.1591 112.4917 59.4936 30.0070 178.3600 57 A 4.0278 8.1569 120.0808 55.8962 18.9518 179.5673 58 I 3.7306 7.8234 117.8542 64.6958 37.0101 178.5394 59 K 3.8036 8.2476 117.6847 59.6414 32.3839 178.9358 60 R 4.1221 8.4093 118.2732 59.6986 29.9631 178.6963 61 A 4.2151 8.9897 120.9162 55.5424 18.3561 179.7790 62 R 4.0745 7.7719 117.4017 59.1766 29.8167 178.9315 63 Y 4.3320 7.8118 114.9535 60.3859 37.8504 176.6238 64 L 4.4919 7.8180 117.8006 53.8825 41.9367 176.5734 65 S 3.7951 7.6503 113.5266 59.6945 61.1254 173.7291 66 L 4.2631 8.4049 120.8431 56.9679 42.2752 177.9446 67 L 4.6716 7.5261 117.4758 52.2474 43.7662 174.0658 68 P 4.7319 0.0000 0.0000 62.4008 32.2145 174.6651 69 Y 3.8866 8.1498 117.5848 60.3777 38.4014 181.0413 70 T 4.2866 8.0487 124.0691 62.3364 68.1173 171.6525 71 D 4.6714 8.2619 113.6276 55.4535 43.5333 178.6008 72 R 3.7899 7.7202 115.4411 58.8922 29.7357 175.8695 73 H 4.5152 7.7216 118.5970 55.5289 28.9314 174.1137 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 19 E 8.30 4.24 0.00 1.95 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 0.00 2.01 1.84 0.00 20 I 7.61 3.64 1.82 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.89 0.88 0.00 0.00 21 D 7.23 4.84 0.00 2.59 2.24 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 0.00 22 Y 8.53 4.39 0.00 3.35 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 23 K 6.60 3.54 0.00 1.63 1.49 0.00 1.35 0.00 0.00 1.20 0.00 0.00 2.86 0.00 0.00 2.78 0.00 0.00 0.00 0.00 0.51 1.10 7.81 24 D 7.28 4.61 0.00 2.53 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 25 I 7.39 4.09 1.90 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.67 1.03 0.00 0.00 26 A 7.35 4.01 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.04 4.32 4.38 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 1.27 0.00 0.00 28 L 7.82 4.26 0.00 1.81 1.82 1.02 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 29 K 7.63 4.00 0.00 1.92 1.97 0.00 1.60 0.00 0.00 1.62 0.00 0.00 2.94 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.70 1.51 7.81 30 N 7.78 4.35 0.00 2.54 2.66 0.00 0.00 7.05 8.41 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 31 Y 8.27 4.97 0.00 2.98 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 32 I 7.74 4.90 1.97 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 1.42 0.37 0.96 0.00 0.00 33 T 9.01 3.96 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 1.22 0.00 0.00 34 E 8.67 4.49 0.00 1.98 2.00 0.00 0.00 0.00 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 2.23 0.00 35 S 7.57 5.28 0.00 3.93 3.94 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 0.00 0.00 0.00 36 G 7.92 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 37 K 7.85 4.31 0.00 1.74 1.73 0.00 1.68 0.00 0.00 1.65 0.00 0.00 3.00 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.46 1.42 7.81 38 I 8.37 4.27 1.88 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 1.23 0.44 0.94 0.00 0.00 39 V 7.86 4.41 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 0.79 0.00 0.00 1.02 0.00 0.00 40 P 0.00 4.35 0.00 2.23 1.99 0.00 3.69 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.10 0.00 41 S 8.88 4.34 0.00 4.27 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 R 8.00 4.21 0.00 1.95 2.10 0.00 3.00 0.00 0.00 3.23 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.66 0.00 43 I 8.03 4.30 2.05 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.94 0.92 0.00 0.00 44 T 7.99 4.01 4.42 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 45 G 8.36 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 0.00 0.00 0.00 46 T 7.74 3.91 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 47 R 8.44 4.09 0.00 1.99 1.94 0.00 2.27 0.00 0.00 3.06 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.51 0.00 48 A 8.53 3.93 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.13 3.81 0.00 1.86 2.01 0.00 1.92 0.00 0.00 1.84 0.00 0.00 3.10 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.56 1.56 7.81 50 Y 7.78 3.92 0.00 3.07 2.93 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 51 Q 8.13 4.14 0.00 2.30 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.84 0.00 0.00 0.00 0.00 0.00 2.38 2.48 0.00 52 R 7.91 3.88 0.00 2.04 1.94 0.00 3.22 0.00 0.00 3.34 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.88 0.00 53 Q 7.66 3.91 0.00 2.04 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.80 0.00 0.00 0.00 0.00 0.00 2.29 2.48 0.00 54 L 8.60 3.84 0.00 1.69 1.63 0.62 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 55 A 8.25 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 56 R 8.16 3.47 0.00 2.10 1.86 0.00 3.30 0.00 0.00 3.15 8.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.82 0.00 57 A 8.16 4.03 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 I 7.82 3.73 2.01 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.31 0.89 0.00 0.00 59 K 8.25 3.80 0.00 1.96 2.15 0.00 1.76 0.00 0.00 1.76 0.00 0.00 3.07 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.50 1.48 7.81 60 R 8.41 4.12 0.00 1.83 1.54 0.00 2.96 0.00 0.00 2.76 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.79 0.00 61 A 8.99 4.22 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 R 7.77 4.07 0.00 1.37 1.04 0.00 2.56 0.00 0.00 2.25 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.65 0.00 63 Y 7.81 4.33 0.00 3.14 3.09 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 64 L 7.82 4.49 0.00 1.92 1.79 1.17 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 65 S 7.65 3.80 0.00 4.02 3.92 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 66 L 8.40 4.26 0.00 1.77 1.77 1.04 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 67 L 7.53 4.67 0.00 1.66 1.55 0.93 1.00 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 68 P 0.00 4.73 0.00 2.39 2.07 0.00 3.76 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 1.97 1.99 0.00 69 Y 8.15 3.89 0.00 2.85 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 T 8.05 4.29 4.30 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 1.27 0.00 0.00 71 D 8.26 4.67 0.00 2.86 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 R 7.72 3.79 0.00 1.74 2.00 0.00 3.24 0.00 0.00 3.22 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.59 0.00 73 H 7.72 4.52 0.00 3.14 3.23 0.00 5.88 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00