NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 19 E 4.2160 8.3027 118.7834 56.3596 31.5377 177.6965 20 I 3.6134 7.6350 118.2457 62.2745 38.2410 173.8550 21 D 4.8134 7.1113 119.0658 52.5078 45.3648 174.6682 22 Y 4.3097 8.3365 120.1310 59.3076 38.5733 177.6823 23 K 3.8187 6.5991 118.2822 58.6854 33.5115 176.5408 24 D 4.6123 7.2532 122.5628 53.9155 40.2787 177.1329 25 I 3.9629 7.5516 113.1443 62.5369 37.7375 176.8597 26 A 4.0211 7.9678 123.0015 55.1902 18.6907 178.6614 27 T 4.4337 8.1603 106.3088 62.5640 69.7169 176.9516 28 L 4.2187 7.8225 122.5137 57.4788 41.5723 178.7368 29 K 4.0644 7.7026 117.8412 59.5480 32.3227 178.0704 30 N 4.4474 8.0127 117.5257 55.5430 39.1975 174.5320 31 Y 4.8865 8.4137 118.3870 57.2427 39.5021 175.2153 32 I 5.1543 7.6897 112.4327 59.1065 40.4565 174.8916 33 T 3.9596 9.0752 117.5387 61.6289 69.7849 174.0714 34 E 4.5306 8.6590 120.3447 56.9591 29.1349 177.7917 35 S 5.5616 7.2634 113.0564 56.5229 64.5545 174.3516 36 G 4.0107 7.8343 108.0578 45.3346 0.0000 174.3299 37 K 4.3795 7.9684 119.5903 55.5690 33.5469 176.9080 38 I 4.2661 8.3222 123.7347 61.6504 37.9867 175.3499 39 V 4.4282 7.9227 124.3657 60.3102 33.3222 174.0467 40 P 4.4107 0.0000 0.0000 62.5519 32.1301 177.4873 41 S 4.1750 8.9023 118.1190 61.5840 62.6492 176.7645 42 R 4.0722 8.0942 117.9557 58.3234 28.8829 177.7090 43 I 4.2021 7.5815 119.8681 63.6185 38.2993 177.6907 44 T 4.0833 7.8487 108.1279 62.9166 69.0255 175.5169 45 G 3.9633 8.8671 110.2189 45.1220 0.0000 173.6458 46 T 3.7807 7.5182 113.5827 62.4587 67.9597 174.1105 47 R 4.1546 8.3640 124.4370 55.9056 31.5566 177.8169 48 A 3.9478 8.3483 120.5742 55.3731 18.3013 179.6298 49 K 3.8508 8.2408 117.5029 60.0338 32.0344 178.4110 50 Y 3.9051 8.2091 116.3113 61.1324 37.9858 177.3328 51 Q 3.9273 8.0031 120.1306 59.8170 29.0438 179.0849 52 R 3.8956 8.1183 118.5423 59.2343 30.1675 178.7771 53 Q 3.8636 7.7863 117.2587 59.4111 28.7947 179.4622 54 L 3.7789 8.5538 121.0403 57.8828 42.0057 178.4231 55 A 3.9669 8.2913 120.5016 55.8028 18.2895 179.2335 56 R 3.8023 7.9472 115.5168 59.7712 30.0848 178.4894 57 A 4.0372 7.9802 119.1113 55.8394 18.2135 179.3885 58 I 3.6335 7.7418 116.7324 64.6555 37.6977 178.4335 59 K 4.0385 8.3517 118.9843 59.7361 32.0562 179.0557 60 R 3.8431 8.3390 118.1986 59.7690 29.9694 178.5029 61 A 4.1086 8.3603 119.9717 55.5719 18.3800 179.6951 62 R 4.5178 7.6664 117.2825 59.2057 29.8740 178.9736 63 Y 4.2201 7.9998 114.3133 60.7703 38.1300 176.5604 64 L 4.3873 7.8338 117.0325 54.1955 41.7101 176.5926 65 S 3.8452 7.7736 113.6727 59.5506 61.1441 173.8682 66 L 4.3243 8.2310 120.9819 56.3044 42.3656 177.6505 67 L 4.8399 7.5463 117.2707 51.8671 44.3460 174.0918 68 P 4.8037 0.0000 0.0000 62.5351 33.0202 174.8324 69 Y 3.6501 8.7584 118.7907 60.3028 37.3295 180.0132 70 T 4.2271 8.6895 123.6815 62.4519 68.9698 170.3170 71 D 4.7785 8.3025 113.4866 56.2262 43.6782 179.3522 72 R 3.8250 7.6611 114.6948 59.1860 29.7973 175.7218 73 H 4.5033 7.5461 118.8992 55.1904 28.8250 174.8738 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 4.22 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 2.00 1.86 0.00 20 I 7.64 3.61 1.80 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 1.37 0.88 0.86 0.00 0.00 21 D 7.11 4.81 0.00 2.64 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 0.00 0.00 0.00 0.00 22 Y 8.34 4.31 0.00 3.32 3.22 0.00 0.00 0.00 0.00 0.00 0.00 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 3.82 0.00 1.64 1.47 0.00 1.34 0.00 0.00 1.12 0.00 0.00 2.80 0.00 0.00 2.79 0.00 0.00 0.00 0.00 0.55 1.09 7.81 24 D 7.25 4.61 0.00 2.82 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 7.55 3.96 1.92 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 1.59 0.68 1.06 0.00 0.00 26 A 7.97 4.02 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 27 T 8.16 4.43 4.40 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 1.26 0.00 0.00 28 L 7.82 4.22 0.00 1.81 1.82 0.97 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 29 K 7.70 4.06 0.00 1.90 1.99 0.00 1.61 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.77 1.47 7.81 30 N 8.01 4.45 0.00 2.69 2.98 0.00 0.00 7.02 7.45 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 31 Y 8.41 4.89 0.00 2.93 2.94 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 32 I 7.69 5.15 1.98 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 1.43 0.55 0.96 0.00 0.00 33 T 9.08 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 1.21 0.00 0.00 34 E 8.66 4.53 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 7.26 5.56 0.00 3.95 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 36 G 7.83 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 0.00 0.00 0.00 37 K 7.97 4.38 0.00 1.75 1.73 0.00 1.68 0.00 0.00 1.65 0.00 0.00 2.97 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.44 1.42 7.81 38 I 8.32 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 7.92 4.43 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 0.78 0.00 0.00 1.01 0.00 0.00 40 P 0.00 4.41 0.00 2.23 1.98 0.00 3.67 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 2.12 2.09 0.00 41 S 8.90 4.18 0.00 4.25 4.17 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 0.00 0.00 0.00 42 R 8.09 4.07 0.00 1.99 2.14 0.00 3.02 0.00 0.00 3.23 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.75 0.00 43 I 7.58 4.20 2.05 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 1.59 0.89 0.91 0.00 0.00 44 T 7.85 4.08 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 1.35 0.00 0.00 45 G 8.87 3.96 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 0.00 0.00 0.00 0.00 0.00 0.00 46 T 7.52 3.78 4.40 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 1.34 0.00 0.00 47 R 8.36 4.15 0.00 2.02 1.96 0.00 2.21 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 1.46 1.59 0.00 48 A 8.35 3.95 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.24 3.85 0.00 1.88 2.05 0.00 1.80 0.00 0.00 1.81 0.00 0.00 3.11 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.55 1.55 7.81 50 Y 8.21 3.91 0.00 2.96 2.97 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 51 Q 8.00 3.93 0.00 2.33 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.80 0.00 0.00 0.00 0.00 0.00 2.40 2.51 0.00 52 R 8.12 3.90 0.00 2.08 1.94 0.00 3.22 0.00 0.00 3.18 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.86 0.00 53 Q 7.79 3.86 0.00 2.13 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.80 0.00 0.00 0.00 0.00 0.00 2.27 2.52 0.00 54 L 8.55 3.78 0.00 1.67 1.76 0.49 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 55 A 8.29 3.97 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 56 R 7.95 3.80 0.00 2.08 1.97 0.00 3.31 0.00 0.00 3.16 7.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.80 0.00 57 A 7.98 4.04 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 58 I 7.74 3.63 1.99 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 1.54 0.79 0.88 0.00 0.00 59 K 8.35 4.04 0.00 2.07 2.14 0.00 1.73 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.51 1.48 7.81 60 R 8.34 3.84 0.00 1.82 1.48 0.00 3.15 0.00 0.00 2.95 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.80 0.00 61 A 8.36 4.11 1.44 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 0.00 0.00 62 R 7.67 4.52 0.00 1.60 1.05 0.00 2.67 0.00 0.00 2.25 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.61 0.00 63 Y 8.00 4.22 0.00 3.07 3.07 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 0.00 0.00 0.00 64 L 7.83 4.39 0.00 1.90 1.77 0.93 0.92 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 65 S 7.77 3.85 0.00 4.03 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 66 L 8.23 4.32 0.00 1.71 1.78 1.09 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 67 L 7.55 4.84 0.00 1.65 1.51 0.94 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 68 P 0.00 4.80 0.00 2.37 2.08 0.00 3.77 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 1.99 2.00 0.00 69 Y 8.76 3.65 0.00 2.88 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 70 T 8.69 4.23 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 1.28 0.00 0.00 71 D 8.30 4.78 0.00 2.92 2.55 0.00 0.00 0.00 0.00 0.00 0.00 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 7.66 3.83 0.00 1.73 1.97 0.00 3.26 0.00 0.00 3.22 7.29 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 7.55 4.50 0.00 3.26 3.25 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