NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 15 K 4.3220 8.3144 120.1385 56.7513 32.5697 174.4757 16 D 4.4858 8.1258 121.8743 52.7411 44.0049 172.5167 17 D 4.8894 8.7833 124.9179 53.6534 45.8096 174.0336 18 E 3.6805 8.6248 115.0631 57.8312 26.7885 174.6859 19 A 4.6339 7.7350 119.2022 51.6092 20.9539 177.6235 20 T 4.5495 8.4972 114.3599 64.3742 71.0805 174.2827 21 H 4.8396 7.7631 115.1543 53.1650 32.6868 172.5906 22 C 4.0912 7.8433 122.1153 59.0179 31.7706 174.6166 23 R 3.6761 7.9450 127.8800 59.2322 29.0676 176.5933 24 Q 4.3155 7.4326 118.3409 57.9465 29.8502 175.7498 25 C 4.2154 7.8812 112.4479 58.6028 30.6806 174.9098 26 E 3.7404 8.1590 118.5661 56.6682 27.4605 174.5407 27 K 4.2053 7.1493 118.5289 56.1459 33.5287 175.6571 28 E 4.3803 8.4215 123.3506 55.6393 30.2819 176.3485 29 F 4.6936 8.4727 126.3299 58.1065 40.1664 174.9350 30 S 4.5825 8.4674 114.4571 57.9715 65.7940 175.6893 31 I 3.7429 8.4364 120.2625 64.7441 36.7557 177.5982 32 S 4.3391 7.5671 113.2148 59.4041 63.1743 174.3186 33 R 4.5010 7.9584 120.6573 53.7276 30.6036 174.2325 34 R 4.1532 8.4776 123.0757 56.2782 30.8127 176.5153 35 K 4.0443 7.9734 119.9407 55.5019 33.7269 175.6625 36 H 5.0047 8.8049 119.2172 54.6044 33.6284 171.8528 37 H 5.4038 8.8217 117.3240 54.3405 31.1501 173.6902 38 C 4.5629 8.9418 123.4370 58.5855 32.1217 174.6880 39 R 4.0473 9.0964 126.1881 58.0792 29.9584 177.1049 40 N 4.6603 8.1081 115.8686 54.6582 39.8487 174.9123 41 C 4.7069 7.9229 109.8584 56.8420 30.9750 175.3694 42 G 4.0932 8.5365 108.3134 46.2337 0.0000 173.6952 43 H 4.5878 7.8019 115.8887 55.5207 30.6270 174.3047 44 I 4.6838 7.9884 120.9885 60.5976 38.6278 175.1015 45 F 5.4685 9.6725 125.5121 55.5554 43.2395 174.6263 46 C 5.2565 8.9168 115.6011 57.6144 31.0327 174.2421 47 N 4.3584 8.8884 117.8065 57.1896 38.2086 176.9164 48 T 3.9718 7.9307 115.8757 66.3011 68.7986 175.3961 49 C 4.5295 7.8921 115.7963 59.8462 28.8188 173.6729 50 S 4.9356 7.9340 114.6664 56.5210 62.6293 174.6418 51 S 4.4253 8.1143 112.1991 59.7551 63.6184 173.2406 52 N 5.0754 7.7039 118.4702 51.7161 41.6289 173.1697 53 E 5.3089 8.5887 120.4899 54.8362 33.0667 175.0458 54 L 4.7301 8.6667 121.6748 54.1249 44.6319 174.8517 55 A 4.4221 8.5408 123.3171 52.0856 19.0115 177.1272 56 L 4.7823 8.1014 122.1871 53.0188 44.4453 175.6778 57 P 4.0538 0.0000 0.0000 65.7987 31.7227 177.3842 58 S 4.0246 8.1172 112.9313 60.5600 62.4789 173.8589 59 Y 4.7550 8.0460 117.1565 55.7561 39.7762 174.1069 60 P 4.4559 0.0000 0.0000 64.6062 31.8516 176.8350 61 K 4.7407 7.6470 114.4630 53.1747 35.5115 173.7767 62 P 4.5007 0.0000 0.0000 63.6487 31.8092 176.2180 63 V 4.4297 8.3474 115.7148 59.0314 35.8924 174.8096 64 R 4.5343 8.1981 122.4728 56.5811 30.7356 175.5947 65 V 4.7982 8.7548 118.6679 59.4166 36.5576 175.1202 66 C 4.0553 8.1233 117.6644 57.4258 30.6108 174.3990 67 D 4.2786 8.2854 120.2179 57.4389 40.0956 178.9934 68 S 4.0570 7.9243 113.0993 61.8287 62.4618 175.8594 69 C 4.1199 7.9811 118.7306 62.9671 27.6351 175.5861 70 H 4.0931 8.0466 119.2307 59.6387 29.6393 177.2243 71 T 3.9382 8.1258 117.7064 66.3231 67.8223 176.4410 72 L 3.9421 8.2501 122.7175 58.0900 41.9713 178.3506 73 L 4.2622 7.8441 115.2479 55.2949 41.9410 177.7548 74 L 4.4534 7.1883 118.2571 54.5306 42.2559 176.0978 75 Q 4.1033 7.4372 125.3177 56.2515 29.0033 175.2610 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 15 K 8.31 4.32 0.00 1.77 1.87 0.00 1.74 0.00 0.00 1.70 0.00 0.00 2.89 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.35 1.45 7.81 16 D 8.13 4.49 0.00 2.66 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 D 8.78 4.89 0.00 2.69 2.54 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 18 E 8.62 3.68 0.00 2.09 2.01 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 2.22 2.28 0.00 19 A 7.74 4.63 1.27 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 0.00 0.00 0.00 20 T 8.50 4.55 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 0.95 0.00 0.00 21 H 7.76 4.84 0.00 3.00 3.13 0.00 5.70 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 C 7.84 4.09 0.00 2.56 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 23 R 7.94 3.68 0.00 1.12 1.30 0.00 3.33 0.00 0.00 3.08 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.40 0.00 24 Q 7.43 4.32 0.00 2.51 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.84 0.00 0.00 0.00 0.00 0.00 2.39 2.44 0.00 25 C 7.88 4.22 0.00 3.14 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 E 8.16 3.74 0.00 2.11 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 2.16 2.22 0.00 27 K 7.15 4.21 0.00 1.71 1.64 0.00 1.62 0.00 0.00 1.54 0.00 0.00 2.80 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.41 1.33 7.81 28 E 8.42 4.38 0.00 1.98 1.80 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 2.25 2.11 0.00 29 F 8.47 4.69 0.00 2.97 2.85 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 0.00 0.00 0.00 30 S 8.47 4.58 0.00 3.97 3.98 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 0.00 0.00 0.00 31 I 8.44 3.74 1.88 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 1.42 0.42 0.92 0.00 0.00 32 S 7.57 4.34 0.00 3.99 3.93 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 33 R 7.96 4.50 0.00 1.85 1.96 0.00 3.02 0.00 0.00 3.05 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.64 0.00 34 R 8.48 4.15 0.00 1.88 1.75 0.00 3.26 0.00 0.00 3.13 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.61 0.00 35 K 7.97 4.04 0.00 1.25 1.14 0.00 1.36 0.00 0.00 1.13 0.00 0.00 2.59 0.00 0.00 2.74 0.00 0.00 0.00 0.00 0.30 0.87 7.81 36 H 8.80 5.00 0.00 3.25 3.15 0.00 5.58 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 H 8.82 5.40 0.00 3.04 3.28 0.00 5.89 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 38 C 8.94 4.56 0.00 2.85 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 39 R 9.10 4.05 0.00 1.65 1.39 0.00 2.93 0.00 0.00 2.96 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.62 1.49 0.00 40 N 8.11 4.66 0.00 2.65 2.83 0.00 0.00 6.81 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 41 C 7.92 4.71 0.00 3.24 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 42 G 8.54 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 43 H 7.80 4.59 0.00 3.45 2.91 0.00 5.61 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 44 I 7.99 4.68 1.78 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 1.13 0.12 0.44 0.00 0.00 45 F 9.67 5.47 0.00 2.96 3.02 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 46 C 8.92 5.26 0.00 3.27 3.17 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 47 N 8.89 4.36 0.00 2.96 2.90 0.00 0.00 6.88 7.22 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 48 T 7.93 3.97 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 1.22 0.00 0.00 49 C 7.89 4.53 0.00 3.20 3.06 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.93 4.94 0.00 3.81 3.72 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.11 4.43 0.00 3.95 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 52 N 7.70 5.08 0.00 2.53 2.55 0.00 0.00 6.84 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 E 8.59 5.31 0.00 1.76 1.76 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 2.13 2.21 0.00 54 L 8.67 4.73 0.00 1.67 1.72 0.92 0.49 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 55 A 8.54 4.42 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.10 4.78 0.00 1.67 1.81 0.95 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 57 P 0.00 4.05 0.00 2.09 2.08 0.00 3.75 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.16 0.00 58 S 8.12 4.02 0.00 3.66 3.69 0.00 0.00 0.00 0.00 0.00 0.00 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 8.05 4.76 0.00 3.02 2.90 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.46 0.00 2.08 2.12 0.00 3.76 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.12 0.00 61 K 7.65 4.74 0.00 1.72 1.69 0.00 1.79 0.00 0.00 1.72 0.00 0.00 2.99 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.34 1.44 7.81 62 P 0.00 4.50 0.00 1.91 1.98 0.00 3.61 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.14 0.00 63 V 8.35 4.43 1.67 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 0.26 0.00 0.00 0.53 0.00 0.00 64 R 8.20 4.53 0.00 1.84 1.73 0.00 3.30 0.00 0.00 3.32 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.76 0.00 65 V 8.75 4.80 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 0.77 0.00 0.00 0.95 0.00 0.00 66 C 8.12 4.06 0.00 2.15 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 D 8.29 4.28 0.00 2.76 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 S 7.92 4.06 0.00 3.90 3.85 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 0.00 0.00 0.00 69 C 7.98 4.12 0.00 2.93 2.95 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 70 H 8.05 4.09 0.00 3.17 3.42 0.00 5.76 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 T 8.13 3.94 4.39 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 1.20 0.00 0.00 72 L 8.25 3.94 0.00 1.81 1.85 0.93 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 73 L 7.84 4.26 0.00 1.62 1.67 1.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 74 L 7.19 4.45 0.00 1.45 1.63 0.76 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 75 Q 7.44 4.10 0.00 1.95 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.02 6.55 0.00 0.00 0.00 0.00 0.00 2.36 2.43 0.00