NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 12 E 4.3488 8.4449 121.4700 56.0919 30.8781 174.2858 13 L 4.5732 8.1080 117.6908 52.1950 45.5028 170.5789 14 V 4.2455 8.3770 121.8555 60.8591 34.7277 174.2211 15 D 4.5511 8.5952 126.9840 52.7389 40.8796 174.7303 16 P 4.2585 0.0000 0.0000 65.8323 30.8194 177.3574 17 L 3.9580 8.5337 121.3802 58.2174 42.1566 178.4822 18 T 3.8919 7.9415 109.8574 65.3365 68.4575 176.4500 19 T 4.0322 7.7949 117.7131 66.7736 68.8021 176.6541 20 I 3.9606 7.8038 120.9855 63.6384 37.0457 178.8232 21 R 3.9547 8.0921 119.8257 59.0789 29.7141 178.5400 22 E 3.9425 7.8666 116.9210 59.8596 29.6594 178.3233 23 H 4.2534 8.2730 118.0593 59.9246 29.9282 176.5271 24 C 4.3758 8.2499 117.8468 59.7811 39.8727 175.7012 25 E 4.0266 8.1525 119.0680 58.4188 29.0121 177.1975 26 Q 4.5751 7.4383 116.1317 56.4397 29.4691 175.8818 27 T 4.6169 7.3982 114.1705 61.6603 71.9110 174.2067 28 E 3.7854 8.6143 125.1503 59.8121 29.9694 179.6440 29 K 3.9509 8.0237 117.5610 59.6561 32.1524 179.0498 30 C 4.2491 8.0160 116.2956 62.8590 28.1471 175.8379 31 V 3.8025 8.2292 120.1147 66.3111 30.9565 178.0384 32 K 3.8892 8.3005 117.7844 59.5128 31.9033 179.1993 33 A 4.0680 8.0450 120.4683 55.1003 18.5143 179.4707 34 R 3.3601 8.9567 118.4670 59.4273 29.9807 178.2097 35 E 3.8037 8.4737 119.2848 59.4875 29.7727 178.9595 36 R 3.9499 7.7662 118.1244 59.0368 30.0571 179.0329 37 L 3.8439 7.7030 120.1129 58.1804 42.1781 178.5202 38 E 3.8887 7.9432 118.5336 59.4768 29.3164 179.4146 39 L 3.9057 7.7680 118.5926 57.9896 41.6649 178.4662 40 C 4.1115 8.0095 118.1310 59.8560 41.9528 174.7014 41 D 4.2816 8.5970 119.3653 57.5636 40.7026 178.0911 42 A 3.9817 8.4963 121.3303 55.5112 18.2046 179.7379 43 R 4.0377 8.0828 112.1495 58.4373 29.7957 178.3286 44 V 3.8439 7.6876 118.7773 65.4104 31.7447 177.5876 45 S 4.3364 8.3434 114.7477 60.6092 62.8761 175.8167 46 S 4.4221 7.7554 114.6779 58.5859 63.4102 173.9075 47 R 4.6018 7.4569 120.8490 55.0430 32.2836 175.6292 48 S 4.7537 8.3252 110.5781 58.6073 64.4237 175.0006 49 H 4.8162 8.0445 118.0129 56.4674 30.2173 172.6527 50 T 4.4476 7.7942 111.4878 60.1896 68.4875 174.4314 51 E 4.1001 8.6024 126.7353 58.5011 30.0850 176.9990 52 E 3.9787 7.9641 118.0834 56.7310 30.1361 175.6725 53 Q 4.6071 8.1132 120.3048 54.2113 33.1034 175.7034 54 C 5.3679 8.2672 116.1805 56.6628 38.1718 176.5307 55 T 3.3970 7.8462 118.0548 66.5119 67.8837 175.3021 56 E 3.7833 7.8226 120.2704 59.7227 29.7985 179.1732 57 E 3.9747 8.0555 117.7595 59.2515 29.5236 178.8342 58 L 4.0925 7.9338 120.4282 58.3329 42.0357 178.9707 59 F 4.5840 8.7569 118.0120 60.8858 38.9161 177.1342 60 D 4.4139 8.6298 118.5819 57.9146 40.6175 179.2590 61 F 4.2964 8.4452 120.7993 61.2836 39.4770 177.0546 62 L 3.5962 8.4707 118.7586 58.0887 41.4900 179.2754 63 H 3.9764 9.0057 118.1668 59.1945 29.5743 177.2915 64 A 3.9747 7.7270 122.2231 54.9698 18.1473 179.5654 65 R 3.6693 8.2016 117.5063 59.6717 30.1439 178.3963 66 D 4.2510 8.1611 119.0005 57.6006 40.2836 178.1618 67 H 3.9138 8.0874 118.6421 59.4283 29.5146 176.3254 68 C 4.1973 7.6007 118.6081 59.6530 42.0641 175.1058 69 V 3.7011 7.8130 119.6936 66.1641 31.1821 177.3484 70 A 4.0212 8.0023 120.2281 56.0130 17.9278 179.0717 71 H 4.0102 7.4741 111.8108 58.6174 29.0808 176.7950 72 K 4.4523 7.5077 117.4053 57.4806 33.6793 178.1313 73 L 3.9386 8.6250 121.6427 58.5415 41.5679 179.1348 74 F 4.3011 8.5093 115.9409 59.6357 38.6243 177.1044 75 N 4.4664 8.5763 116.7482 55.7485 38.4606 175.9361 76 K 4.2866 7.7078 116.9975 56.6255 32.7951 176.6464 77 L 4.4695 7.0243 118.2614 53.0762 43.2120 176.5539 78 K 4.0793 8.2932 120.7720 56.6991 32.1542 176.4988 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 12 E 8.44 4.35 0.00 1.94 1.97 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 2.19 2.34 0.00 13 L 8.11 4.57 0.00 1.69 1.48 0.91 0.47 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 14 V 8.38 4.25 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.93 0.00 0.00 15 D 8.60 4.55 0.00 2.75 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 P 0.00 4.26 0.00 2.30 2.33 0.00 3.74 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.04 0.00 17 L 8.53 3.96 0.00 1.85 1.73 0.95 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 18 T 7.94 3.89 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 1.23 0.00 0.00 19 T 7.79 4.03 4.41 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 0.00 0.00 0.00 1.22 0.00 0.00 20 I 7.80 3.96 1.91 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.21 0.96 0.00 0.00 21 R 8.09 3.95 0.00 2.05 2.00 0.00 3.32 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.85 0.00 22 E 7.87 3.94 0.00 2.17 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.72 0.00 23 H 8.27 4.25 0.00 3.27 3.50 0.00 5.78 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 C 8.25 4.38 0.00 3.23 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 25 E 8.15 4.03 0.00 2.20 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 2.66 2.66 0.00 26 Q 7.44 4.58 0.00 2.07 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.63 0.00 0.00 0.00 0.00 0.00 2.59 2.48 0.00 27 T 7.40 4.62 4.37 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 1.19 0.00 0.00 28 E 8.61 3.79 0.00 2.03 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 2.39 2.46 0.00 29 K 8.02 3.95 0.00 1.83 1.85 0.00 1.70 0.00 0.00 1.78 0.00 0.00 3.01 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.53 1.52 7.81 30 C 8.02 4.25 0.00 3.20 3.21 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.23 3.80 2.25 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 1.13 0.00 0.00 1.05 0.00 0.00 32 K 8.30 3.89 0.00 2.01 1.88 0.00 1.72 0.00 0.00 1.66 0.00 0.00 2.98 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.48 1.75 7.81 33 A 8.05 4.07 1.57 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 0.00 0.00 0.00 0.00 0.00 0.00 34 R 8.96 3.36 0.00 1.40 2.18 0.00 2.92 0.00 0.00 2.63 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.55 0.00 35 E 8.47 3.80 0.00 2.16 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.33 0.00 36 R 7.77 3.95 0.00 1.98 1.98 0.00 3.18 0.00 0.00 3.11 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.90 0.00 37 L 7.70 3.84 0.00 1.79 1.74 0.91 0.75 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 38 E 7.94 3.89 0.00 2.14 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 2.24 2.54 0.00 39 L 7.77 3.91 0.00 1.83 1.70 0.91 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 40 C 8.01 4.11 0.00 3.06 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 41 D 8.60 4.28 0.00 2.84 2.78 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 42 A 8.50 3.98 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 43 R 8.08 4.04 0.00 1.95 2.06 0.00 3.05 0.00 0.00 3.14 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.61 0.00 44 V 7.69 3.84 2.16 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 0.84 0.00 0.00 0.93 0.00 0.00 45 S 8.34 4.34 0.00 3.84 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 46 S 7.76 4.42 0.00 4.00 4.14 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.46 4.60 0.00 1.80 1.90 0.00 3.14 0.00 0.00 3.22 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.81 0.00 48 S 8.33 4.75 0.00 3.80 3.81 0.00 0.00 0.00 0.00 0.00 0.00 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 H 8.04 4.82 0.00 3.00 3.21 0.00 5.91 0.00 0.00 0.00 0.00 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 T 7.79 4.45 4.23 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 0.00 0.00 1.19 0.00 0.00 51 E 8.60 4.10 0.00 1.97 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 2.24 2.19 0.00 52 E 7.96 3.98 0.00 1.89 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.35 0.00 53 Q 8.11 4.61 0.00 1.95 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 7.27 0.00 0.00 0.00 0.00 0.00 2.22 2.41 0.00 54 C 8.27 5.37 0.00 2.89 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 55 T 7.85 3.40 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 0.17 0.00 0.00 56 E 7.82 3.78 0.00 1.98 1.92 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 2.40 2.47 0.00 57 E 8.06 3.97 0.00 2.20 1.98 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 2.38 2.42 0.00 58 L 7.93 4.09 0.00 1.76 1.83 1.11 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 59 F 8.76 4.58 0.00 3.21 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 60 D 8.63 4.41 0.00 2.91 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 F 8.45 4.30 0.00 3.16 3.36 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 62 L 8.47 3.60 0.00 1.90 1.69 1.13 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 63 H 9.01 3.98 0.00 3.19 3.44 0.00 5.59 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 A 7.73 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 65 R 8.20 3.67 0.00 1.06 1.41 0.00 3.06 0.00 0.00 2.97 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.52 0.00 66 D 8.16 4.25 0.00 2.74 2.61 0.00 0.00 0.00 0.00 0.00 0.00 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 H 8.09 3.91 0.00 3.19 3.34 0.00 5.59 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 68 C 7.60 4.20 0.00 3.04 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 69 V 7.81 3.70 2.20 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 0.98 0.00 0.00 0.95 0.00 0.00 70 A 8.00 4.02 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 71 H 7.47 4.01 0.00 3.35 3.45 0.00 5.80 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 K 7.51 4.45 0.00 1.91 1.84 0.00 1.78 0.00 0.00 1.62 0.00 0.00 3.00 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.39 1.45 7.81 73 L 8.63 3.94 0.00 1.85 1.87 0.97 0.30 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 74 F 8.51 4.30 0.00 3.00 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 75 N 8.58 4.47 0.00 2.89 2.91 0.00 0.00 6.94 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 76 K 7.71 4.29 0.00 1.70 1.84 0.00 1.70 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.43 1.41 7.81 77 L 7.02 4.47 0.00 1.37 1.33 0.62 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 78 K 8.29 4.08 0.00 1.67 1.62 0.00 1.78 0.00 0.00 1.72 0.00 0.00 3.03 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.35 1.39 7.81