NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 7 A 4.3064 8.2644 123.5819 51.7579 20.9209 177.3425 8 I 3.9299 7.5017 114.4071 61.0124 39.9740 170.9024 9 E 5.0295 8.9003 124.2781 54.6764 31.1131 175.2116 10 V 4.6454 8.8684 119.6452 59.6802 36.4525 174.0720 11 E 5.1223 8.7016 123.0927 55.2102 31.8505 174.7477 12 G 4.1806 8.8557 111.0595 45.8185 0.0000 171.2411 13 R 5.1291 8.7737 120.5220 54.0977 32.6036 175.3225 14 V 4.0626 8.7869 127.3781 63.5766 32.0929 176.1615 15 V 3.9931 9.1152 129.2453 64.5383 32.0535 175.5528 16 E 4.9921 7.7769 115.9934 54.6371 32.3505 172.3585 17 P 4.5650 0.0000 0.0000 62.6743 32.6615 174.8247 18 L 4.8181 8.0931 120.9312 52.0135 45.9213 174.1229 19 P 4.3693 0.0000 0.0000 62.7693 31.9696 175.9384 20 N 4.3414 9.2177 112.7951 54.6189 35.7868 174.5615 21 A 3.6218 8.0205 115.6180 53.4690 16.5253 177.9165 22 M 4.8336 7.2972 117.4098 55.6333 34.9650 175.3590 23 F 5.0659 8.9553 118.3360 55.7851 43.9000 174.0436 24 R 4.7357 9.0918 124.0331 55.9425 31.3104 175.1008 25 I 5.0447 9.0608 126.9973 59.4740 41.1929 173.8497 26 E 4.9396 9.1786 127.5648 54.5278 31.4558 176.0405 27 L 4.7751 9.0377 127.7662 53.8416 42.7933 177.8098 28 E 3.9438 8.6109 118.8342 59.0499 29.3816 177.8754 29 N 4.5939 8.1444 114.4349 52.4115 37.5856 176.0338 30 G 4.0059 8.2773 108.3387 45.9172 0.0000 174.2156 31 H 4.4467 8.5039 117.5868 55.8221 29.3376 174.1351 32 K 5.1506 8.4046 121.6652 55.0908 33.9445 176.0981 33 V 4.7800 8.8538 116.5848 59.6172 36.4692 174.2339 34 L 5.3885 8.8206 122.0816 53.2690 44.1372 175.6960 35 A 5.8566 9.4095 123.7461 50.7390 23.2895 174.4912 36 H 5.7089 8.6075 114.3925 53.5040 32.1832 173.3797 37 I 4.6141 8.4478 112.8049 60.4220 38.8208 175.6545 38 S 4.3770 8.6824 118.7008 57.9245 64.1443 175.5419 39 G 3.6064 8.8128 106.9694 47.9490 0.0000 176.0066 40 K 4.1252 8.0284 120.3212 59.5983 32.2156 179.2025 41 M 4.1057 8.1388 118.9791 58.4043 31.8768 179.0059 42 R 3.9410 8.3113 118.5609 59.3135 29.9995 179.0561 43 Q 3.7834 8.1575 116.9359 57.9600 28.6284 177.2993 44 H 4.3256 6.9916 114.2539 54.3575 29.2564 173.9887 45 Y 3.7080 7.0458 116.9237 58.9397 35.7872 170.4929 46 I 3.8274 7.5749 120.2093 61.2273 37.7153 175.7752 47 R 4.4923 8.4857 125.5121 54.6818 31.1935 175.0406 48 I 4.4230 8.1840 125.9790 59.5705 38.9418 174.9358 49 L 4.9096 9.0061 124.3824 51.6922 44.8544 174.2613 50 P 4.5514 0.0000 0.0000 64.7039 31.5860 177.0309 51 E 3.9792 9.2768 120.3169 56.3809 28.3748 174.8447 52 D 4.5650 7.8413 119.5764 54.5226 42.2574 175.3965 53 R 5.1019 8.5280 120.3269 55.0033 32.5279 175.7677 54 V 5.0324 8.9725 115.6893 59.7923 36.8031 174.2585 55 V 4.8168 8.8278 122.9796 61.4459 33.5951 174.7073 56 V 4.8647 9.0434 127.4142 61.1579 34.8230 173.9148 57 E 4.7408 9.0818 127.7558 54.9110 30.6059 175.8437 58 L 4.6730 8.7087 125.6804 54.0766 43.0529 177.2814 59 S 4.3170 8.9580 116.7594 57.5091 62.9325 173.8299 60 P 4.2576 0.0000 0.0000 65.5324 31.2256 177.2466 61 Y 4.2544 7.6633 114.7920 59.8897 38.2801 175.2922 62 D 4.3455 7.8564 118.0229 53.6922 42.5818 175.4601 63 L 4.2992 8.5816 126.5497 56.0037 41.9483 177.8430 64 S 4.7090 8.6700 114.0756 58.4578 64.2461 173.8492 65 R 5.1317 8.0657 119.7733 55.3076 34.4490 175.2158 66 G 4.0372 8.2575 106.4199 46.0944 0.0000 171.1585 67 R 4.9263 8.3828 120.2998 54.2131 33.0646 175.9162 68 I 4.3767 8.8508 128.4211 61.7013 37.7493 176.8441 69 V 4.5001 8.9774 118.9680 61.2368 33.6789 175.1099 70 Y 4.8040 7.6861 120.9368 56.1242 42.3938 173.0201 71 R 4.7197 7.3819 125.3483 54.2133 32.6218 174.4403 72 Y 3.7569 8.7115 125.2953 57.5408 38.4433 176.6461 73 K 3.9915 8.6218 122.8841 56.8805 32.1489 176.7142 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 A 8.26 4.31 1.29 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 0.00 0.00 8 I 7.50 3.93 1.86 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 1.21 1.74 0.90 0.00 0.00 9 E 8.90 5.03 0.00 2.10 1.83 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 2.21 2.49 0.00 10 V 8.87 4.65 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 0.62 0.00 0.00 0.95 0.00 0.00 11 E 8.70 5.12 0.00 2.04 1.85 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 2.59 2.32 0.00 12 G 8.86 4.18 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 0.00 0.00 0.00 13 R 8.77 5.13 0.00 1.86 1.78 0.00 3.38 0.00 0.00 3.09 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.53 0.00 14 V 8.79 4.06 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 0.89 0.00 0.00 0.82 0.00 0.00 15 V 9.12 3.99 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 0.85 0.00 0.00 0.98 0.00 0.00 16 E 7.78 4.99 0.00 2.06 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 2.28 2.30 0.00 17 P 0.00 4.57 0.00 1.98 2.17 0.00 3.75 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.05 0.00 18 L 8.09 4.82 0.00 1.39 1.51 0.90 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 19 P 0.00 4.37 0.00 2.13 1.95 0.00 3.69 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.06 0.00 20 N 9.22 4.34 0.00 2.81 2.85 0.00 0.00 6.82 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 A 8.02 3.62 1.37 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 0.00 0.00 0.00 22 M 7.30 4.83 0.00 1.93 1.97 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.84 0.00 23 F 8.96 5.07 0.00 2.95 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 24 R 9.09 4.74 0.00 1.91 1.84 0.00 3.05 0.00 0.00 3.19 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.64 0.00 25 I 9.06 5.04 1.92 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.77 0.95 0.00 0.00 26 E 9.18 4.94 0.00 2.01 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.28 0.00 27 L 9.04 4.78 0.00 1.88 1.59 0.95 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 28 E 8.61 3.94 0.00 1.94 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 2.53 2.23 0.00 29 N 8.14 4.59 0.00 2.69 2.83 0.00 0.00 6.19 7.00 0.00 0.00 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 G 8.28 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 31 H 8.50 4.45 0.00 3.30 3.23 0.00 5.61 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 K 8.40 5.15 0.00 1.62 1.74 0.00 1.61 0.00 0.00 1.82 0.00 0.00 3.01 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.38 1.53 7.81 33 V 8.85 4.78 2.19 0.00 0.00 0.00 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 0.97 0.00 0.00 34 L 8.82 5.39 0.00 1.59 1.58 0.93 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 35 A 9.41 5.86 1.24 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 0.00 0.00 36 H 8.61 5.71 0.00 3.39 3.48 0.00 5.65 0.00 0.00 0.00 0.00 6.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 I 8.45 4.61 1.86 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 1.51 0.65 0.84 0.00 0.00 38 S 8.68 4.38 0.00 3.96 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 39 G 8.81 3.61 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 0.00 0.00 0.00 40 K 8.03 4.13 0.00 1.82 1.89 0.00 1.67 0.00 0.00 1.83 0.00 0.00 2.94 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.53 1.54 7.81 41 M 8.14 4.11 0.00 2.04 2.22 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.53 0.00 42 R 8.31 3.94 0.00 1.97 1.98 0.00 3.16 0.00 0.00 3.20 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.86 0.00 43 Q 8.16 3.78 0.00 2.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 7.06 0.00 0.00 0.00 0.00 0.00 2.30 2.54 0.00 44 H 6.99 4.33 0.00 3.00 3.23 0.00 6.01 0.00 0.00 0.00 0.00 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 Y 7.05 3.71 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 46 I 7.57 3.83 1.83 0.00 0.00 0.82 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 0.66 0.82 0.00 0.00 47 R 8.49 4.49 0.00 1.79 1.83 0.00 3.23 0.00 0.00 3.26 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.68 0.00 48 I 8.18 4.42 0.93 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.35 0.21 0.00 0.00 49 L 9.01 4.91 0.00 1.59 1.53 0.93 0.95 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 50 P 0.00 4.55 0.00 2.06 2.18 0.00 3.77 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.19 0.00 51 E 9.28 3.98 0.00 2.09 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 0.00 2.22 2.41 0.00 52 D 7.84 4.57 0.00 2.63 2.53 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.53 5.10 0.00 1.74 1.88 0.00 3.46 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 1.56 1.42 0.00 54 V 8.97 5.03 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 0.61 0.00 0.00 1.01 0.00 0.00 55 V 8.83 4.82 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 0.95 0.00 0.00 1.06 0.00 0.00 56 V 9.04 4.86 2.11 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 1.11 0.00 0.00 0.96 0.00 0.00 57 E 9.08 4.74 0.00 1.90 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 2.26 2.41 0.00 58 L 8.71 4.67 0.00 1.52 1.61 1.04 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 59 S 8.96 4.32 0.00 3.92 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 60 P 0.00 4.26 0.00 1.59 1.91 0.00 3.65 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 1.78 1.98 0.00 61 Y 7.66 4.25 0.00 3.04 2.96 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 62 D 7.86 4.35 0.00 2.73 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 L 8.58 4.30 0.00 1.70 1.72 0.93 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 64 S 8.67 4.71 0.00 3.91 4.10 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 0.00 0.00 0.00 0.00 65 R 8.07 5.13 0.00 1.88 1.86 0.00 3.36 0.00 0.00 3.31 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.73 0.00 66 G 8.26 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.38 4.93 0.00 1.80 1.73 0.00 3.12 0.00 0.00 3.20 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.45 0.00 68 I 8.85 4.38 1.83 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.41 0.84 0.00 0.00 69 V 8.98 4.50 2.09 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 0.65 0.00 0.00 1.03 0.00 0.00 70 Y 7.69 4.80 0.00 2.85 2.59 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.38 4.72 0.00 1.61 1.48 0.00 3.31 0.00 0.00 3.09 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.49 0.00 72 Y 8.71 3.76 0.00 2.86 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 73 K 8.62 3.99 0.00 1.71 1.72 0.00 1.75 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.36 1.34 7.81