NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1E S 4.3483 8.3231 116.7952 57.7403 63.2500 170.8654 1D G 3.7758 8.1417 110.5731 43.8602 0.0000 166.3151 1C E 4.2946 8.6381 123.1046 57.3609 32.6238 176.3154 1B A 4.0158 8.4766 125.5552 52.6138 17.6390 178.0122 1A D 4.9607 7.5638 112.6454 52.3338 39.9312 175.4454 1 C 4.0694 8.1433 113.8307 60.5450 30.0796 174.9887 2 G 3.8750 8.5944 106.8391 45.9341 0.0000 173.7116 3 L 4.4558 7.3862 119.8082 52.9692 41.6467 176.5469 4 R 4.2522 9.0006 124.4939 55.1933 30.7275 176.8118 5 P 4.2456 0.0000 0.0000 65.2089 31.5622 177.1868 6 L 4.4612 7.9039 115.6800 54.1775 41.7530 176.5098 7 F 4.8415 7.5906 117.2196 57.8152 45.7271 176.0957 8 E 3.9987 9.1931 122.2334 60.1504 30.0663 180.2005 9 K 4.1864 8.2532 115.9235 58.4216 32.1590 177.8940 10 K 4.5613 7.6571 117.4928 56.3573 32.9309 175.7615 11 S 3.7771 7.5144 111.5735 59.7340 61.1081 172.2746 12 L 4.7633 8.1328 118.1159 53.0249 43.9551 176.0469 13 E 4.9165 8.8289 121.1576 53.9030 31.8284 174.1737 14 D 5.2153 8.0584 119.8449 50.6164 42.2046 176.7416 14A K 3.8770 8.7029 121.0230 59.4634 32.2818 177.0884 14B T 4.6192 8.4176 104.9005 60.4265 70.3414 175.0992 14C E 3.8317 8.1364 123.1480 60.2906 29.2994 179.3281 14D R 3.9309 7.3012 117.3400 58.7912 30.5117 178.5595 14E E 4.0179 8.0746 119.5505 59.6878 29.6484 177.9025 14F L 3.8871 7.9875 118.9385 57.8669 41.4604 179.1875 14G L 2.8855 7.4956 120.2075 56.9669 41.9059 178.3966 14H E 4.3734 7.4237 116.7241 56.7363 30.2479 177.7203 14I S 4.3542 8.4504 114.9570 60.7019 64.5586 174.9824 14J Y 4.5515 7.6821 120.6185 58.3773 35.4246 174.5653 14K I 3.5901 8.2317 128.5685 61.6358 36.3620 173.8155 14L D 4.6548 7.4635 114.9866 53.3152 43.6481 175.3917 14M G 3.7181 8.9459 113.5157 47.0637 0.0000 174.2532 15 R 4.1916 8.1281 120.3410 56.1481 29.7401 175.9505 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 1E S 8.32 4.35 0.00 3.88 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1D G 8.14 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 1C E 8.64 4.29 0.00 2.03 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 0.00 2.23 2.21 0.00 1B A 8.48 4.02 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 1A D 7.56 4.96 0.00 2.75 2.70 0.00 0.00 0.00 0.00 0.00 0.00 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 C 8.14 4.07 0.00 3.13 3.13 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 0.00 0.00 0.00 0.00 2 G 8.59 3.87 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 0.00 0.00 0.00 0.00 0.00 0.00 3 L 7.39 4.46 0.00 1.85 1.67 0.94 1.39 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 4 R 9.00 4.25 0.00 2.16 2.07 0.00 3.08 0.00 0.00 3.44 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.63 0.00 5 P 0.00 4.25 0.00 2.06 2.13 0.00 3.72 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.13 0.00 6 L 7.90 4.46 0.00 1.45 1.24 0.88 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 7 F 7.59 4.84 0.00 3.03 3.05 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 0.00 0.00 0.00 8 E 9.19 4.00 0.00 2.29 2.07 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 2.44 2.46 0.00 9 K 8.25 4.19 0.00 2.00 1.89 0.00 1.65 0.00 0.00 1.72 0.00 0.00 3.03 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.50 1.56 7.81 10 K 7.66 4.56 0.00 1.64 1.72 0.00 1.85 0.00 0.00 1.66 0.00 0.00 3.03 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.30 1.57 7.81 11 S 7.51 3.78 0.00 3.99 3.90 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 12 L 8.13 4.76 0.00 1.47 1.56 0.87 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 13 E 8.83 4.92 0.00 1.95 1.89 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 2.22 2.23 0.00 14 D 8.06 5.22 0.00 2.87 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14A K 8.70 3.88 0.00 1.76 1.94 0.00 1.74 0.00 0.00 1.77 0.00 0.00 3.00 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.44 1.48 7.81 14B T 8.42 4.62 4.21 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 1.24 0.00 0.00 14C E 8.14 3.83 0.00 1.93 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 2.27 2.51 0.00 14D R 7.30 3.93 0.00 1.86 1.97 0.00 3.14 0.00 0.00 3.25 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.82 0.00 14E E 8.07 4.02 0.00 2.01 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 0.00 2.28 2.32 0.00 14F L 7.99 3.89 0.00 1.91 1.54 0.90 0.46 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 14G L 7.50 2.89 0.00 1.42 1.53 0.84 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 14H E 7.42 4.37 0.00 2.20 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 2.23 2.40 0.00 14I S 8.45 4.35 0.00 4.08 4.03 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 0.00 0.00 0.00 14J Y 7.68 4.55 0.00 2.88 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 14K I 8.23 3.59 1.91 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 1.32 0.26 0.93 0.00 0.00 14L D 7.46 4.65 0.00 2.60 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14M G 8.95 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 0.00 0.00 0.00 15 R 8.13 4.19 0.00 1.91 1.90 0.00 3.23 0.00 0.00 3.53 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.54 0.00