NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 D 4.5974 8.3644 120.3168 53.3829 40.2509 175.5966 2 V 4.1244 8.4280 117.6309 59.6640 33.4318 173.0227 3 D 4.6132 9.4080 128.1156 53.3689 42.4217 175.1227 4 N 4.4679 8.9726 124.8699 55.9276 38.8546 175.6210 5 K 4.4903 8.1518 116.7513 55.1546 33.2996 175.8154 6 F 5.0404 7.7348 116.0099 55.2459 41.4370 173.2996 7 N 4.8152 8.5139 118.1294 51.4023 40.2720 176.2950 8 K 4.1667 8.7090 123.1837 59.9457 32.1607 178.9362 9 E 4.0373 8.2326 118.3296 59.3651 29.5374 178.8094 10 Q 4.0475 8.0186 119.2948 59.2641 29.0244 178.0966 11 Q 4.0333 8.0774 120.7607 59.2874 28.7905 177.8087 12 N 4.5044 8.2546 117.6306 56.8745 38.5472 176.6572 13 A 4.0323 8.0141 121.7377 54.9498 17.9237 179.3063 14 F 3.9148 8.0517 118.8889 61.3406 39.4631 177.4072 15 W 4.2421 8.2744 117.9852 59.8766 28.6337 178.1708 16 E 4.0596 8.1227 118.4029 59.3580 28.6058 179.4204 17 I 3.4714 7.0210 118.6894 64.3165 37.1899 178.1233 18 L 4.0015 7.0765 117.5955 57.8125 41.4429 178.6682 19 H 4.4921 8.1034 117.4767 58.6386 30.4204 174.1433 20 L 3.9138 7.4282 125.1748 53.6874 41.1028 175.9357 21 P 4.3095 0.0000 0.0000 65.4415 31.8755 178.3624 22 N 4.4094 8.1820 115.4150 55.4372 38.6851 175.1075 23 L 4.6291 7.2064 115.9760 53.1452 43.1319 176.2685 24 N 4.7496 8.1948 118.8310 51.7911 38.6424 176.0447 25 E 3.9040 8.6467 117.2586 59.4189 29.8529 179.3813 26 E 3.9495 8.2917 119.2937 59.2523 30.2711 178.6569 27 Q 4.0002 7.8262 117.4932 58.9952 28.5076 178.9388 28 R 4.1492 7.8187 119.1639 59.3261 30.1135 178.4554 29 N 4.4002 8.0759 117.1442 56.6472 38.7431 176.9349 30 G 3.5614 7.8141 106.6074 47.9254 0.0000 175.5914 31 F 4.1187 7.8354 120.0342 60.3106 38.7887 177.7502 32 I 3.7943 7.7947 118.9727 64.6095 36.7436 178.2644 33 Q 4.0200 7.8239 117.6177 59.0364 28.3997 178.5245 34 S 4.2194 7.8722 114.2807 61.2118 62.3321 175.9035 35 L 4.0205 7.9137 123.1191 58.1613 41.5873 179.1239 36 K 3.9869 7.7092 117.2449 59.5557 32.0386 178.1213 37 D 4.5615 7.6742 117.6652 57.0541 41.3055 176.7687 38 D 4.8327 7.6683 118.2100 50.5273 41.7672 173.9754 39 P 4.4094 0.0000 0.0000 65.8353 31.2702 178.7466 40 S 4.2362 8.0540 112.7388 60.9573 63.1683 175.2772 41 Q 4.4571 7.9348 120.4192 55.9038 28.5088 177.6210 42 S 4.2083 8.0425 118.2471 61.4937 62.5201 176.4500 43 A 4.0035 7.9353 123.2578 55.1606 18.3781 178.7378 44 N 4.4437 8.0977 114.5070 56.5495 38.5164 177.4543 45 L 4.1908 7.9769 120.4080 57.5732 41.1733 179.1369 46 L 3.8859 7.8991 120.2578 58.2098 41.6774 179.0119 47 A 3.8379 7.7158 119.2220 55.1851 18.1113 179.4823 48 E 4.1609 8.1183 117.0895 59.3960 29.2064 179.3999 49 A 3.6581 7.4774 120.6582 54.9400 18.0927 179.7798 50 K 3.9567 7.2738 116.2775 59.3928 31.8490 179.0710 51 K 4.0710 8.0231 119.4617 59.4782 32.2971 178.3879 52 L 4.0381 7.8056 120.5586 58.1148 42.1365 178.2562 53 N 4.2877 7.8688 115.7723 56.8787 38.9226 176.1996 54 D 4.4002 7.8951 118.1680 57.3016 41.0460 178.1644 55 A 4.0623 7.6468 121.2279 55.1163 18.7038 178.3321 56 Q 3.8671 7.8399 115.0348 58.1420 29.7257 176.5199 57 A 3.7956 7.6345 117.9274 52.4383 16.2244 175.5522 58 P 4.1437 0.0000 0.0000 64.2757 32.3432 177.5387 59 K 4.1736 7.4302 121.3608 56.4609 32.0405 176.3282 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 1 D 8.36 4.60 0.00 2.78 2.38 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 2 V 8.43 4.12 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 0.73 0.00 0.00 0.92 0.00 0.00 3 D 9.41 4.61 0.00 2.68 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 4 N 8.97 4.47 0.00 2.77 2.91 0.00 0.00 7.16 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 K 8.15 4.49 0.00 1.75 1.65 0.00 1.62 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.40 1.36 7.81 6 F 7.73 5.04 0.00 3.12 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 7 N 8.51 4.82 0.00 2.86 2.78 0.00 0.00 6.36 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 K 8.71 4.17 0.00 1.87 1.86 0.00 1.77 0.00 0.00 1.86 0.00 0.00 3.00 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.60 1.67 7.81 9 E 8.23 4.04 0.00 2.10 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 2.43 2.40 0.00 10 Q 8.02 4.05 0.00 2.22 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.83 0.00 0.00 0.00 0.00 0.00 2.44 2.44 0.00 11 Q 8.08 4.03 0.00 2.23 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.07 6.62 0.00 0.00 0.00 0.00 0.00 2.70 2.38 0.00 12 N 8.25 4.50 0.00 2.85 3.02 0.00 0.00 7.14 9.28 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 13 A 8.01 4.03 1.41 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 0.00 0.00 0.00 14 F 8.05 3.91 0.00 3.02 2.99 0.00 0.00 0.00 0.00 0.00 0.00 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 W 8.27 4.24 0.00 3.64 3.27 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 16 E 8.12 4.06 0.00 2.08 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 2.35 2.62 0.00 17 I 7.02 3.47 1.59 0.00 0.00 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.54 0.80 0.00 0.00 18 L 7.08 4.00 0.00 1.87 1.73 0.51 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 19 H 8.10 4.49 0.00 3.17 3.53 0.00 5.99 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 20 L 7.43 3.91 0.00 1.68 1.63 0.79 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 21 P 0.00 4.31 0.00 2.13 2.11 0.00 3.69 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.90 0.00 22 N 8.18 4.41 0.00 2.73 2.93 0.00 0.00 7.13 7.85 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 23 L 7.21 4.63 0.00 1.69 1.72 1.02 1.15 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 24 N 8.19 4.75 0.00 2.97 2.96 0.00 0.00 6.96 7.58 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 25 E 8.65 3.90 0.00 2.01 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 2.39 2.24 0.00 26 E 8.29 3.95 0.00 1.99 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 2.36 2.32 0.00 27 Q 7.83 4.00 0.00 2.43 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.59 0.00 0.00 0.00 0.00 0.00 2.37 2.41 0.00 28 R 7.82 4.15 0.00 2.01 1.93 0.00 3.31 0.00 0.00 3.04 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.85 0.00 29 N 8.08 4.40 0.00 2.71 2.93 0.00 0.00 7.08 7.81 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 30 G 7.81 3.56 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 0.00 0.00 0.00 31 F 7.84 4.12 0.00 3.18 3.11 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 0.00 0.00 0.00 0.00 32 I 7.79 3.79 2.07 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 1.75 1.65 0.98 0.00 0.00 33 Q 7.82 4.02 0.00 2.15 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.97 0.00 0.00 0.00 0.00 0.00 2.59 2.49 0.00 34 S 7.87 4.22 0.00 3.83 4.07 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 35 L 7.91 4.02 0.00 1.90 1.90 0.98 0.79 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 36 K 7.71 3.99 0.00 1.89 1.87 0.00 1.77 0.00 0.00 1.71 0.00 0.00 3.04 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.50 1.69 7.81 37 D 7.67 4.56 0.00 2.85 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 38 D 7.67 4.83 0.00 2.87 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 39 P 0.00 4.41 0.00 2.28 2.35 0.00 3.72 0.00 0.00 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.05 0.00 40 S 8.05 4.24 0.00 4.06 4.06 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 41 Q 7.93 4.46 0.00 2.27 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.82 0.00 0.00 0.00 0.00 0.00 2.36 2.37 0.00 42 S 8.04 4.21 0.00 4.13 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 0.00 43 A 7.94 4.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 N 8.10 4.44 0.00 2.93 2.91 0.00 0.00 7.15 6.76 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 45 L 7.98 4.19 0.00 1.95 1.85 1.00 0.63 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 46 L 7.90 3.89 0.00 1.78 1.85 0.99 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 47 A 7.72 3.84 1.41 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 0.00 0.00 0.00 48 E 8.12 4.16 0.00 2.32 2.21 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 2.39 2.57 0.00 49 A 7.48 3.66 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.27 3.96 0.00 1.79 1.88 0.00 1.70 0.00 0.00 1.62 0.00 0.00 2.97 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.45 1.40 7.81 51 K 8.02 4.07 0.00 1.85 2.02 0.00 1.75 0.00 0.00 1.78 0.00 0.00 2.92 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.54 1.52 7.81 52 L 7.81 4.04 0.00 1.98 1.96 0.96 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 53 N 7.87 4.29 0.00 2.84 2.96 0.00 0.00 6.81 8.36 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 54 D 7.90 4.40 0.00 2.87 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 55 A 7.65 4.06 1.35 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 0.00 0.00 0.00 0.00 0.00 0.00 56 Q 7.84 3.87 0.00 2.13 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.41 0.00 0.00 0.00 0.00 0.00 2.59 2.36 0.00 57 A 7.63 3.80 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 58 P 0.00 4.14 0.00 2.05 2.14 0.00 3.67 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.11 0.00 59 K 7.43 4.17 0.00 1.84 1.71 0.00 1.73 0.00 0.00 1.74 0.00 0.00 3.01 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.43 1.37 7.81