NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.2965 8.3049 120.3488 55.0011 33.6197 175.6240 2 L 4.1311 7.7880 118.2735 52.9922 40.7534 174.2432 3 S 4.5766 8.5211 116.8244 57.3887 66.1091 176.9579 4 V 3.6449 8.1410 118.4103 64.3718 31.7590 178.8089 5 A 3.9442 8.0250 121.4277 55.0002 18.4989 178.5573 6 A 4.1359 7.9303 117.2537 54.7937 18.6419 178.5216 7 R 4.0851 7.7983 113.0290 56.1490 30.6252 176.5496 8 S 3.5032 7.4901 106.8884 58.9045 59.6331 169.9616 9 G 4.4878 7.1723 117.3861 45.1084 0.0000 169.7948 10 P 4.6726 0.0000 0.0000 61.7359 33.3910 175.6230 11 F 4.4972 8.8909 119.3819 57.5190 40.2130 175.5173 12 A 4.6197 8.0846 123.2661 49.3656 21.1901 173.2960 13 P 4.8516 0.0000 0.0000 63.6187 32.9206 176.3760 14 V 4.3356 8.6326 121.4089 61.3670 34.3905 173.9153 15 L 5.1342 8.6054 129.8136 53.7528 44.2958 175.0634 16 S 4.6038 8.2547 116.2522 56.7726 66.0712 174.2905 17 A 4.1383 8.7816 123.9529 55.1275 18.1309 178.7665 18 T 4.4600 7.8341 102.4843 61.5397 70.7948 174.3748 19 S 4.8135 7.4656 116.9470 56.1669 65.0041 174.2846 20 R 4.0657 8.3691 122.1548 56.1466 30.4704 176.7345 21 G 3.7805 8.4891 108.2220 46.3464 0.0000 173.0377 22 V 4.6343 8.5880 124.7057 60.9333 34.5640 174.1412 23 A 4.7446 8.1141 127.2820 50.9621 21.2618 175.3585 24 G 2.1465 8.1232 111.7746 44.7081 0.0000 173.7473 25 A 4.6971 6.8864 123.9352 50.9221 20.5510 176.9676 26 L 4.3353 8.4670 114.2776 54.3167 42.6088 176.4341 27 R 4.9672 7.8419 121.4187 55.2048 30.3727 172.1989 28 P 4.5128 0.0000 0.0000 62.8549 32.3528 174.6250 29 L 4.4196 7.8990 125.2388 55.9153 45.8159 176.5550 30 V 3.6418 8.1604 118.1564 65.3799 31.6252 176.1127 31 Q 4.4542 8.0666 115.2779 55.8567 28.6011 175.7023 32 A 4.5138 7.6136 121.6836 52.9735 20.6922 178.2196 33 A 4.4040 7.8388 115.7887 52.3763 19.4792 178.5377 34 V 3.8115 7.7218 115.2621 64.9927 31.9302 175.3290 35 P 4.4150 0.0000 0.0000 61.6493 29.0957 173.6322 36 A 4.1797 8.0052 122.5646 52.6474 18.1883 178.1823 37 T 4.5087 8.0683 115.6530 64.7125 74.0070 175.1572 38 S 4.3944 7.8843 117.5744 57.6480 61.4963 174.5050 39 E 3.9621 8.5491 127.6226 57.2106 29.5976 174.6856 40 S 3.5620 7.4486 117.6185 57.0076 63.3737 170.1023 41 P 4.0250 0.0000 0.0000 62.4797 31.3085 176.5470 42 V 3.8192 8.2647 121.8893 62.9725 32.0530 175.6885 43 L 4.4119 8.2769 118.4671 55.0384 41.0140 175.9935 44 D 4.4178 7.4286 122.0463 55.4193 40.4865 175.9818 45 L 3.6412 8.1709 122.8005 55.0891 38.9475 173.8669 46 K 4.6772 7.3789 118.0315 54.1462 36.2394 177.4316 47 R 4.3201 8.3196 120.3650 55.5434 30.9177 175.2001 48 S 4.6815 8.2858 111.2075 56.9032 65.6838 174.3628 49 V 3.8385 8.1063 116.7474 61.2647 32.5291 176.8135 50 L 3.5404 8.8212 119.1595 55.0176 41.4252 174.8153 51 C 3.8216 7.6200 116.9023 60.3951 31.8696 172.0331 52 R 4.3215 7.7938 119.1596 56.8465 30.1840 174.2509 53 E 4.8626 8.0399 125.7554 56.0488 30.8007 176.0363 54 S 4.7222 8.2653 108.9772 57.2234 63.5070 173.4630 55 L 4.0483 7.8963 121.2964 55.1381 41.6063 177.4262 56 R 4.1906 8.4376 122.8986 55.3410 30.9713 176.9168 57 G 3.7960 8.5009 106.9947 46.1728 0.0000 173.5747 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 M 8.30 4.30 0.00 1.99 2.12 0.00 0.00 0.00 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.57 0.00 2 L 7.79 4.13 0.00 1.74 1.64 0.92 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 3 S 8.52 4.58 0.00 3.78 3.62 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 0.00 0.00 0.00 0.00 4 V 8.14 3.64 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 0.71 0.00 0.00 0.92 0.00 0.00 5 A 8.02 3.94 1.26 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 0.00 0.00 0.00 6 A 7.93 4.14 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 7 R 7.80 4.09 0.00 1.87 2.00 0.00 3.48 0.00 0.00 3.15 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.78 0.00 8 S 7.49 3.50 0.00 3.93 3.82 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 0.00 0.00 0.00 9 G 7.17 4.49 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 0.00 0.00 0.00 10 P 0.00 4.67 0.00 2.27 2.24 0.00 3.47 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.15 0.00 11 F 8.89 4.50 0.00 2.91 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 12 A 8.08 4.62 1.14 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 0.00 0.00 13 P 0.00 4.85 0.00 2.10 2.09 0.00 3.73 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.00 0.00 14 V 8.63 4.34 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 0.91 0.00 0.00 0.89 0.00 0.00 15 L 8.61 5.13 0.00 1.66 1.52 0.92 0.92 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 16 S 8.25 4.60 0.00 3.96 3.77 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.78 4.14 1.30 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 0.00 0.00 18 T 7.83 4.46 4.24 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 1.21 0.00 0.00 19 S 7.47 4.81 0.00 3.88 3.79 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.37 4.07 0.00 1.79 1.87 0.00 3.33 0.00 0.00 3.23 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.63 0.00 21 G 8.49 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 22 V 8.59 4.63 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 0.88 0.00 0.00 0.94 0.00 0.00 23 A 8.11 4.74 1.25 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 0.00 0.00 0.00 0.00 0.00 0.00 24 G 8.12 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 0.00 0.00 0.00 0.00 0.00 0.00 25 A 6.89 4.70 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 26 L 8.47 4.34 0.00 1.71 1.62 0.92 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 27 R 7.84 4.97 0.00 2.05 2.05 0.00 3.67 0.00 0.00 3.44 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.35 0.00 28 P 0.00 4.51 0.00 2.21 2.10 0.00 3.83 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.96 0.00 29 L 7.90 4.42 0.00 1.72 1.64 0.94 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 30 V 8.16 3.64 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 0.88 0.00 0.00 0.94 0.00 0.00 31 Q 8.07 4.45 0.00 2.20 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.66 0.00 0.00 0.00 0.00 0.00 2.28 2.35 0.00 32 A 7.61 4.51 1.31 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 0.00 0.00 33 A 7.84 4.40 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 34 V 7.72 3.81 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 0.84 0.00 0.00 0.97 0.00 0.00 35 P 0.00 4.41 0.00 2.08 2.00 0.00 3.79 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 2.02 2.08 0.00 36 A 8.01 4.18 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 37 T 8.07 4.51 4.24 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 1.21 0.00 0.00 38 S 7.88 4.39 0.00 4.01 4.05 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 39 E 8.55 3.96 0.00 1.98 2.06 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 2.32 2.30 0.00 40 S 7.45 3.56 0.00 4.21 3.97 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 41 P 0.00 4.03 0.00 2.06 2.09 0.00 3.70 0.00 0.00 3.59 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 42 V 8.26 3.82 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 1.00 0.00 0.00 0.98 0.00 0.00 43 L 8.28 4.41 0.00 1.66 1.66 0.92 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 44 D 7.43 4.42 0.00 2.65 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 45 L 8.17 3.64 0.00 1.74 1.67 0.92 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 46 K 7.38 4.68 0.00 1.65 1.70 0.00 1.94 0.00 0.00 1.76 0.00 0.00 3.09 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.31 1.41 7.81 47 R 8.32 4.32 0.00 1.96 1.98 0.00 3.03 0.00 0.00 3.34 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.62 0.00 48 S 8.29 4.68 0.00 3.94 3.84 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 49 V 8.11 3.84 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 0.84 0.00 0.00 0.93 0.00 0.00 50 L 8.82 3.54 0.00 1.76 1.76 0.92 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 51 C 7.62 3.82 0.00 3.13 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 52 R 7.79 4.32 0.00 1.74 1.78 0.00 3.37 0.00 0.00 3.15 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.67 0.00 53 E 8.04 4.86 0.00 1.87 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 2.09 2.24 0.00 54 S 8.27 4.72 0.00 3.97 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 55 L 7.90 4.05 0.00 1.65 1.66 0.92 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 56 R 8.44 4.19 0.00 1.80 1.88 0.00 3.38 0.00 0.00 3.23 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.57 0.00 57 G 8.50 3.80 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 0.00 0.00 0.00 0.00 0.00 0.00