NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.3159 8.2649 123.5823 51.3268 20.7810 177.3064 3 P 4.4094 0.0000 0.0000 61.7296 32.5189 175.0809 4 T 4.2240 8.9193 118.5913 63.3359 71.4696 175.8473 5 L 4.0751 8.3942 123.2835 57.9141 41.6632 179.8095 6 T 3.8972 7.9928 109.3391 64.8990 68.6122 176.1348 7 A 4.0595 7.9899 123.1542 54.8614 18.4428 179.7441 8 R 3.8584 7.8907 116.0572 59.4228 30.1222 179.2020 9 L 3.6090 7.9821 118.8653 57.6898 41.5623 178.9401 10 Y 4.0621 8.1633 119.5911 60.7722 38.6270 177.9369 11 S 3.9362 7.9734 112.8647 61.3647 62.6197 175.7512 12 L 4.2105 7.7424 120.1039 56.3348 41.6349 177.7355 13 L 4.5825 7.1126 114.8817 55.7258 44.4834 177.6925 14 F 4.9914 7.7308 115.4939 59.4129 39.5994 177.3120 15 R 3.7078 7.6266 120.0340 59.0666 30.0657 177.2139 16 R 4.2838 7.6757 117.0948 55.6795 31.6854 177.6835 17 T 3.9534 8.5435 120.3558 66.6066 68.5238 176.6848 18 S 4.1854 8.2232 117.0774 62.1665 62.9407 176.8564 19 T 3.9672 7.8973 111.6553 64.5378 68.7127 176.0180 20 F 4.3842 8.6848 123.6208 61.3289 39.4619 177.0298 21 A 3.8723 8.4629 120.4717 55.0265 18.3154 179.2520 22 L 3.9233 8.0881 118.8636 58.5406 42.1269 179.3404 23 T 3.8669 8.4249 116.2617 66.6941 68.3871 176.5971 24 I 3.6862 7.4603 114.8330 63.8282 37.4670 178.4453 25 V 3.5794 7.6301 119.3648 65.6181 31.6355 178.0034 26 V 3.8343 7.7298 117.8365 66.2149 31.2819 178.1121 27 G 3.7144 8.7173 105.4006 47.8534 0.0000 175.5186 28 A 4.1510 8.3359 123.3338 54.6091 18.3405 179.4523 29 L 3.9115 7.9653 118.6525 58.5833 42.3875 179.3808 30 F 3.9828 8.4305 117.3338 60.2445 38.7687 177.6159 31 F 4.1714 8.7062 120.6066 61.1922 39.2706 176.5989 32 E 3.9377 8.6480 119.4351 59.3856 29.3776 178.7703 33 R 3.7487 7.7029 118.2357 59.5628 30.1317 178.4311 34 A 3.9749 7.7764 120.0638 54.7952 18.2776 179.4819 35 F 3.7584 8.1345 119.5712 61.4692 39.4045 177.0693 36 D 4.1337 7.9240 118.5401 57.3821 40.4749 178.7220 37 Q 3.9651 8.0838 120.0204 59.0114 28.9785 178.6451 38 G 3.4449 7.7291 106.1065 47.8525 0.0000 175.7281 39 A 3.8275 7.7751 123.9280 54.3161 18.1804 179.5550 40 D 4.2827 8.3080 117.9086 57.6850 40.9957 178.8665 41 A 4.1837 7.7260 121.2945 54.9703 18.4107 179.8250 42 I 3.6496 8.1384 118.8786 64.8438 37.0408 177.9668 43 Y 4.1506 7.6170 118.8706 60.7205 38.6729 177.6638 44 E 4.3791 9.0567 119.8938 59.9236 29.4608 178.9077 45 H 4.3116 8.1556 116.8445 59.1531 29.9459 177.0947 46 I 3.7543 7.5826 120.8529 63.6612 37.1668 176.2003 47 N 4.4380 7.6011 115.0917 52.8699 39.8428 176.3934 48 E 2.5400 7.6409 117.4337 56.3462 28.2598 175.1001 49 G 4.2937 7.5525 106.8532 44.4771 0.0000 172.8339 50 K 4.4238 8.2305 119.8232 56.7766 32.6132 178.8820 51 L 4.8865 8.8236 124.2397 54.7846 42.3064 177.4003 52 W 4.2700 8.5167 120.2161 59.5443 29.7584 178.5799 53 K 4.1799 8.2641 117.2158 59.7152 32.3679 177.7655 54 H 4.5290 8.2907 117.8618 57.1621 29.5576 176.2776 55 I 3.7121 7.8568 113.8627 64.9394 37.0952 177.5149 56 K 3.9764 7.9747 119.3339 59.1330 31.9438 177.3659 57 H 4.7202 7.7938 113.1186 56.3135 30.9265 174.4629 58 K 4.2034 7.5441 119.3949 56.5472 32.8943 176.0045 59 Y 3.9202 8.6012 123.6121 58.3611 38.8417 169.6085 60 E 4.0031 8.4925 119.0457 59.2493 29.7583 176.2128 61 N 4.4806 8.0767 118.7235 53.5679 38.5452 174.6041 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 2 A 8.26 4.32 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 3 P 0.00 4.41 0.00 2.14 1.99 0.00 3.68 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 2.17 0.00 4 T 8.92 4.22 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 1.22 0.00 0.00 5 L 8.39 4.08 0.00 1.69 1.71 0.92 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 6 T 7.99 3.90 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 7 A 7.99 4.06 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.89 3.86 0.00 1.98 1.93 0.00 3.11 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.80 0.00 9 L 7.98 3.61 0.00 1.76 1.01 0.92 0.34 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 10 Y 8.16 4.06 0.00 3.26 3.20 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 0.00 0.00 0.00 0.00 11 S 7.97 3.94 0.00 4.05 3.86 0.00 0.00 0.00 0.00 0.00 0.00 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 7.74 4.21 0.00 1.68 1.60 0.93 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 13 L 7.11 4.58 0.00 1.51 1.58 0.76 0.77 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 14 F 7.73 4.99 0.00 3.06 2.92 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 0.00 0.00 0.00 15 R 7.63 3.71 0.00 1.27 1.74 0.00 3.14 0.00 0.00 3.19 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.60 0.00 16 R 7.68 4.28 0.00 1.90 1.84 0.00 3.16 0.00 0.00 3.32 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.68 0.00 17 T 8.54 3.95 4.28 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 1.29 0.00 0.00 18 S 8.22 4.19 0.00 3.89 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 0.00 19 T 7.90 3.97 4.27 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 1.22 0.00 0.00 20 F 8.68 4.38 0.00 3.20 3.32 0.00 0.00 0.00 0.00 0.00 0.00 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 8.46 3.87 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.09 3.92 0.00 1.91 1.88 0.94 0.70 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 23 T 8.42 3.87 4.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 24 I 7.46 3.69 1.66 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 1.16 0.74 0.39 0.00 0.00 25 V 7.63 3.58 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 1.00 0.00 0.00 0.98 0.00 0.00 26 V 7.73 3.83 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 0.91 0.00 0.00 1.01 0.00 0.00 27 G 8.72 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 A 8.34 4.15 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 29 L 7.97 3.91 0.00 1.87 1.97 0.89 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 30 F 8.43 3.98 0.00 3.42 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 F 8.71 4.17 0.00 3.39 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 32 E 8.65 3.94 0.00 2.29 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 0.00 2.48 2.39 0.00 33 R 7.70 3.75 0.00 1.77 1.96 0.00 3.11 0.00 0.00 3.06 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.62 0.00 34 A 7.78 3.97 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 35 F 8.13 3.76 0.00 1.93 2.64 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 36 D 7.92 4.13 0.00 2.83 2.63 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.08 3.97 0.00 2.30 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.82 0.00 0.00 0.00 0.00 0.00 2.30 2.32 0.00 38 G 7.73 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.78 3.83 0.69 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 0.00 0.00 40 D 8.31 4.28 0.00 2.63 2.73 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.73 4.18 1.36 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 0.00 0.00 42 I 8.14 3.65 1.88 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 1.61 1.39 0.96 0.00 0.00 43 Y 7.62 4.15 0.00 2.97 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 44 E 9.06 4.38 0.00 2.37 2.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.62 0.00 45 H 8.16 4.31 0.00 3.32 3.36 0.00 5.95 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 I 7.58 3.75 1.74 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 1.48 0.62 0.80 0.00 0.00 47 N 7.60 4.44 0.00 2.43 2.53 0.00 0.00 6.94 7.48 0.00 0.00 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 7.64 2.54 0.00 1.51 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.47 0.00 49 G 7.55 4.29 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 0.00 50 K 8.23 4.42 0.00 2.12 1.29 0.00 1.89 0.00 0.00 1.88 0.00 0.00 2.99 0.00 0.00 3.28 0.00 0.00 0.00 0.00 1.44 1.52 7.81 51 L 8.82 4.89 0.00 1.55 1.58 0.72 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 52 W 8.52 4.27 0.00 3.20 3.30 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 53 K 8.26 4.18 0.00 2.02 2.16 0.00 1.59 0.00 0.00 1.82 0.00 0.00 3.02 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.61 1.59 7.81 54 H 8.29 4.53 0.00 3.28 3.37 0.00 5.88 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 I 7.86 3.71 1.85 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.79 0.88 0.00 0.00 56 K 7.97 3.98 0.00 1.48 1.51 0.00 1.74 0.00 0.00 1.66 0.00 0.00 3.06 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.42 1.50 7.81 57 H 7.79 4.72 0.00 2.94 3.26 0.00 5.89 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 K 7.54 4.20 0.00 1.87 1.79 0.00 1.95 0.00 0.00 1.68 0.00 0.00 3.00 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.51 1.40 7.81 59 Y 8.60 3.92 0.00 3.11 3.10 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 60 E 8.49 4.00 0.00 1.97 1.99 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 2.31 2.42 0.00 61 N 8.08 4.48 0.00 2.73 2.70 0.00 0.00 6.73 7.56 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