NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 38 I 4.0358 8.0249 121.4480 59.8878 39.2229 176.0572 39 Q 3.5981 8.2451 116.5844 56.2411 25.5218 172.3264 40 D 4.6723 8.5835 118.5830 54.3050 41.1502 177.9337 41 I 2.9910 7.3408 123.0439 64.1656 37.5147 178.7663 42 E 4.2955 7.8356 118.4650 58.0131 30.6723 178.9775 43 L 3.9131 8.0653 119.1040 57.2215 41.5444 178.2186 44 L 4.6565 7.1999 113.7533 54.8480 42.0635 178.1732 45 M 4.5047 7.6088 120.5268 58.6926 31.9922 178.7474 46 R 4.1158 7.6760 117.7240 58.9217 30.2254 178.3322 47 N 4.1412 7.4725 114.0585 57.0557 39.0822 177.0596 48 T 3.9564 7.7302 113.0644 64.3826 67.5033 176.1068 49 E 4.0655 7.5559 121.7412 59.4964 29.6039 178.8325 50 I 3.9425 8.2864 119.7498 63.6602 36.8393 178.2685 51 W 4.2630 8.0045 118.6513 59.1650 28.7945 177.7103 52 D 4.4311 8.2428 118.4810 56.9449 40.4548 177.8872 53 N 4.5154 7.7301 116.2077 56.0583 38.6744 175.7579 54 L 4.4769 7.3237 116.0575 54.8302 42.0289 176.8474 55 L 4.4691 8.0410 121.8109 53.9334 43.8165 173.0992 56 N 5.2177 8.6016 121.2313 52.8236 40.3798 174.1863 57 G 4.2582 8.2871 101.4471 44.5811 0.0000 175.3766 58 K 4.4305 7.5488 116.3172 55.3001 34.4418 174.9864 59 I 4.5992 8.7808 123.0910 62.6149 35.3427 175.4052 60 T 4.5053 7.7057 107.9535 62.5856 69.3030 176.0697 61 L 4.2560 7.8495 121.2297 56.5393 41.5043 177.7256 62 E 4.4264 7.7779 116.7948 56.7315 29.7310 176.7890 63 E 4.2425 8.4736 117.6224 57.7013 31.6810 177.6442 64 A 4.2724 7.8592 118.6957 53.4397 18.9071 179.5480 65 K 3.9523 7.9563 117.3197 59.4488 32.2946 178.8758 66 K 3.8845 7.5105 119.5966 59.6657 32.1356 178.4817 67 L 4.0046 8.2324 120.7544 58.0303 40.4351 178.7551 68 F 4.1938 8.3321 120.7023 61.2337 39.1614 176.9927 69 E 4.0061 8.5528 117.3142 58.6760 29.3691 178.6725 70 D 4.4709 7.9150 119.4861 56.9423 41.0569 178.1694 71 N 4.3245 7.6708 114.3678 55.2082 38.5935 174.9866 72 Y 3.7755 6.8933 117.4867 57.8698 39.4762 175.8659 73 K 4.4419 7.8405 118.1140 56.5387 32.5654 176.6766 74 E 4.2808 7.3148 120.2109 58.1587 30.7964 177.8842 75 Y 4.3377 7.0190 114.3044 60.7331 38.2246 177.9125 76 E 3.9913 7.7994 118.7298 60.3552 29.7103 176.2911 77 K 4.1552 7.7162 116.9328 55.0401 32.8622 174.7343 78 R 4.6974 8.3351 124.1064 54.6384 33.1450 174.2738 79 D 4.7554 8.0561 117.0682 53.4578 43.9179 174.2299 80 S 4.5855 8.2720 114.6397 56.5267 64.7964 173.7670 81 R 3.7269 8.2861 121.6147 59.8086 29.5393 176.0294 82 R 4.1767 8.8589 124.5989 56.6254 30.5990 174.5679 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 38 I 8.02 4.04 1.87 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.06 0.97 0.00 0.00 39 Q 8.25 3.60 0.00 2.25 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.63 7.72 0.00 0.00 0.00 0.00 0.00 2.15 2.39 0.00 40 D 8.58 4.67 0.00 2.74 2.67 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.34 2.99 1.68 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.80 0.50 0.00 0.00 42 E 7.84 4.30 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 2.36 2.37 0.00 43 L 8.07 3.91 0.00 1.73 1.71 0.90 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 44 L 7.20 4.66 0.00 1.87 1.72 0.95 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 45 M 7.61 4.50 0.00 2.56 2.48 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3.01 2.97 0.00 46 R 7.68 4.12 0.00 1.73 2.01 0.00 3.19 0.00 0.00 3.20 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.87 0.00 47 N 7.47 4.14 0.00 2.61 2.58 0.00 0.00 7.03 7.42 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 48 T 7.73 3.96 4.14 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 1.29 0.00 0.00 49 E 7.56 4.07 0.00 2.38 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 2.18 2.11 0.00 50 I 8.29 3.94 2.02 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 1.87 0.88 0.98 0.00 0.00 51 W 8.00 4.26 0.00 3.56 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 52 D 8.24 4.43 0.00 2.81 2.83 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 0.00 0.00 0.00 53 N 7.73 4.52 0.00 2.98 2.88 0.00 0.00 7.06 7.66 0.00 0.00 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 L 7.32 4.48 0.00 1.55 1.54 0.72 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 55 L 8.04 4.47 0.00 1.63 1.41 0.91 0.83 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 56 N 8.60 5.22 0.00 2.75 2.79 0.00 0.00 5.58 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 57 G 8.29 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 0.00 0.00 0.00 0.00 58 K 7.55 4.43 0.00 1.70 1.71 0.00 1.73 0.00 0.00 1.70 0.00 0.00 2.78 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.34 1.40 7.81 59 I 8.78 4.60 1.88 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.84 0.92 0.00 0.00 60 T 7.71 4.51 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 61 L 7.85 4.26 0.00 1.66 1.77 0.95 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 62 E 7.78 4.43 0.00 2.23 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 2.28 2.34 0.00 63 E 8.47 4.24 0.00 2.08 1.96 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 2.23 2.29 0.00 64 A 7.86 4.27 1.44 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 65 K 7.96 3.95 0.00 1.89 1.91 0.00 1.77 0.00 0.00 1.76 0.00 0.00 2.86 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.54 1.56 7.81 66 K 7.51 3.88 0.00 1.68 1.98 0.00 1.65 0.00 0.00 1.58 0.00 0.00 2.90 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.57 1.47 7.81 67 L 8.23 4.00 0.00 2.03 1.72 0.94 1.20 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 68 F 8.33 4.19 0.00 3.25 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 69 E 8.55 4.01 0.00 2.21 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 2.36 2.38 0.00 70 D 7.91 4.47 0.00 2.94 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 71 N 7.67 4.32 0.00 2.49 2.70 0.00 0.00 6.97 7.24 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 72 Y 6.89 3.78 0.00 2.79 2.80 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 73 K 7.84 4.44 0.00 1.69 1.76 0.00 1.73 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.57 1.50 7.81 74 E 7.31 4.28 0.00 1.48 1.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.23 0.00 75 Y 7.02 4.34 0.00 2.88 2.87 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 76 E 7.80 3.99 0.00 1.97 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 2.32 2.39 0.00 77 K 7.72 4.16 0.00 1.78 2.01 0.00 1.74 0.00 0.00 1.91 0.00 0.00 2.96 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.22 1.21 7.81 78 R 8.34 4.70 0.00 1.79 1.81 0.00 3.17 0.00 0.00 3.20 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.58 0.00 79 D 8.06 4.76 0.00 2.59 2.56 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 80 S 8.27 4.59 0.00 3.79 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 R 8.29 3.73 0.00 1.80 1.87 0.00 3.26 0.00 0.00 3.15 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.63 0.00 82 R 8.86 4.18 0.00 1.85 2.12 0.00 3.37 0.00 0.00 3.26 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.51 0.00