NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 I 4.0274 8.0249 114.2705 60.3932 38.8039 175.2604 2 N 4.3071 8.6945 121.0906 52.4414 38.2642 169.2925 3 V 4.4213 7.8359 123.0928 60.0252 35.4965 174.9657 4 K 4.4475 8.5694 124.9559 57.2831 32.7811 175.9805 5 C 5.0010 7.8612 117.5906 54.8942 46.1101 172.4009 6 S 4.5879 8.0704 117.3557 57.4334 64.6326 175.7325 7 L 4.1980 7.9669 123.9956 54.2116 41.8186 176.8600 8 P 4.4389 0.0000 0.0000 65.0217 31.5722 177.7216 9 Q 4.0832 7.9939 116.6543 58.1685 28.8973 176.5101 10 Q 4.6518 7.7517 116.8268 55.9754 29.3575 175.0579 11 C 4.9999 8.0867 112.5214 56.8969 35.3217 175.3681 12 I 3.7709 7.7342 124.0683 64.3640 37.0272 178.3248 13 K 3.8878 8.1596 119.7478 59.1411 31.9444 177.0075 14 P 4.5061 0.0000 0.0000 64.5670 31.6841 177.0683 15 C 5.0467 7.8725 117.4081 56.7702 41.9268 176.3948 16 K 3.9893 7.9904 122.5630 59.2699 32.2445 178.5220 17 D 4.3635 8.1684 116.6146 57.3070 40.8476 177.8249 18 A 3.9796 7.9465 120.6868 53.1989 18.5885 178.1949 19 G 3.8485 8.0084 102.9761 46.5561 0.0000 173.5523 20 M 4.5060 7.3175 118.8552 54.1885 33.6709 175.4168 21 R 4.4380 8.5266 117.0566 58.4156 32.5098 175.7216 22 F 4.3975 8.5835 116.7054 57.6259 41.0939 173.8762 23 G 4.3662 8.3798 105.6318 46.9148 0.0000 173.1955 24 K 4.6979 8.7413 118.9012 55.1004 36.5783 174.8980 25 C 5.2564 8.7690 126.1011 55.6678 45.3594 172.5251 26 M 4.4857 9.5977 121.4872 55.5822 33.7096 173.7357 27 N 4.2023 9.5036 116.1163 55.0138 37.4642 173.9592 28 K 3.9469 8.4099 110.2758 56.6297 30.1631 175.1270 29 K 5.3835 8.0813 117.9567 54.2269 36.1866 173.7117 30 C 5.3198 8.8165 125.6984 55.1389 46.1780 172.9463 31 R 4.7694 9.1549 125.7548 55.1435 32.1936 174.6384 32 C 5.0858 8.6160 119.7619 56.1458 36.8330 172.7430 33 Y 4.8493 8.7810 120.8688 55.4758 41.8150 176.0870 34 S 4.3654 8.9869 116.1800 59.0162 62.8403 174.2271 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 I 8.02 4.03 1.87 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 1.41 1.12 0.91 0.00 0.00 2 N 8.69 4.31 0.00 2.80 2.85 0.00 0.00 6.70 6.80 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 3 V 7.84 4.42 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 1.02 0.00 0.00 0.98 0.00 0.00 4 K 8.57 4.45 0.00 1.90 1.85 0.00 1.57 0.00 0.00 1.63 0.00 0.00 2.86 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.42 1.45 7.81 5 C 7.86 5.00 0.00 2.84 2.96 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 0.00 0.00 0.00 6 S 8.07 4.59 0.00 3.81 3.66 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 0.00 0.00 0.00 0.00 7 L 7.97 4.20 0.00 1.74 1.58 0.91 0.91 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 8 P 0.00 4.44 0.00 2.14 2.37 0.00 3.76 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.98 0.00 9 Q 7.99 4.08 0.00 2.13 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 7.51 0.00 0.00 0.00 0.00 0.00 2.30 2.35 0.00 10 Q 7.75 4.65 0.00 1.97 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 7.29 0.00 0.00 0.00 0.00 0.00 2.26 2.27 0.00 11 C 8.09 5.00 0.00 3.04 3.07 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 12 I 7.73 3.77 1.86 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.84 0.91 0.00 0.00 13 K 8.16 3.89 0.00 1.81 1.86 0.00 1.66 0.00 0.00 1.87 0.00 0.00 2.93 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.53 1.44 7.81 14 P 0.00 4.51 0.00 2.18 2.18 0.00 3.69 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 2.11 1.99 0.00 15 C 7.87 5.05 0.00 3.10 3.08 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 0.00 0.00 0.00 0.00 16 K 7.99 3.99 0.00 1.98 1.78 0.00 1.64 0.00 0.00 1.65 0.00 0.00 2.92 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.41 1.40 7.81 17 D 8.17 4.36 0.00 2.70 2.72 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 18 A 7.95 3.98 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 19 G 8.01 3.85 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 M 7.32 4.51 0.00 2.35 2.07 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.74 0.00 21 R 8.53 4.44 0.00 1.85 1.98 0.00 3.24 0.00 0.00 3.06 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.58 0.00 22 F 8.58 4.40 0.00 3.42 3.08 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 0.00 0.00 0.00 0.00 23 G 8.38 4.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.74 4.70 0.00 1.78 1.69 0.00 1.62 0.00 0.00 1.41 0.00 0.00 2.82 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.12 1.14 7.81 25 C 8.77 5.26 0.00 3.21 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 M 9.60 4.49 0.00 2.16 2.10 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.44 0.00 27 N 9.50 4.20 0.00 2.83 2.90 0.00 0.00 7.09 6.69 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 28 K 8.41 3.95 0.00 1.94 1.87 0.00 1.78 0.00 0.00 1.64 0.00 0.00 2.98 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.35 1.35 7.81 29 K 8.08 5.38 0.00 1.78 1.72 0.00 1.77 0.00 0.00 1.68 0.00 0.00 2.86 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.35 1.23 7.81 30 C 8.82 5.32 0.00 3.03 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 31 R 9.15 4.77 0.00 1.99 1.88 0.00 3.24 0.00 0.00 3.35 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.83 0.00 32 C 8.62 5.09 0.00 2.81 3.03 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 33 Y 8.78 4.85 0.00 3.12 2.84 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 34 S 8.99 4.37 0.00 4.01 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