NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 20 C 4.4305 8.2027 120.8332 58.9606 32.8342 175.1639 21 R 3.6588 8.2073 116.0288 57.5044 29.2534 172.1149 22 V 3.7786 7.5227 116.3417 64.5033 33.0155 176.3324 23 C 4.0868 7.8371 122.5429 59.3848 31.8882 174.4200 24 S 4.5068 8.1250 110.6287 59.0422 60.0748 169.1300 25 S 4.3013 7.4302 113.4612 57.7472 62.3392 173.9550 26 H 4.3132 8.8641 126.0194 58.8335 28.8522 177.5865 27 T 3.8796 7.5282 112.3550 64.0977 67.1102 173.6703 28 G 4.5443 6.6218 108.1375 45.2145 0.0000 171.2718 29 L 4.7446 8.0593 125.4210 52.1975 44.6046 177.3470 30 V 3.8592 7.9664 122.2078 61.1911 32.3847 177.4480 31 R 3.9037 8.5714 119.0686 59.3206 29.7386 177.8657 32 K 3.9659 8.1981 118.5545 59.4717 32.3404 177.3102 33 Y 3.8466 8.2896 114.5703 59.8164 38.0233 176.1023 34 D 4.5737 8.7398 117.6221 54.8967 40.3436 172.4187 35 L 4.9485 7.5591 115.3319 53.2266 45.6094 176.3697 36 N 4.7867 8.7063 111.3462 53.4673 37.0035 175.5686 37 I 3.8381 8.3172 119.0600 64.2015 39.3284 174.3337 38 C 4.9681 7.1909 120.4233 58.7660 33.2565 176.6006 39 R 3.9963 8.4028 124.3735 60.3317 29.5331 178.2906 40 Q 3.9689 8.0594 117.6259 59.4212 28.7877 178.6078 41 C 4.3153 8.0528 116.9968 62.4067 28.1771 175.6455 42 F 4.2686 7.9718 123.4835 60.8144 38.8897 177.2913 43 R 3.5436 8.5150 118.4553 59.0581 29.4435 178.3341 44 E 3.8689 8.4369 118.8629 59.3152 29.2980 179.2624 45 K 3.9026 8.4355 118.4550 59.3800 32.3214 178.3653 46 A 3.9505 7.4474 120.2365 54.9185 18.2398 178.7625 47 N 4.3087 8.0742 115.5492 56.5417 39.1434 174.4722 48 D 4.4737 7.5615 122.6873 53.4593 39.7933 175.8673 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 20 C 8.20 4.43 0.00 2.97 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 0.00 0.00 0.00 21 R 8.21 3.66 0.00 2.06 1.96 0.00 3.33 0.00 0.00 3.26 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.64 0.00 22 V 7.52 3.78 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 0.78 0.00 0.00 0.94 0.00 0.00 23 C 7.84 4.09 0.00 2.96 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 24 S 8.13 4.51 0.00 4.03 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 25 S 7.43 4.30 0.00 3.70 4.04 0.00 0.00 0.00 0.00 0.00 0.00 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 H 8.86 4.31 0.00 3.23 3.33 0.00 5.69 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 T 7.53 3.88 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 28 G 6.62 4.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.06 4.74 0.00 1.61 1.72 1.05 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 30 V 7.97 3.86 1.92 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 0.87 0.00 0.00 0.97 0.00 0.00 31 R 8.57 3.90 0.00 1.94 2.10 0.00 3.04 0.00 0.00 3.14 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.60 0.00 32 K 8.20 3.97 0.00 1.71 1.87 0.00 1.72 0.00 0.00 1.60 0.00 0.00 2.88 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.05 1.33 7.81 33 Y 8.29 3.85 0.00 2.93 3.16 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.74 4.57 0.00 3.05 2.68 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 0.00 0.00 0.00 35 L 7.56 4.95 0.00 1.79 1.64 1.03 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 36 N 8.71 4.79 0.00 3.12 3.14 0.00 0.00 6.47 7.32 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 37 I 8.32 3.84 1.88 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 1.42 1.35 0.95 0.00 0.00 38 C 7.19 4.97 0.00 3.04 2.65 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.40 4.00 0.00 1.88 1.95 0.00 3.25 0.00 0.00 3.37 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.80 0.00 40 Q 8.06 3.97 0.00 2.11 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.68 0.00 0.00 0.00 0.00 0.00 2.46 2.41 0.00 41 C 8.05 4.32 0.00 2.98 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 42 F 7.97 4.27 0.00 3.01 3.13 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.51 3.54 0.00 1.94 2.04 0.00 3.10 0.00 0.00 3.11 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.63 0.00 44 E 8.44 3.87 0.00 2.12 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 2.30 2.36 0.00 45 K 8.44 3.90 0.00 1.79 1.76 0.00 1.81 0.00 0.00 1.69 0.00 0.00 3.05 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.45 1.62 7.81 46 A 7.45 3.95 0.97 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 0.00 0.00 47 N 8.07 4.31 0.00 2.72 2.88 0.00 0.00 7.25 8.03 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 48 D 7.56 4.47 0.00 2.81 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