NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 A 4.3438 8.1233 123.5806 51.7191 19.9107 177.4697 5 L 3.8040 8.5765 124.0525 57.6417 41.6673 177.9592 6 L 3.8275 8.6486 119.7424 57.9145 42.0045 179.1939 7 R 3.9197 7.9149 117.5385 59.2347 30.3391 178.5684 8 Q 3.9744 8.6672 117.8043 59.5376 28.7193 179.6085 9 A 3.7182 8.8273 122.6652 54.8225 18.4556 178.6713 10 Y 3.7394 8.2043 117.5635 60.9796 38.6941 178.7346 11 S 4.0795 8.6685 112.3317 61.0091 62.5411 175.1897 12 A 4.4289 7.6725 120.9295 52.5923 19.7453 177.3212 13 L 4.6697 8.1393 116.3973 55.7872 43.6701 178.9618 14 F 4.8509 7.8748 115.2039 59.8237 38.6609 176.1757 15 R 3.5018 6.8471 121.8836 58.2025 30.3545 176.1009 16 R 3.9607 7.7074 123.0360 56.6739 30.0347 177.6553 17 T 3.8401 8.6262 121.5224 66.4323 68.1249 176.0101 18 S 4.3547 8.0049 116.2242 61.4919 63.2104 176.3820 19 T 3.7250 8.3284 113.6380 63.8301 68.6414 176.2616 20 F 4.1733 8.6940 124.6036 60.9806 39.1861 176.1850 21 A 4.0531 7.8468 119.3236 55.4942 18.0393 179.1991 22 L 3.9302 8.0343 115.4512 58.3134 41.7649 180.2587 23 T 3.8110 7.9272 115.3228 66.5528 68.2648 176.8259 24 V 3.4379 7.5267 120.0125 66.7151 31.4971 177.3701 25 V 3.7197 8.3226 118.4096 65.2259 31.0139 177.1286 26 L 3.9602 8.6330 119.8898 58.4718 42.1473 180.1741 27 G 3.5263 8.5369 105.5046 47.6967 0.0000 175.2570 28 A 4.0022 8.8367 125.4212 54.8940 18.1662 179.4271 29 V 3.7617 7.9816 116.5778 66.5123 31.4797 178.1799 30 L 4.0336 7.7628 118.1125 57.8684 41.5024 178.9995 31 F 3.9896 8.6873 120.9583 61.8095 39.0898 176.3770 32 E 3.9973 9.2563 119.4540 59.5272 29.3981 178.5380 33 R 3.8715 7.9460 117.2150 59.6333 30.3518 178.5476 34 A 3.9437 8.0299 119.7586 55.7053 18.3648 178.9534 35 F 3.8589 8.0804 118.9637 61.2379 39.3138 176.5791 36 D 4.3232 8.6054 118.3025 57.7582 40.8047 179.2281 37 Q 4.0208 8.0796 118.0171 59.1480 28.6660 179.5518 38 G 3.4693 8.0057 106.0282 47.6548 0.0000 175.1147 39 A 4.0526 8.1709 123.8320 55.0895 18.2517 179.2742 40 D 4.3365 8.4837 116.8905 57.6647 40.8666 178.7771 41 A 4.0128 8.1024 121.0515 55.3070 18.3665 179.3263 42 I 3.6070 8.7024 118.6502 64.9773 37.1002 178.0500 43 F 4.2274 8.3128 119.8113 60.8553 39.4608 176.3512 44 E 3.9189 9.1099 118.4026 59.8645 29.4732 179.1360 45 H 3.9935 8.3913 117.8611 59.3725 29.8000 176.9390 46 L 4.2640 7.5894 117.6474 56.2232 41.8874 176.8708 47 N 4.9852 8.1453 117.6895 52.2254 39.7948 174.3993 48 E 3.7636 7.9298 117.4286 57.6820 30.1085 178.3473 49 G 3.8885 8.0305 109.2608 46.0189 0.0000 174.0947 50 K 4.4368 7.8164 117.7602 56.1075 33.8878 176.4570 51 L 4.5961 7.5322 118.9330 52.9119 43.3821 177.2640 52 W 4.3898 8.6815 130.0955 59.7336 30.2993 177.9552 53 K 3.9718 7.8910 118.1223 59.3402 31.7482 177.7100 54 H 4.5568 8.0028 116.0629 58.4123 29.5195 177.2828 55 I 3.6385 7.9605 120.9721 65.1316 36.9808 179.1780 56 K 2.9326 7.6761 113.7643 56.0759 33.1422 176.9859 57 H 3.9717 7.9748 115.4900 58.6236 29.5306 177.3569 58 K 3.9166 7.7737 118.1889 58.1932 31.7623 176.8974 59 Y 4.8639 7.9990 113.2828 57.0106 41.2760 176.9881 60 E 4.5161 7.2644 115.0261 56.4220 28.9384 177.3380 61 A 4.5532 8.5306 125.4936 53.8833 20.8115 176.1430 62 S 4.2649 7.8547 112.8589 59.1237 62.4008 175.3279 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 4 A 8.12 4.34 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 5 L 8.58 3.80 0.00 1.77 1.70 0.92 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 6 L 8.65 3.83 0.00 1.67 1.72 0.93 0.99 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 7 R 7.91 3.92 0.00 2.00 1.96 0.00 3.14 0.00 0.00 3.33 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.69 0.00 8 Q 8.67 3.97 0.00 2.20 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.83 0.00 0.00 0.00 0.00 0.00 2.38 2.50 0.00 9 A 8.83 3.72 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 8.20 3.74 0.00 3.05 3.04 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 11 S 8.67 4.08 0.00 3.99 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 12 A 7.67 4.43 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.14 4.67 0.00 1.54 1.76 0.86 1.32 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 14 F 7.87 4.85 0.00 2.92 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 15 R 6.85 3.50 0.00 1.30 1.60 0.00 3.34 0.00 0.00 3.18 7.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.45 0.00 16 R 7.71 3.96 0.00 1.91 1.90 0.00 3.21 0.00 0.00 3.34 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.64 0.00 17 T 8.63 3.84 4.21 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 1.10 0.00 0.00 18 S 8.00 4.35 0.00 4.06 4.12 0.00 0.00 0.00 0.00 0.00 0.00 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 8.33 3.72 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 1.23 0.00 0.00 20 F 8.69 4.17 0.00 3.11 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 21 A 7.85 4.05 1.37 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 22 L 8.03 3.93 0.00 1.71 1.78 0.93 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 23 T 7.93 3.81 4.20 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 1.22 0.00 0.00 24 V 7.53 3.44 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 0.94 0.00 0.00 0.88 0.00 0.00 25 V 8.32 3.72 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 0.94 0.00 0.00 26 L 8.63 3.96 0.00 1.94 1.69 0.93 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 27 G 8.54 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.84 4.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.98 3.76 2.28 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 1.05 0.00 0.00 1.01 0.00 0.00 30 L 7.76 4.03 0.00 1.83 1.74 0.95 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 31 F 8.69 3.99 0.00 3.10 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 32 E 9.26 4.00 0.00 2.22 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.46 0.00 33 R 7.95 3.87 0.00 2.02 1.99 0.00 3.21 0.00 0.00 3.18 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.85 0.00 34 A 8.03 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 35 F 8.08 3.86 0.00 2.18 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 D 8.61 4.32 0.00 2.71 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 37 Q 8.08 4.02 0.00 2.22 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.81 0.00 0.00 0.00 0.00 0.00 2.37 2.58 0.00 38 G 8.01 3.47 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 0.00 0.00 0.00 0.00 39 A 8.17 4.05 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 D 8.48 4.34 0.00 2.77 2.77 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 41 A 8.10 4.01 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.70 3.61 2.01 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.83 0.93 0.00 0.00 43 F 8.31 4.23 0.00 2.93 3.24 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 44 E 9.11 3.92 0.00 2.15 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 0.00 2.41 2.67 0.00 45 H 8.39 3.99 0.00 3.16 3.46 0.00 5.60 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 L 7.59 4.26 0.00 1.72 1.68 1.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 47 N 8.15 4.99 0.00 2.30 2.51 0.00 0.00 6.92 8.51 0.00 0.00 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 7.93 3.76 0.00 1.83 1.71 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 2.30 2.19 0.00 49 G 8.03 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 K 7.82 4.44 0.00 1.67 1.85 0.00 1.66 0.00 0.00 1.65 0.00 0.00 2.91 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.38 1.52 7.81 51 L 7.53 4.60 0.00 1.42 1.55 0.82 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 52 W 8.68 4.39 0.00 3.40 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 53 K 7.89 3.97 0.00 1.77 1.63 0.00 1.83 0.00 0.00 1.88 0.00 0.00 3.04 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.40 1.52 7.81 54 H 8.00 4.56 0.00 3.14 3.24 0.00 5.73 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 I 7.96 3.64 1.64 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 1.51 1.12 0.97 0.00 0.00 56 K 7.68 2.93 0.00 1.59 1.29 0.00 1.60 0.00 0.00 1.63 0.00 0.00 3.27 0.00 0.00 3.22 0.00 0.00 0.00 0.00 1.26 1.32 7.81 57 H 7.97 3.97 0.00 3.33 3.51 0.00 5.71 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 K 7.77 3.92 0.00 1.24 1.05 0.00 1.61 0.00 0.00 1.54 0.00 0.00 3.03 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.38 1.28 7.81 59 Y 8.00 4.86 0.00 2.93 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 60 E 7.26 4.52 0.00 2.09 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.43 0.00 61 A 8.53 4.55 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 62 S 7.85 4.26 0.00 3.92 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