NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 P 4.2318 0.0000 0.0000 63.3584 32.2829 173.6011 17 S 3.8195 8.8533 116.0732 57.3129 63.4842 170.2367 18 R 4.4340 8.2483 125.3650 55.3915 32.8932 171.6565 19 K 4.7333 8.3037 117.7817 55.3257 33.9807 176.2192 20 A 4.0903 8.3994 120.2073 51.6857 18.9626 177.3923 21 K 4.0739 8.4508 120.8997 56.4999 31.9681 176.5416 22 V 4.7104 7.8384 125.6953 61.0487 35.9689 171.2078 23 K 4.7159 9.3753 132.0502 57.3963 38.4918 177.3671 24 A 4.5868 8.9341 113.6593 51.1248 19.5447 176.7110 25 T 3.8337 7.2293 118.3507 65.6818 69.5300 178.1996 26 L 4.2962 7.8171 126.1999 55.6564 42.9582 177.6890 27 G 3.2373 7.6386 102.7251 46.3896 0.0000 175.1564 28 E 3.5490 7.6380 120.0821 58.5552 29.9094 177.5343 29 F 4.6171 5.9324 113.3192 57.8066 39.8673 173.6638 30 D 4.5802 8.3397 114.9083 54.3546 43.5844 177.5518 31 L 4.4136 8.6876 127.2362 54.3757 41.3762 177.0462 32 R 4.8047 7.8500 118.2297 57.5362 37.0253 174.7607 33 D 4.5767 8.5238 117.9904 54.6333 41.5718 175.1408 34 Y 4.2657 8.7098 123.5712 59.4202 39.1899 176.7590 35 R 4.0892 8.3182 119.0251 58.9197 30.4785 175.9484 36 N 5.1242 7.5567 113.2465 51.9577 39.2533 174.9849 37 V 3.6158 7.6076 117.0133 63.4361 32.1502 173.3045 38 E 4.6543 7.8030 124.7868 55.6851 35.1990 176.8519 39 V 4.0066 7.7792 119.0585 65.2221 31.2448 178.3398 40 L 4.0769 7.8341 117.6500 56.5395 41.7730 177.4477 41 K 4.3085 8.2724 118.3982 58.5294 33.2540 177.3749 42 R 3.8027 7.9701 117.9409 59.8999 30.0784 177.1810 43 F 4.1681 8.1099 116.8168 58.6074 39.4088 175.8620 44 L 4.2824 7.2067 121.9078 53.9001 42.5970 176.4382 45 S 4.2731 8.2958 116.2570 58.6237 63.3297 174.5103 46 E 4.3592 8.5916 120.5069 57.0619 29.2054 175.8842 47 T 4.7130 7.3351 115.5530 61.8124 72.3310 173.8026 48 G 3.7108 8.7358 110.2032 46.4506 0.0000 174.4183 49 K 3.6548 7.9874 119.4190 56.5910 32.1950 176.3841 50 I 3.5799 8.3213 125.0516 61.2294 37.1542 175.7627 51 L 3.8218 8.6529 125.3262 54.8548 41.0110 175.1018 52 P 4.3794 0.0000 0.0000 63.6291 32.1296 176.1237 53 R 5.1280 7.5093 118.3016 58.4528 37.7400 176.7559 54 R 3.9129 8.0978 115.8273 58.4363 29.5412 177.8426 55 R 4.1092 8.7820 125.5748 58.9099 31.1512 178.8045 56 T 3.6982 7.5274 114.4377 64.9096 68.9057 175.0261 57 G 4.3128 8.0346 114.5046 45.8098 0.0000 175.0172 58 L 4.2676 7.1246 120.5584 53.8699 43.4329 178.4772 59 S 4.4363 8.3637 120.6997 58.6335 67.5406 177.8324 60 G 4.1519 8.4766 109.2523 46.0329 0.0000 175.6620 61 K 3.9171 7.8184 121.5081 59.4130 32.2779 177.7193 62 E 4.4093 8.0582 115.6910 56.4014 29.4846 176.6120 63 Q 4.4802 7.8621 121.3377 56.3274 31.2280 177.5440 64 R 3.8970 7.5249 115.5575 59.4030 30.3953 177.7936 65 I 4.0906 7.6006 116.8693 62.8421 38.2603 177.6725 66 L 3.8936 8.1268 121.5984 58.1959 41.5603 178.4108 67 A 3.9593 7.8884 120.4624 55.6072 18.2898 179.8284 68 K 4.0769 8.0797 116.1959 59.4321 31.9605 179.6747 69 T 3.9730 7.9290 115.1365 66.2827 68.6356 175.4682 70 I 4.2981 7.7774 120.6944 62.6475 38.0473 177.8508 71 K 3.9476 8.0640 120.5251 59.2666 31.8561 178.6989 72 R 3.9252 7.9271 118.0341 59.4081 29.7730 178.2962 73 A 4.1528 7.9529 119.1739 56.1432 18.4913 179.1245 74 R 4.7415 8.0932 117.2321 59.3783 29.8518 179.0753 75 I 3.7763 7.6493 121.4383 64.2404 37.6802 177.4985 76 L 4.4184 8.4148 118.8174 54.1534 41.4166 179.2421 77 G 4.0516 8.5872 108.3480 46.1495 0.0000 175.9759 78 L 4.0048 7.7634 120.8084 57.4960 42.5206 176.7935 79 L 4.9375 7.4297 116.9000 52.5432 47.1453 174.5559 80 P 5.0111 0.0000 0.0000 62.8128 29.9065 175.7325 81 F 4.8194 9.2237 113.7499 59.1093 41.0839 173.7828 82 T 4.6260 7.6060 111.0581 61.1179 70.8202 171.9624 83 E 4.7877 8.3973 122.8097 55.0462 31.2688 175.5576 84 K 4.7339 8.3287 118.9919 55.7990 35.7597 175.3294 85 L 4.4999 7.8786 120.6386 54.5499 44.2433 174.6599 86 V 4.3840 7.7038 115.1716 62.6443 34.4804 176.4585 87 R 3.8260 9.0610 122.1070 55.5378 27.9015 176.3696 88 K 4.1246 7.5970 123.9518 56.9356 33.7129 174.5780 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 16 P 0.00 4.23 0.00 2.19 2.11 0.00 3.85 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.96 0.00 17 S 8.85 3.82 0.00 4.10 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 18 R 8.25 4.43 0.00 1.74 1.68 0.00 3.24 0.00 0.00 3.16 7.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.60 0.00 19 K 8.30 4.73 0.00 1.71 1.61 0.00 1.82 0.00 0.00 1.70 0.00 0.00 2.79 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.29 1.38 7.81 20 A 8.40 4.09 1.24 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 0.00 0.00 21 K 8.45 4.07 0.00 1.73 1.80 0.00 1.63 0.00 0.00 1.65 0.00 0.00 3.03 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.45 1.52 7.81 22 V 7.84 4.71 2.16 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 1.15 0.00 0.00 0.99 0.00 0.00 23 K 9.38 4.72 0.00 1.72 1.29 0.00 1.66 0.00 0.00 2.38 0.00 0.00 2.89 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.25 1.32 7.81 24 A 8.93 4.59 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.23 3.83 4.39 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 1.27 0.00 0.00 26 L 7.82 4.30 0.00 1.90 1.82 1.00 0.95 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 27 G 7.64 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 0.00 0.00 0.00 28 E 7.64 3.55 0.00 1.88 1.97 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 2.27 2.26 0.00 29 F 5.93 4.62 0.00 3.05 3.15 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 0.00 0.00 0.00 0.00 30 D 8.34 4.58 0.00 2.63 2.59 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.69 4.41 0.00 1.70 1.68 1.03 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 32 R 7.85 4.80 0.00 1.76 2.18 0.00 3.35 0.00 0.00 3.20 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.75 0.00 33 D 8.52 4.58 0.00 2.86 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 34 Y 8.71 4.27 0.00 2.93 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 35 R 8.32 4.09 0.00 1.82 2.03 0.00 3.38 0.00 0.00 3.25 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.65 0.00 36 N 7.56 5.12 0.00 2.67 2.76 0.00 0.00 6.96 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 37 V 7.61 3.62 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 0.60 0.00 0.00 0.67 0.00 0.00 38 E 7.80 4.65 0.00 2.01 1.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.36 0.00 39 V 7.78 4.01 1.32 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 0.48 0.00 0.00 0.57 0.00 0.00 40 L 7.83 4.08 0.00 1.50 1.66 0.51 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 41 K 8.27 4.31 0.00 1.70 1.86 0.00 1.63 0.00 0.00 1.55 0.00 0.00 2.89 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.31 1.38 7.81 42 R 7.97 3.80 0.00 1.99 1.77 0.00 2.21 0.00 0.00 2.39 7.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.46 0.00 43 F 8.11 4.17 0.00 2.98 3.05 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 0.00 0.00 0.00 44 L 7.21 4.28 0.00 1.66 1.70 0.96 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 45 S 8.30 4.27 0.00 4.02 3.96 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 46 E 8.59 4.36 0.00 1.96 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 2.27 2.29 0.00 47 T 7.34 4.71 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 48 G 8.74 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 49 K 7.99 3.65 0.00 1.72 1.77 0.00 1.75 0.00 0.00 1.68 0.00 0.00 2.99 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.41 1.45 7.81 50 I 8.32 3.58 1.83 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.38 0.88 0.00 0.00 51 L 8.65 3.82 0.00 1.61 1.66 0.95 1.14 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 52 P 0.00 4.38 0.00 2.03 1.96 0.00 3.70 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.05 0.00 53 R 7.51 5.13 0.00 1.72 1.86 0.00 3.34 0.00 0.00 2.25 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.54 0.00 54 R 8.10 3.91 0.00 1.95 1.73 0.00 3.24 0.00 0.00 3.33 7.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.72 0.00 55 R 8.78 4.11 0.00 1.83 1.99 0.00 3.29 0.00 0.00 3.34 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.61 0.00 56 T 7.53 3.70 4.35 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 1.20 0.00 0.00 57 G 8.03 4.31 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 0.00 58 L 7.12 4.27 0.00 1.61 1.52 0.84 0.79 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 59 S 8.36 4.44 0.00 3.93 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 G 8.48 4.15 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 K 7.82 3.92 0.00 1.62 1.81 0.00 1.62 0.00 0.00 1.64 0.00 0.00 2.91 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.43 1.41 7.81 62 E 8.06 4.41 0.00 1.97 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 0.00 2.29 2.28 0.00 63 Q 7.86 4.48 0.00 2.09 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.81 6.72 0.00 0.00 0.00 0.00 0.00 2.35 2.31 0.00 64 R 7.52 3.90 0.00 1.94 2.00 0.00 3.20 0.00 0.00 3.22 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.86 0.00 65 I 7.60 4.09 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 1.30 0.89 0.92 0.00 0.00 66 L 8.13 3.89 0.00 1.91 1.76 0.89 1.30 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 67 A 7.89 3.96 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 68 K 8.08 4.08 0.00 1.86 1.88 0.00 1.69 0.00 0.00 1.65 0.00 0.00 2.98 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.48 7.81 69 T 7.93 3.97 4.38 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 1.39 0.00 0.00 70 I 7.78 4.30 1.88 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 1.37 0.90 0.90 0.00 0.00 71 K 8.06 3.95 0.00 2.07 1.84 0.00 1.66 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.47 1.51 7.81 72 R 7.93 3.93 0.00 1.95 1.94 0.00 3.13 0.00 0.00 3.08 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 2.07 0.00 73 A 7.95 4.15 1.51 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 0.00 0.00 0.00 0.00 0.00 0.00 74 R 8.09 4.74 0.00 2.17 2.01 0.00 3.20 0.00 0.00 3.44 7.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.59 0.00 75 I 7.65 3.78 1.89 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 1.67 0.50 0.92 0.00 0.00 76 L 8.41 4.42 0.00 1.70 1.66 0.82 0.80 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 77 G 8.59 4.05 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 0.00 0.00 0.00 0.00 0.00 0.00 78 L 7.76 4.00 0.00 1.71 1.92 1.20 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 79 L 7.43 4.94 0.00 1.87 1.51 0.94 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 80 P 0.00 5.01 0.00 2.26 1.26 0.00 3.74 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.99 0.00 81 F 9.22 4.82 0.00 2.86 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 82 T 7.61 4.63 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 83 E 8.40 4.79 0.00 2.08 1.87 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 2.24 2.30 0.00 84 K 8.33 4.73 0.00 1.67 1.67 0.00 1.64 0.00 0.00 1.64 0.00 0.00 3.08 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.33 1.45 7.81 85 L 7.88 4.50 0.00 1.52 1.52 0.91 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 86 V 7.70 4.38 2.08 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 0.96 0.00 0.00 0.93 0.00 0.00 87 R 9.06 3.83 0.00 2.01 2.04 0.00 3.57 0.00 0.00 3.15 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.54 0.00 88 K 7.60 4.12 0.00 1.87 1.73 0.00 1.83 0.00 0.00 1.74 0.00 0.00 2.98 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.36 1.36 7.81