NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 30 S 4.4523 8.3344 115.4141 57.9346 65.1431 174.5352 31 R 3.7662 8.0295 121.2123 59.0431 30.1147 174.9783 32 T 4.1454 10.1183 114.0810 62.8905 72.9245 172.0752 33 A 4.5342 8.4516 130.4066 50.3829 20.5297 176.3410 34 C 4.3383 8.3400 116.5104 57.3597 30.1421 173.1443 35 K 3.7875 8.1263 119.8542 59.3944 31.1632 178.4497 36 R 3.6892 8.0310 113.3510 60.3374 29.7888 178.0620 37 C 4.0384 8.0694 116.8741 62.0981 28.1528 176.2482 38 R 3.8687 8.3521 119.3733 59.4906 29.7292 178.2911 39 L 4.1805 7.8667 117.7838 57.4131 41.7819 179.1289 40 K 4.0525 8.3691 117.5194 56.5626 32.8672 176.7497 41 K 3.8791 8.1692 118.0767 56.8131 29.6358 175.1068 42 I 4.6408 7.1833 109.2372 58.5687 40.9750 175.0244 43 K 3.7613 8.6422 123.2616 57.0400 32.4704 175.5785 44 C 4.5461 8.4959 126.4933 57.4855 31.8182 173.5330 45 D 4.4285 8.8478 124.7283 53.8356 39.1827 176.7166 46 Q 3.2882 7.9121 117.3518 57.5543 26.6198 173.1427 47 E 4.7860 7.5004 117.2931 54.2930 33.5630 175.2137 48 F 4.3222 8.7036 123.7486 56.5357 40.4954 173.6939 49 P 2.9700 0.0000 0.0000 60.9929 31.2734 175.3945 50 S 4.2377 7.4983 110.6557 56.4762 66.5785 176.1314 51 C 4.0415 8.5633 121.6425 58.6111 30.7427 174.3761 52 K 3.8236 8.8576 124.3007 60.0251 31.7544 178.1110 53 R 3.8567 7.9785 118.5060 60.1715 29.9769 178.2504 54 C 4.1616 8.0792 115.3426 62.4521 28.1059 176.0309 55 A 3.8871 7.8869 122.5891 55.4999 17.8288 179.1093 56 K 3.6948 8.3802 115.1911 60.5021 32.3260 178.6304 57 L 4.0585 7.8966 120.0337 55.6083 42.3026 176.7285 58 E 3.7669 8.3329 117.1422 57.9304 27.3297 174.2271 59 V 4.3353 7.5107 118.1578 58.6984 33.1450 173.8021 60 P 4.1665 0.0000 0.0000 63.3416 31.3280 174.8581 61 C 4.6406 8.4996 120.6014 57.8258 32.9541 173.0419 62 V 4.6011 7.9638 119.0128 59.7122 36.2663 175.1402 63 S 4.7836 8.9051 118.0907 57.1976 64.9424 172.1111 64 L 4.9403 8.0307 121.8057 53.1012 44.8536 175.3358 65 D 4.5014 8.6811 126.5522 53.3184 41.0996 174.8698 66 P 4.0811 0.0000 0.0000 65.7616 31.6452 177.9826 67 A 4.0903 8.0690 120.9730 55.2180 18.5410 178.5883 68 T 3.9733 8.6995 105.2469 62.5324 69.2259 176.3181 69 G 3.9028 8.7627 109.2686 44.7658 0.0000 173.3682 70 K 4.2426 8.5004 122.1747 56.0853 33.4421 176.1221 71 D 4.7740 8.5556 124.4001 54.7392 41.9337 175.8552 72 V 4.2879 8.1867 117.2280 61.4972 35.8864 170.4433 73 P 4.6943 0.0000 0.0000 62.4003 31.9835 177.4052 74 R 3.9910 8.6724 120.4523 59.5941 30.2074 177.1673 75 S 4.4893 8.3012 110.6642 56.6047 64.4752 173.3029 76 Y 4.5155 8.9900 129.0543 61.9279 38.4429 178.3414 77 V 3.5122 7.8995 112.0571 64.4776 31.7909 178.3285 78 F 3.9100 8.2200 120.3443 61.0595 39.0869 176.7835 79 F 4.3917 9.0642 120.6310 60.5495 39.1773 177.4687 80 L 3.5378 7.6299 118.4393 57.7249 41.3490 178.6560 81 E 3.7279 8.2067 118.8153 59.7277 29.0019 179.3547 82 D 4.0643 7.3209 117.6921 56.9743 41.1974 177.9956 83 R 3.6251 7.6535 119.5316 59.4981 30.0317 178.2775 84 L 3.7945 7.8301 118.2975 57.7421 41.5976 179.4412 85 A 3.8675 7.3995 120.2038 55.2772 18.3099 179.6944 86 V 3.5002 7.3465 115.9886 66.3568 31.5275 177.9093 87 M 3.9311 8.1266 118.5009 58.7673 31.8575 178.5960 88 M 3.9663 8.2931 118.6522 58.6208 32.2432 178.8726 89 R 3.9492 8.3645 118.4122 59.3999 30.0018 179.3480 90 V 3.5852 7.7219 116.8484 65.9211 31.7801 177.5543 91 L 4.0087 8.1197 119.1568 57.9588 41.2482 179.2611 92 K 3.9849 8.4888 118.3595 59.9373 31.9302 178.8398 93 E 4.1052 8.0200 117.0394 58.6089 29.6609 177.9388 94 Y 4.6536 8.7532 116.2770 57.6158 38.6565 176.1227 95 G 4.1570 9.9569 110.2840 45.2951 0.0000 175.9400 96 V 4.2299 7.3224 125.0807 61.8316 32.2076 172.9224 97 D 4.2801 7.9153 120.3003 54.4581 45.1648 177.3540 98 P 4.5831 0.0000 0.0000 60.8286 29.9296 175.9784 99 T 4.0297 7.8929 111.2779 61.7146 68.6030 175.2162 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 30 S 8.33 4.45 0.00 4.00 4.07 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 31 R 8.03 3.77 0.00 1.85 2.00 0.00 3.32 0.00 0.00 3.23 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.78 0.00 32 T 10.12 4.15 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 1.23 0.00 0.00 33 A 8.45 4.53 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 C 8.34 4.34 0.00 3.33 3.11 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.13 3.79 0.00 2.02 1.69 0.00 1.82 0.00 0.00 1.69 0.00 0.00 2.99 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.44 1.46 7.81 36 R 8.03 3.69 0.00 2.07 2.12 0.00 3.03 0.00 0.00 3.33 7.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.77 0.00 37 C 8.07 4.04 0.00 2.99 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 38 R 8.35 3.87 0.00 1.75 2.17 0.00 3.25 0.00 0.00 3.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.67 0.00 39 L 7.87 4.18 0.00 1.67 1.71 0.92 0.74 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 40 K 8.37 4.05 0.00 1.88 1.87 0.00 1.74 0.00 0.00 1.70 0.00 0.00 3.11 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.47 1.52 7.81 41 K 8.17 3.88 0.00 1.89 1.87 0.00 1.67 0.00 0.00 1.75 0.00 0.00 3.02 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.51 1.48 7.81 42 I 7.18 4.64 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 1.30 0.54 0.95 0.00 0.00 43 K 8.64 3.76 0.00 1.73 1.77 0.00 1.75 0.00 0.00 1.63 0.00 0.00 2.74 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.43 1.44 7.81 44 C 8.50 4.55 0.00 2.98 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 45 D 8.85 4.43 0.00 2.83 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 46 Q 7.91 3.29 0.00 2.22 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.64 6.68 0.00 0.00 0.00 0.00 0.00 2.34 2.39 0.00 47 E 7.50 4.79 0.00 2.11 1.80 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 2.30 2.20 0.00 48 F 8.70 4.32 0.00 3.00 3.01 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 0.00 0.00 0.00 49 P 0.00 2.97 0.00 1.48 0.64 0.00 3.46 0.00 0.00 3.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.03 0.00 50 S 7.50 4.24 0.00 3.67 3.67 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 51 C 8.56 4.04 0.00 3.48 3.09 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 0.00 0.00 0.00 0.00 52 K 8.86 3.82 0.00 1.83 1.88 0.00 1.73 0.00 0.00 1.74 0.00 0.00 2.92 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.51 1.53 7.81 53 R 7.98 3.86 0.00 1.86 1.91 0.00 3.15 0.00 0.00 3.16 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.69 0.00 54 C 8.08 4.16 0.00 2.98 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 55 A 7.89 3.89 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 56 K 8.38 3.69 0.00 2.09 1.87 0.00 1.71 0.00 0.00 1.62 0.00 0.00 2.96 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.48 1.48 7.81 57 L 7.90 4.06 0.00 1.77 1.68 0.92 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 58 E 8.33 3.77 0.00 2.11 2.04 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 2.23 2.22 0.00 59 V 7.51 4.34 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 0.72 0.00 0.00 0.93 0.00 0.00 60 P 0.00 4.17 0.00 2.20 2.13 0.00 3.72 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.98 0.00 61 C 8.50 4.64 0.00 2.91 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 V 7.96 4.60 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 0.93 0.00 0.00 63 S 8.91 4.78 0.00 3.91 3.80 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 64 L 8.03 4.94 0.00 1.60 1.46 0.95 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 65 D 8.68 4.50 0.00 2.68 2.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 P 0.00 4.08 0.00 2.20 2.16 0.00 3.79 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.95 0.00 67 A 8.07 4.09 1.30 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 0.00 0.00 68 T 8.70 3.97 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 1.23 0.00 0.00 69 G 8.76 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 0.00 0.00 0.00 70 K 8.50 4.24 0.00 1.75 1.64 0.00 1.63 0.00 0.00 1.62 0.00 0.00 2.85 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.41 1.53 7.81 71 D 8.56 4.77 0.00 2.59 2.57 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.19 4.29 2.02 0.00 0.00 0.00 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 0.82 0.00 0.00 73 P 0.00 4.69 0.00 2.46 2.20 0.00 3.49 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.71 0.00 74 R 8.67 3.99 0.00 1.99 2.33 0.00 3.45 0.00 0.00 3.14 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.63 0.00 75 S 8.30 4.49 0.00 3.99 4.03 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 76 Y 8.99 4.52 0.00 3.03 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 77 V 7.90 3.51 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 0.75 0.00 0.00 1.01 0.00 0.00 78 F 8.22 3.91 0.00 3.34 3.60 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 79 F 9.06 4.39 0.00 3.15 3.27 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 80 L 7.63 3.54 0.00 1.62 1.45 0.43 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 81 E 8.21 3.73 0.00 1.52 1.80 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 2.21 2.39 0.00 82 D 7.32 4.06 0.00 2.53 2.46 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 0.00 0.00 0.00 83 R 7.65 3.63 0.00 1.40 1.51 0.00 2.65 0.00 0.00 2.25 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 1.45 0.00 84 L 7.83 3.79 0.00 1.62 1.62 0.84 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 85 A 7.40 3.87 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 86 V 7.35 3.50 2.13 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 1.06 0.00 0.00 0.93 0.00 0.00 87 M 8.13 3.93 0.00 1.97 2.13 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.79 0.00 88 M 8.29 3.97 0.00 1.97 2.27 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.54 0.00 89 R 8.36 3.95 0.00 1.78 1.99 0.00 3.12 0.00 0.00 3.09 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.64 0.00 90 V 7.72 3.59 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 0.67 0.00 0.00 0.96 0.00 0.00 91 L 8.12 4.01 0.00 1.76 1.68 0.86 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 92 K 8.49 3.98 0.00 1.75 1.89 0.00 1.68 0.00 0.00 1.64 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.51 7.81 93 E 8.02 4.11 0.00 2.05 2.13 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 2.38 2.44 0.00 94 Y 8.75 4.65 0.00 2.82 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 95 G 9.96 4.16 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 0.00 0.00 0.00 96 V 7.32 4.23 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 0.71 0.00 0.00 0.93 0.00 0.00 97 D 7.92 4.28 0.00 2.57 2.34 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 98 P 0.00 4.58 0.00 2.08 1.97 0.00 3.98 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.93 0.00 99 T 7.89 4.03 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00