NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 56 N 4.6836 8.2827 118.2185 52.4128 39.4174 172.7969 57 T 5.0872 7.4559 114.6263 60.4553 71.1124 170.1778 58 I 4.7228 8.5995 121.4266 60.1714 42.1774 174.5679 59 R 4.5240 8.4570 127.8893 55.2134 29.9327 173.4795 60 V 4.5107 8.5477 124.7868 61.3039 33.2257 174.5084 61 F 4.6280 10.5022 128.2550 57.4293 39.9531 175.8790 62 L 4.8891 10.0416 124.3256 52.5197 43.5981 174.7760 63 P 4.2949 0.0000 0.0000 64.5472 31.4971 176.9572 64 N 4.6712 8.5330 119.1495 52.5825 36.3064 174.6425 65 K 4.3595 8.0731 116.9177 57.0373 29.6178 175.9036 66 Q 4.5648 8.1517 116.7434 54.1958 31.8963 175.4324 67 R 4.6564 8.4096 122.8706 54.8671 32.3396 175.6990 68 T 4.6497 8.6340 116.3435 60.3646 71.2397 172.3974 69 V 4.9195 8.4305 126.9889 61.2480 33.8975 174.9939 70 V 4.4151 9.3887 121.2955 59.1391 34.3359 174.6154 71 N 4.5320 8.9408 125.2671 53.8777 39.4973 173.9616 72 V 4.1464 8.1082 126.7561 61.5216 32.1834 175.2993 73 R 4.6033 8.4541 133.4199 56.0970 30.0741 175.4943 74 N 5.0238 8.6180 120.1719 53.5645 42.6766 172.4570 75 G 4.2318 9.0987 108.7270 46.2335 0.0000 174.7084 76 M 4.2654 7.8894 119.4865 55.3840 32.4552 177.1728 77 S 4.9538 8.6168 118.7972 58.3853 66.1684 174.2596 78 L 4.3134 8.0681 119.1184 57.4483 41.6127 178.3826 79 H 4.1443 8.4010 118.1908 59.4546 29.5982 176.9590 80 D 4.3519 7.4953 118.9127 57.5453 40.8690 178.3912 81 C 4.3693 7.7582 112.0717 60.0285 30.0603 174.5779 82 L 4.6826 7.6374 120.2173 55.1829 43.3839 178.0806 83 M 3.7616 8.1332 118.7263 58.3674 31.5130 178.1244 84 K 3.9221 7.9076 119.3345 59.1703 32.1872 178.8382 85 K 3.9619 7.7475 117.4960 59.4000 32.4580 178.9220 86 L 4.0680 7.8978 119.0004 57.9351 41.4338 179.7723 87 K 4.0633 7.6659 116.7779 59.5284 31.9496 179.5372 88 V 3.8295 7.2531 111.2779 64.1458 31.5327 177.8983 89 R 4.1647 8.0757 116.8475 56.4961 29.4328 177.1407 90 G 4.0980 8.1867 103.0066 46.2473 0.0000 173.7671 91 L 4.6402 7.3097 117.8484 52.9872 43.6533 176.0305 92 Q 4.5033 8.2099 118.9754 53.3434 30.7069 174.6459 93 P 3.4983 0.0000 0.0000 65.4588 30.8774 176.7780 94 E 4.3640 7.8676 113.4997 56.0077 29.2272 175.7719 95 C 4.5824 8.2081 119.2084 60.0550 32.0586 172.3374 96 C 5.0765 7.8176 114.1675 58.8820 32.3046 172.8472 97 A 5.0632 9.5197 122.4030 50.1266 22.2808 175.6236 98 V 4.0547 7.5079 118.6821 59.4162 34.7429 174.4947 99 F 5.2567 7.6007 117.0270 55.2418 41.8396 173.5510 100 R 4.6916 9.9075 121.1152 55.6401 31.3742 175.3589 101 L 4.7501 8.5974 125.0788 53.5741 43.0124 176.2126 102 L 4.5065 9.1407 124.3670 52.6888 44.6844 177.1523 103 H 5.1297 8.1937 124.5946 56.2643 29.6127 176.3268 104 E 4.5910 9.2173 116.3405 53.8769 28.8096 175.4055 105 H 4.5390 9.1928 122.4572 54.9862 28.6552 174.5422 106 K 3.6439 8.0271 121.0244 56.0959 27.9577 175.6078 107 G 3.7532 8.3811 111.2602 46.2340 0.0000 170.8296 108 K 4.5932 8.3851 119.8750 54.1053 35.5670 174.7977 109 K 4.9227 8.5226 125.6743 54.8569 33.3917 175.7410 110 A 4.4127 9.3572 129.0066 50.5452 19.6698 176.4147 111 R 4.0585 8.6079 123.0189 57.0364 31.0065 175.6085 112 L 4.7225 8.1287 125.5523 52.8301 44.1572 176.0398 113 D 4.5461 8.2989 122.6272 53.3696 42.2387 177.4888 114 W 4.3235 8.7310 124.2688 59.2712 29.2828 177.2377 115 N 4.9610 9.2667 115.0740 53.0603 38.1031 175.3757 116 T 3.9833 7.6432 116.6091 63.0705 69.0664 173.4092 117 D 4.3174 8.5710 124.0845 54.6633 42.2831 176.6276 118 A 4.1929 8.4143 125.5522 54.7682 19.6207 179.6472 119 A 3.9692 8.0090 118.6866 55.6681 18.3670 180.7207 120 S 4.3975 8.1202 104.4375 59.1770 62.4442 174.8349 121 L 4.7182 8.5410 120.9530 55.0562 43.6481 177.4976 122 I 4.3229 6.0243 118.3533 61.4445 37.7733 176.3084 123 G 4.1321 9.5276 105.0983 45.9466 0.0000 174.0498 124 E 5.0201 7.6719 121.0045 54.8845 33.7992 173.7124 125 E 4.7787 8.6450 121.4380 55.7077 32.4135 175.8347 126 L 5.3602 8.5774 125.5681 53.2545 45.8573 175.0652 127 Q 4.5250 8.5822 120.1810 54.9753 32.9059 173.3405 128 V 4.3958 8.4315 124.6673 61.1828 34.4347 174.7920 129 D 4.7184 9.2677 126.6218 53.4145 45.5492 174.3450 130 F 4.4158 8.4373 121.2715 56.9408 39.3996 175.9066 131 L 4.2985 10.0052 124.0805 56.0743 40.4059 176.7110 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 56 N 8.28 4.68 0.00 2.92 3.12 0.00 0.00 5.52 6.34 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 57 T 7.46 5.09 4.25 0.00 0.00 0.00 0.00 0.00 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 58 I 8.60 4.72 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 1.11 0.76 0.91 0.00 0.00 59 R 8.46 4.52 0.00 2.02 1.90 0.00 3.44 0.00 0.00 3.29 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.80 0.00 60 V 8.55 4.51 2.11 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 0.91 0.00 0.00 0.94 0.00 0.00 61 F 10.50 4.63 0.00 3.08 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 62 L 10.04 4.89 0.00 1.67 1.59 0.90 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 63 P 0.00 4.29 0.00 1.98 1.93 0.00 3.56 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.87 0.00 64 N 8.53 4.67 0.00 2.88 3.28 0.00 0.00 7.32 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 K 8.07 4.36 0.00 1.79 2.23 0.00 1.62 0.00 0.00 1.75 0.00 0.00 2.92 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.31 1.46 7.81 66 Q 8.15 4.56 0.00 1.92 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.33 6.89 0.00 0.00 0.00 0.00 0.00 2.30 2.33 0.00 67 R 8.41 4.66 0.00 1.51 1.51 0.00 2.91 0.00 0.00 2.60 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 1.38 0.00 68 T 8.63 4.65 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 1.27 0.00 0.00 69 V 8.43 4.92 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 0.92 0.00 0.00 0.94 0.00 0.00 70 V 9.39 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 0.75 0.00 0.00 1.00 0.00 0.00 71 N 8.94 4.53 0.00 2.74 2.74 0.00 0.00 7.09 7.71 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 72 V 8.11 4.15 2.20 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 0.81 0.00 0.00 0.98 0.00 0.00 73 R 8.45 4.60 0.00 1.84 1.74 0.00 3.21 0.00 0.00 3.23 7.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.64 0.00 74 N 8.62 5.02 0.00 2.65 2.66 0.00 0.00 7.04 7.65 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 75 G 9.10 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 0.00 0.00 0.00 0.00 76 M 7.89 4.27 0.00 2.12 2.04 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.55 0.00 77 S 8.62 4.95 0.00 4.37 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 0.00 78 L 8.07 4.31 0.00 1.79 1.82 0.78 1.04 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 79 H 8.40 4.14 0.00 3.57 3.38 0.00 5.78 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 80 D 7.50 4.35 0.00 2.56 2.74 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 81 C 7.76 4.37 0.00 3.16 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 82 L 7.64 4.68 0.00 2.22 1.89 0.98 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 83 M 8.13 3.76 0.00 1.85 1.87 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 2.26 2.38 0.00 84 K 7.91 3.92 0.00 1.82 1.76 0.00 1.76 0.00 0.00 1.80 0.00 0.00 2.92 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.48 1.50 7.81 85 K 7.75 3.96 0.00 1.97 1.84 0.00 1.81 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.44 1.48 7.81 86 L 7.90 4.07 0.00 1.61 1.61 0.98 0.47 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 87 K 7.67 4.06 0.00 1.78 1.84 0.00 1.66 0.00 0.00 1.63 0.00 0.00 2.96 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.60 1.51 7.81 88 V 7.25 3.83 2.07 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 0.72 0.00 0.00 1.00 0.00 0.00 89 R 8.08 4.16 0.00 2.15 1.93 0.00 3.30 0.00 0.00 3.36 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.61 0.00 90 G 8.19 4.10 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 L 7.31 4.64 0.00 1.72 1.54 0.73 1.03 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 92 Q 8.21 4.50 0.00 2.12 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.74 6.79 0.00 0.00 0.00 0.00 0.00 2.34 2.36 0.00 93 P 0.00 3.50 0.00 1.71 1.51 0.00 3.61 0.00 0.00 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.72 0.00 94 E 7.87 4.36 0.00 2.08 2.03 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 2.11 2.23 0.00 95 C 8.21 4.58 0.00 3.02 3.14 0.00 0.00 0.00 0.00 0.00 0.00 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 C 7.82 5.08 0.00 3.08 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 A 9.52 5.06 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.51 4.05 1.09 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 -0.95 0.00 0.00 0.47 0.00 0.00 99 F 7.60 5.26 0.00 3.06 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 0.00 100 R 9.91 4.69 0.00 1.86 1.88 0.00 3.08 0.00 0.00 3.14 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.56 0.00 101 L 8.60 4.75 0.00 1.59 1.65 1.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 102 L 9.14 4.51 0.00 1.47 1.65 0.94 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 103 H 8.19 5.13 0.00 3.13 3.32 0.00 5.66 0.00 0.00 0.00 0.00 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 E 9.22 4.59 0.00 1.90 1.85 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 2.18 2.26 0.00 105 H 9.19 4.54 0.00 3.22 3.47 0.00 5.81 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 K 8.03 3.64 0.00 1.93 1.91 0.00 1.77 0.00 0.00 1.71 0.00 0.00 3.05 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.33 1.36 7.81 107 G 8.38 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 K 8.39 4.59 0.00 1.75 1.72 0.00 1.50 0.00 0.00 1.54 0.00 0.00 2.79 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.26 1.30 7.81 109 K 8.52 4.92 0.00 1.41 1.54 0.00 1.66 0.00 0.00 1.47 0.00 0.00 2.90 0.00 0.00 2.62 0.00 0.00 0.00 0.00 1.33 1.36 7.81 110 A 9.36 4.41 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 R 8.61 4.06 0.00 1.84 1.84 0.00 3.58 0.00 0.00 3.35 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.72 0.00 112 L 8.13 4.72 0.00 1.53 1.21 0.77 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 113 D 8.30 4.55 0.00 2.63 2.51 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 0.00 114 W 8.73 4.32 0.00 3.48 3.22 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 0.00 115 N 9.27 4.96 0.00 2.72 2.87 0.00 0.00 7.00 6.26 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 0.00 116 T 7.64 3.98 4.29 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 1.18 0.00 0.00 117 D 8.57 4.32 0.00 2.63 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 A 8.41 4.19 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 A 8.01 3.97 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 S 8.12 4.40 0.00 3.98 3.98 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 0.00 121 L 8.54 4.72 0.00 1.61 1.65 0.97 0.74 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 0.00 122 I 6.02 4.32 1.97 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 1.18 0.26 0.87 0.00 0.00 123 G 9.53 4.13 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 0.00 0.00 0.00 124 E 7.67 5.02 0.00 1.84 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.18 0.00 125 E 8.65 4.78 0.00 1.98 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 2.23 2.33 0.00 126 L 8.58 5.36 0.00 1.57 1.53 0.83 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 127 Q 8.58 4.53 0.00 2.18 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.75 0.00 0.00 0.00 0.00 0.00 2.50 2.50 0.00 128 V 8.43 4.40 2.01 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 0.96 0.00 0.00 0.87 0.00 0.00 129 D 9.27 4.72 0.00 3.32 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 0.00 130 F 8.44 4.42 0.00 3.02 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 0.00 131 L 10.01 4.30 0.00 1.87 1.81 1.04 0.91 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