NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 92 E 4.2273 8.4401 118.7958 55.5476 31.2015 174.7379 93 A 3.1766 8.3955 121.1854 52.0430 17.0621 173.8367 94 E 4.7233 9.1212 113.7190 58.0634 34.2836 174.1459 95 F 3.8024 8.7905 127.7685 59.3432 39.1023 177.3483 96 V 3.4167 7.6800 118.1607 62.2744 31.7383 176.1023 97 R 4.3257 8.2024 125.6761 55.6943 29.4394 176.0920 98 I 4.5332 7.0717 116.8605 60.2252 41.5664 174.6026 99 C 4.5430 8.1546 118.0434 54.3980 38.8792 173.0344 100 S 4.2179 8.8048 115.6378 58.4940 61.9572 175.3783 101 K 4.3789 8.9589 127.5659 59.0088 33.2146 178.8063 102 S 4.1959 8.0916 114.1311 61.7368 62.5619 175.6135 103 Y 3.9349 8.3039 117.7130 61.0534 37.8270 178.5093 104 L 3.8262 7.8895 118.8495 57.6969 41.8745 177.5636 105 T 4.3475 7.4949 111.6068 60.5660 68.1919 173.6262 106 L 4.5656 8.0327 129.2930 52.9581 45.2116 174.9764 107 E 3.8389 8.7847 126.9767 57.5033 30.4114 176.1307 108 N 4.0476 8.6378 123.8267 53.6941 36.1617 173.3732 109 G 4.3635 7.1649 100.3316 45.6708 0.0000 173.8316 110 K 4.7361 8.5859 119.8669 54.2728 36.2272 175.4173 111 V 4.1705 8.2111 123.4822 61.1392 33.4971 176.4588 112 F 4.6197 8.7632 128.7379 55.6744 37.1052 175.2328 113 L 4.4246 7.7209 121.1514 56.3946 41.7049 179.0559 114 T 4.6828 7.9623 114.3264 62.3168 70.2017 172.8234 115 G 4.0915 8.3411 112.7341 45.7494 0.0000 172.2999 116 G 4.0581 9.0245 106.3242 44.4624 0.0000 174.8587 117 D 4.6993 8.2688 119.3047 51.6664 38.9191 174.6948 118 L 4.2861 7.5086 117.9527 53.5542 43.5967 175.0447 119 P 3.9277 0.0000 0.0000 63.9091 31.3758 177.2175 120 A 3.9394 8.8908 130.0500 51.1435 18.9732 177.3346 121 L 3.6090 7.9853 116.1080 56.3627 41.1830 174.3987 122 D 4.8603 7.9459 114.7111 52.1482 40.1873 174.0729 123 G 4.1601 7.7552 108.3702 46.6842 0.0000 174.3365 124 A 5.0783 7.1861 121.0189 52.0666 19.5396 177.1090 125 R 4.9479 8.5368 117.8245 54.6518 34.5703 174.4128 126 V 5.2179 8.7513 116.8079 58.8134 34.9351 174.5587 127 E 4.8062 8.7462 124.8113 54.7420 30.8431 175.4693 128 F 4.6626 9.4345 124.6857 57.6629 40.2709 175.6822 129 R 4.5533 8.3809 119.4821 55.9266 33.8327 173.2720 130 C 5.0643 8.9379 124.0101 55.8804 39.1078 173.1900 131 D 4.6026 8.4200 121.4387 53.2654 41.8535 175.7492 132 P 4.8544 0.0000 0.0000 62.0340 29.8063 175.1476 133 D 4.9490 7.9352 119.1863 55.0460 47.3800 177.2297 134 F 5.1219 8.3804 116.3500 55.8107 41.4396 175.0397 135 H 4.9460 9.0433 119.0404 53.6071 30.4979 174.0780 136 L 4.1655 8.6350 125.6084 54.6533 42.4449 177.3340 137 V 4.4952 7.3506 123.8747 59.4504 32.1832 174.3918 138 G 4.0124 6.8715 118.2582 46.2370 0.0000 175.0913 139 S 4.3872 7.9005 113.9917 57.4832 61.2654 175.2549 140 S 4.3612 7.6792 116.1669 60.9564 64.0698 175.5778 141 R 5.3280 7.8243 120.3837 55.0173 33.4253 174.3043 142 S 4.8286 9.2535 120.7244 57.0825 66.2700 172.6672 143 V 4.7227 8.6239 127.5238 60.3702 33.1334 175.9052 144 C 4.5392 9.1431 127.0968 56.5257 45.9686 172.4375 145 S 4.4669 9.0692 117.5415 58.1127 66.3892 175.2499 146 Q 3.5223 9.4870 122.4048 57.1796 26.2176 174.1770 147 G 3.8218 8.4360 102.5471 45.9791 0.0000 173.4630 148 Q 4.5712 7.6213 119.3921 53.5057 32.2804 174.2302 149 W 4.4753 8.3021 124.5703 56.5132 29.8518 176.3556 150 S 4.2877 8.8320 120.3063 61.5275 62.5350 174.4992 151 T 4.6901 7.2584 113.3453 59.0178 69.0904 172.3765 152 P 4.8115 0.0000 0.0000 61.6761 31.9870 176.0398 153 K 3.3500 8.2478 121.4312 56.3044 32.8496 175.3590 154 P 4.6691 0.0000 0.0000 62.8619 32.3990 174.3960 155 H 4.8900 8.2463 110.8645 54.9651 31.9852 173.2752 156 C 4.8385 8.6940 117.7172 55.7896 42.4250 172.6674 157 Q 4.9608 8.3357 124.8076 53.8845 31.0491 175.1020 158 V 3.1692 8.4347 126.2362 60.8674 32.3626 175.8042 159 N 4.3710 7.7297 118.6926 53.3251 36.9642 174.6428 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 92 E 8.44 4.23 0.00 2.08 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 2.16 2.25 0.00 93 A 8.40 3.18 1.28 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 0.00 0.00 0.00 0.00 0.00 0.00 94 E 9.12 4.72 0.00 1.91 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.22 0.00 95 F 8.79 3.80 0.00 3.05 2.42 0.00 0.00 0.00 0.00 0.00 0.00 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 7.68 3.42 1.82 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 0.65 0.00 0.00 -0.04 0.00 0.00 97 R 8.20 4.33 0.00 2.06 2.04 0.00 2.92 0.00 0.00 3.28 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.56 0.00 98 I 7.07 4.53 1.77 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.74 0.77 0.00 0.00 99 C 8.15 4.54 0.00 1.23 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 0.00 0.00 0.00 0.00 100 S 8.80 4.22 0.00 4.12 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 0.00 101 K 8.96 4.38 0.00 2.08 2.15 0.00 1.62 0.00 0.00 1.81 0.00 0.00 2.94 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.60 1.52 7.81 102 S 8.09 4.20 0.00 4.06 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 0.00 103 Y 8.30 3.93 0.00 2.19 2.37 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 0.00 104 L 7.89 3.83 0.00 1.81 1.75 1.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 105 T 7.49 4.35 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 1.30 0.00 0.00 106 L 8.03 4.57 0.00 1.54 1.43 0.87 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 107 E 8.78 3.84 0.00 1.88 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.24 0.00 108 N 8.64 4.05 0.00 2.49 2.40 0.00 0.00 6.45 7.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 G 7.16 4.36 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 0.00 110 K 8.59 4.74 0.00 1.62 1.43 0.00 1.58 0.00 0.00 1.45 0.00 0.00 2.84 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.26 1.31 7.81 111 V 8.21 4.17 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 0.45 0.00 0.00 0.62 0.00 0.00 112 F 8.76 4.62 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 0.00 113 L 7.72 4.42 0.00 1.75 1.74 0.89 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 114 T 7.96 4.68 4.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 115 G 8.34 4.09 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 0.00 0.00 0.00 116 G 9.02 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 D 8.27 4.70 0.00 2.65 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 L 7.51 4.29 0.00 1.58 1.59 0.97 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 119 P 0.00 3.93 0.00 2.13 2.01 0.00 3.65 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.08 0.00 120 A 8.89 3.94 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 0.00 0.00 0.00 0.00 0.00 0.00 121 L 7.99 3.61 0.00 1.82 1.49 0.84 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 122 D 7.95 4.86 0.00 2.60 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 G 7.76 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 0.00 124 A 7.19 5.08 1.21 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 0.00 0.00 125 R 8.54 4.95 0.00 1.77 1.86 0.00 3.10 0.00 0.00 3.37 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.91 0.00 126 V 8.75 5.22 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 1.05 0.00 0.00 127 E 8.75 4.81 0.00 1.79 1.75 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 2.33 2.34 0.00 128 F 9.43 4.66 0.00 2.87 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 0.00 129 R 8.38 4.55 0.00 2.07 1.99 0.00 3.12 0.00 0.00 3.20 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.73 0.00 130 C 8.94 5.06 0.00 3.17 3.06 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.42 4.60 0.00 2.72 2.67 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 0.00 132 P 0.00 4.85 0.00 2.08 2.07 0.00 3.76 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.15 0.00 133 D 7.94 4.95 0.00 2.98 2.75 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 0.00 134 F 8.38 5.12 0.00 2.76 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 0.00 135 H 9.04 4.95 0.00 3.20 3.41 0.00 5.27 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 136 L 8.63 4.17 0.00 1.71 1.63 1.04 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 137 V 7.35 4.50 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 0.81 0.00 0.00 0.84 0.00 0.00 138 G 6.87 4.01 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 0.00 0.00 0.00 139 S 7.90 4.39 0.00 3.84 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 S 7.68 4.36 0.00 3.97 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 0.00 141 R 7.82 5.33 0.00 1.89 1.84 0.00 3.29 0.00 0.00 3.21 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.68 0.00 142 S 9.25 4.83 0.00 4.10 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 0.00 143 V 8.62 4.72 2.17 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 0.83 0.00 0.00 1.06 0.00 0.00 144 C 9.14 4.54 0.00 2.36 2.81 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 0.00 0.00 0.00 145 S 9.07 4.47 0.00 3.94 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 146 Q 9.49 3.52 0.00 2.16 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.66 0.00 0.00 0.00 0.00 0.00 2.23 2.25 0.00 147 G 8.44 3.82 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 0.00 0.00 0.00 148 Q 7.62 4.57 0.00 1.99 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.90 6.99 0.00 0.00 0.00 0.00 0.00 2.28 2.36 0.00 149 W 8.30 4.48 0.00 3.16 3.10 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 0.00 150 S 8.83 4.29 0.00 3.99 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 T 7.26 4.69 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 1.30 0.00 0.00 152 P 0.00 4.81 0.00 2.21 2.11 0.00 3.48 0.00 0.00 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.94 0.00 153 K 8.25 3.35 0.00 0.79 1.19 0.00 1.21 0.00 0.00 1.43 0.00 0.00 2.90 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.12 1.13 7.81 154 P 0.00 4.67 0.00 2.04 1.85 0.00 3.27 0.00 0.00 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.32 0.00 155 H 8.25 4.89 0.00 3.15 3.30 0.00 5.44 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 156 C 8.69 4.84 0.00 2.81 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 0.00 157 Q 8.34 4.96 0.00 2.03 1.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 7.03 0.00 0.00 0.00 0.00 0.00 2.27 2.29 0.00 158 V 8.43 3.17 1.55 0.00 0.00 0.00 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 0.42 0.00 0.00 159 N 7.73 4.37 0.00 2.78 2.75 0.00 0.00 6.83 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00