NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 82 R 4.4035 8.3545 119.0729 55.7567 31.5344 176.0827 83 K 4.5801 7.4126 119.2627 54.1527 32.7911 182.1924 84 A 4.0996 8.5662 127.1701 56.1042 19.6538 179.6650 85 Q 4.3229 8.1078 113.8968 56.2403 28.6555 180.0439 86 N 4.6359 7.7495 115.5546 54.4315 38.4500 181.2515 87 R 4.4819 7.8148 117.0057 55.0481 32.6765 178.8429 *105 E 4.3435 8.9404 120.6232 54.8436 30.8288 173.2942 106 T 4.2595 8.5444 117.0660 64.0498 68.6680 174.0488 107 Q 3.9888 7.8441 121.4187 57.2079 29.4420 177.3880 108 V 3.7546 7.6180 119.0185 66.2543 31.9142 177.6898 109 V 3.9308 7.7282 111.1367 63.3325 31.5243 177.9534 110 T 4.2204 7.4667 109.3045 63.7140 68.9411 176.5384 111 L 4.1814 7.6070 119.7602 56.3142 41.9383 178.5747 112 K 4.2882 7.8153 119.4896 58.6658 32.1360 179.0547 113 E 4.2299 7.6807 117.1400 59.9137 29.8375 183.1561 114 L 4.1818 7.6772 118.7261 58.3257 42.0360 178.3497 115 H 4.2488 7.9853 118.3509 59.2468 29.7719 177.4587 116 S 4.1619 8.2314 116.9934 60.7870 62.4555 176.1807 117 S 4.3443 7.5949 116.1697 60.3851 63.6587 176.2085 118 T 4.0899 7.9150 116.2864 64.6021 67.0896 176.0808 119 T 4.1455 7.6161 117.2472 65.3738 68.6529 176.7788 120 L 3.9581 7.1657 120.1712 58.1311 42.2346 178.7359 121 E 3.9728 7.9312 118.7239 59.3699 29.2159 178.9068 122 N 4.4156 7.8649 118.8461 57.1468 38.7758 177.5040 123 D 4.3857 7.9347 122.0564 58.3890 40.1347 180.3805 124 Q 4.4485 8.1516 119.7888 58.4527 28.9351 178.7072 125 L 4.2066 7.5356 124.2380 59.1135 41.4377 184.4674 126 R 4.3139 7.5841 118.6556 56.8382 29.1970 178.3855 *129 V 4.0505 7.9377 116.9455 62.0335 34.3854 180.3473 130 R 4.1546 8.0012 124.0664 62.7796 29.5135 183.8368 131 Q 4.5583 8.1189 121.7214 58.9257 28.0990 180.2853 132 L 4.5141 7.7320 123.8615 60.1780 41.0589 184.7216 133 E 4.3541 8.1583 120.8971 61.3373 29.5918 182.0224 134 E 4.3887 8.0014 119.3418 61.4148 29.4432 182.9034 135 E 4.4001 7.9847 119.2031 61.4026 29.7659 183.5110 136 L 4.4021 7.7839 123.6993 60.3249 40.8102 184.2002 137 R 4.3040 7.7135 122.1652 61.6308 29.4884 181.5972 138 I 4.2286 7.6308 120.4973 64.7593 35.5447 181.9584 139 L 4.6612 7.3858 121.8436 59.4408 41.6290 182.3359 140 K 4.3983 8.1812 125.1051 54.5269 31.7056 178.3395 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 82 R 8.35 4.40 0.00 1.85 1.91 0.00 3.20 0.00 0.00 3.22 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.20 0.00 83 K 7.41 4.58 0.00 1.69 1.71 0.00 1.75 0.00 0.00 1.82 0.00 0.00 2.89 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.34 1.07 7.81 84 A 8.57 4.10 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 85 Q 8.11 4.32 0.00 2.08 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.98 6.91 0.00 0.00 0.00 0.00 0.00 2.25 1.91 0.00 86 N 7.75 4.64 0.00 2.76 2.75 0.00 0.00 6.60 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 R 7.81 4.48 0.00 1.77 1.71 0.00 3.26 0.00 0.00 3.26 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.14 0.00 *105 E 8.94 4.34 0.00 2.01 1.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 1.88 0.00 106 T 8.54 4.26 4.24 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 1.21 0.00 0.00 107 Q 7.84 3.99 0.00 2.16 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.71 0.00 0.00 0.00 0.00 0.00 2.42 2.27 0.00 108 V 7.62 3.75 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 1.01 0.00 0.00 0.93 0.00 0.00 109 V 7.73 3.93 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 0.87 0.00 0.00 0.98 0.00 0.00 110 T 7.47 4.22 4.24 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 1.30 0.00 0.00 111 L 7.61 4.18 0.00 1.95 1.75 0.97 0.60 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 0.00 112 K 7.82 4.29 0.00 1.90 1.86 0.00 1.65 0.00 0.00 1.69 0.00 0.00 2.94 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.42 1.53 7.81 113 E 7.68 4.23 0.00 2.04 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 2.21 2.18 0.00 114 L 7.68 4.18 0.00 2.00 1.84 0.93 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 115 H 7.99 4.25 0.00 3.32 3.45 0.00 5.64 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 S 8.23 4.16 0.00 3.94 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 0.00 117 S 7.59 4.34 0.00 4.14 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 0.00 118 T 7.91 4.09 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 1.25 0.00 0.00 119 T 7.62 4.15 4.14 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 1.17 0.00 0.00 120 L 7.17 3.96 0.00 1.95 1.85 0.91 0.89 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 0.00 121 E 7.93 3.97 0.00 2.00 1.98 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 2.32 2.52 0.00 122 N 7.86 4.42 0.00 2.87 2.97 0.00 0.00 7.29 8.37 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 0.00 123 D 7.93 4.39 0.00 2.83 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 0.00 124 Q 8.15 4.45 0.00 2.20 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.79 6.94 0.00 0.00 0.00 0.00 0.00 2.61 2.36 0.00 125 L 7.54 4.21 0.00 1.80 1.62 0.92 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 126 R 7.58 4.31 0.00 1.87 2.05 0.00 3.06 0.00 0.00 3.26 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.62 0.00 *129 V 7.94 4.05 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 0.73 0.00 0.00 0.93 0.00 0.00 130 R 8.00 4.15 0.00 1.81 1.96 0.00 3.21 0.00 0.00 3.37 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.26 0.00 131 Q 8.12 4.56 0.00 2.05 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.82 6.79 0.00 0.00 0.00 0.00 0.00 2.34 1.98 0.00 132 L 7.73 4.51 0.00 1.64 1.69 0.92 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 133 E 8.16 4.35 0.00 1.92 1.98 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 2.24 2.19 0.00 134 E 8.00 4.39 0.00 2.10 1.98 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 2.24 2.19 0.00 135 E 7.98 4.40 0.00 2.11 1.98 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 2.24 2.19 0.00 136 L 7.78 4.40 0.00 1.66 1.70 0.92 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 137 R 7.71 4.30 0.00 1.92 1.87 0.00 3.23 0.00 0.00 3.26 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.51 0.00 138 I 7.63 4.23 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 1.38 1.10 0.91 0.00 0.00 139 L 7.39 4.66 0.00 1.78 1.59 0.92 0.78 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 0.00 140 K 8.18 4.40 0.00 1.75 1.60 0.00 1.81 0.00 0.00 1.74 0.00 0.00 2.99 0.00 0.00 2.66 0.00 0.00 0.00 0.00 1.39 1.25 7.81 * Residues marked with a * may have inaccurate shift predictions.