NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 83 L 4.4996 8.0433 122.6982 54.9053 43.5044 175.4486 84 Y 4.6408 9.4933 122.5245 56.6102 39.4327 173.0736 85 I 4.9389 9.3084 124.8951 59.8757 40.7325 174.6317 86 G 4.5672 8.8066 116.2259 45.0129 0.0000 172.0500 87 N 4.0407 8.7281 115.2659 54.4198 37.4213 174.5126 88 L 4.4895 7.9730 115.1369 53.1538 43.4867 176.6629 89 T 3.9215 7.3641 110.7152 60.2965 69.3820 175.9805 90 W 4.3175 8.2193 120.2915 58.1496 28.2172 176.4836 91 W 4.5873 6.7818 115.0839 56.3331 27.7819 175.6854 92 T 4.0447 7.5278 117.2485 63.2750 67.5921 175.5311 93 T 4.2024 8.3943 118.2910 60.6312 71.5973 175.0338 94 D 4.6769 8.4303 120.3608 56.7878 39.4467 178.3248 95 E 4.0306 8.1986 119.5525 59.2050 29.0438 178.8204 96 D 4.3898 8.1419 118.9030 57.3202 40.4558 178.5671 97 L 4.1138 7.9001 120.9167 58.2062 42.0813 179.1182 98 T 3.9942 8.3225 118.5087 67.0786 67.0227 177.1757 99 E 4.1921 8.5554 119.5161 60.1157 29.5861 180.4561 100 A 4.5403 7.4717 116.6026 54.2188 19.4312 179.3182 101 V 3.7447 7.2842 116.7178 66.0762 31.6179 177.5810 102 H 4.4677 8.0942 115.7742 58.2461 28.7112 177.1437 103 S 4.4261 7.3962 113.3025 59.6130 62.6438 181.0260 104 L 4.0832 7.6765 120.1133 57.9960 41.8553 178.8098 *106 V 3.8165 7.5050 122.4437 61.6303 31.6868 176.9145 107 N 4.8267 8.7416 123.6229 52.2011 37.5905 174.1808 108 D 4.8629 7.9674 120.5998 53.0781 40.0630 180.2590 109 I 4.7413 7.9591 124.6275 58.2015 39.1702 173.5492 110 L 4.4138 9.4337 132.2415 56.6742 41.1129 174.2934 111 E 4.7980 7.8387 115.8577 55.1859 34.2491 175.3761 112 I 4.6667 8.3576 124.0101 58.8538 39.5942 174.8711 113 K 4.4333 8.9658 128.6022 54.5431 34.4646 175.0618 114 F 4.5998 8.8509 126.1975 56.9010 40.5536 175.0737 115 F 4.6689 8.5513 120.9380 55.9799 40.3346 174.9003 116 E 5.1145 8.5347 120.7377 54.1649 33.1898 174.6058 117 N 4.4846 9.4150 123.3661 54.3655 39.3099 177.0128 118 R 3.9511 8.8378 124.6995 58.7939 30.1173 174.5013 119 A 4.2433 8.4338 119.5901 54.8358 18.4036 177.8635 120 N 4.8078 7.8623 108.3336 51.6672 38.6027 175.2824 121 G 3.8830 8.5899 107.7094 45.3502 0.0000 173.5880 122 Q 4.1430 8.2558 121.9881 55.5817 30.2558 175.3500 123 S 4.5113 8.6499 120.6222 58.6147 62.6293 174.2270 124 K 4.0560 8.9384 126.4058 57.2742 32.4455 178.1317 125 G 4.2837 8.9086 108.3183 45.5883 0.0000 172.7062 126 F 5.5427 7.4205 113.0756 55.4207 41.4379 173.0479 127 A 5.0355 9.1979 121.4525 50.2886 23.3727 174.5157 128 L 4.9918 8.9638 121.6569 53.3575 44.2651 175.2644 129 V 4.6796 8.8602 127.3399 61.0580 33.5808 174.8660 130 G 4.0841 9.5631 118.2792 44.9043 0.0000 172.8384 131 V 4.7197 8.2962 124.1919 61.4527 34.0657 174.2449 *133 S 4.2011 8.7188 118.0092 60.5243 63.7823 175.3064 134 E 4.2483 8.6662 123.3927 60.8913 29.6758 177.0289 135 A 4.3127 8.1211 122.1350 55.7092 18.1597 180.1517 136 S 4.3294 7.9620 119.1616 63.6870 61.4911 180.8197 137 S 4.3142 8.8137 124.7618 63.1611 61.4921 179.0739 138 K 4.6539 8.0034 127.0803 59.3679 32.0377 183.9716 139 K 4.1368 7.9841 125.5213 60.5298 31.4662 183.8196 140 L 4.3769 9.1177 123.6908 58.9119 40.7093 180.9909 141 M 4.5036 7.5791 115.5455 58.4739 32.2674 177.4285 142 D 4.9350 7.7069 121.2513 55.9820 42.1567 183.0087 143 L 4.8699 7.7247 121.1199 57.9880 42.8511 183.6230 144 L 4.4341 7.5080 119.6858 59.3625 40.7040 182.0623 145 P 4.7451 0.0000 0.0000 63.4253 30.9091 177.3899 146 K 4.3664 8.0293 120.7081 54.6730 33.2119 181.2552 147 R 4.5568 7.7799 117.1383 54.8410 29.9675 180.9418 148 E 4.3300 8.6067 124.7708 55.8233 30.2436 177.3799 149 L 4.5489 8.1770 120.6215 53.7924 44.0165 176.1105 150 H 3.9723 9.8441 121.0237 56.0007 26.1296 175.8217 151 G 4.0409 9.4218 105.1427 45.4605 0.0000 173.9231 152 Q 4.5585 7.7447 116.7922 53.9992 32.8896 173.6358 153 N 5.0545 8.4791 118.2204 51.5331 39.6132 173.6461 154 P 4.7289 0.0000 0.0000 62.4837 33.2761 175.1943 155 V 4.6210 8.1473 120.8822 61.1701 34.2451 174.3219 156 V 4.8534 8.3895 127.3596 61.8593 33.3457 174.8650 157 T 4.7958 8.7130 122.7790 61.3536 73.5344 172.3178 158 P 4.4135 0.0000 0.0000 63.1302 31.4609 176.1576 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 83 L 8.04 4.50 0.00 1.36 1.62 0.92 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 84 Y 9.49 4.64 0.00 2.96 2.89 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 85 I 9.31 4.94 1.84 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 1.17 0.79 0.91 0.00 0.00 86 G 8.81 4.57 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 0.00 0.00 0.00 87 N 8.73 4.04 0.00 2.80 2.98 0.00 0.00 6.83 7.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 L 7.97 4.49 0.00 1.87 1.53 0.99 0.86 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 89 T 7.36 3.92 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.55 0.00 0.00 90 W 8.22 4.32 0.00 3.58 3.40 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 91 W 6.78 4.59 0.00 3.07 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 T 7.53 4.04 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 1.24 0.00 0.00 93 T 8.39 4.20 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 1.26 0.00 0.00 94 D 8.43 4.68 0.00 3.11 3.30 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 95 E 8.20 4.03 0.00 2.07 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 0.00 2.43 2.43 0.00 96 D 8.14 4.39 0.00 3.05 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 97 L 7.90 4.11 0.00 1.94 1.86 0.91 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 98 T 8.32 3.99 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 1.26 0.00 0.00 99 E 8.56 4.19 0.00 1.98 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 2.24 2.19 0.00 100 A 7.47 4.54 1.34 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 0.00 0.00 101 V 7.28 3.74 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 0.96 0.00 0.00 0.95 0.00 0.00 102 H 8.09 4.47 0.00 3.22 3.33 0.00 5.72 0.00 0.00 0.00 0.00 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 S 7.40 4.43 0.00 3.60 3.77 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 0.00 104 L 7.68 4.08 0.00 1.81 1.73 0.91 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 *106 V 7.50 3.82 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 0.71 0.00 0.00 0.93 0.00 0.00 107 N 8.74 4.83 0.00 2.73 2.72 0.00 0.00 6.66 8.06 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 0.00 108 D 7.97 4.86 0.00 2.66 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 0.00 109 I 7.96 4.74 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 1.27 1.20 0.91 0.00 0.00 110 L 9.43 4.41 0.00 1.38 1.60 0.92 0.32 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 0.00 111 E 7.84 4.80 0.00 1.61 1.77 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 2.22 1.90 0.00 112 I 8.36 4.67 1.86 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 1.16 1.02 0.63 0.00 0.00 113 K 8.97 4.43 0.00 1.62 1.54 0.00 1.45 0.00 0.00 1.38 0.00 0.00 2.75 0.00 0.00 2.83 0.00 0.00 0.00 0.00 0.85 1.17 7.81 114 F 8.85 4.60 0.00 2.89 2.87 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 0.00 0.00 0.00 115 F 8.55 4.67 0.00 2.27 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 0.00 116 E 8.53 5.11 0.00 1.95 1.84 0.00 0.00 0.00 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 2.26 0.00 117 N 9.42 4.48 0.00 2.73 2.88 0.00 0.00 7.56 7.51 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 0.00 118 R 8.84 3.95 0.00 1.87 1.83 0.00 3.32 0.00 0.00 3.23 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.20 0.00 119 A 8.43 4.24 1.34 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 0.00 0.00 120 N 7.86 4.81 0.00 2.71 2.83 0.00 0.00 6.10 7.00 0.00 0.00 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 G 8.59 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 Q 8.26 4.14 0.00 2.08 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.94 0.00 0.00 0.00 0.00 0.00 2.31 2.04 0.00 123 S 8.65 4.51 0.00 3.92 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 0.00 124 K 8.94 4.06 0.00 1.29 1.69 0.00 1.70 0.00 0.00 1.80 0.00 0.00 2.97 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.49 1.36 7.81 125 G 8.91 4.28 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 0.00 126 F 7.42 5.54 0.00 3.05 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 0.00 127 A 9.20 5.04 0.51 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 0.00 128 L 8.96 4.99 0.00 1.66 1.50 1.16 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 129 V 8.86 4.68 2.05 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 0.77 0.00 0.00 0.82 0.00 0.00 130 G 9.56 4.08 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 0.00 0.00 0.00 131 V 8.30 4.72 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 0.79 0.00 0.00 0.93 0.00 0.00 *133 S 8.72 4.20 0.00 3.90 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 0.00 134 E 8.67 4.25 0.00 1.97 1.96 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 2.31 1.94 0.00 135 A 8.12 4.31 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 0.00 136 S 7.96 4.33 0.00 3.75 3.87 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 0.00 0.00 0.00 137 S 8.81 4.31 0.00 3.68 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 0.00 138 K 8.00 4.65 0.00 1.70 1.83 0.00 1.77 0.00 0.00 1.68 0.00 0.00 2.91 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.32 1.31 7.81 139 K 7.98 4.14 0.00 1.80 1.84 0.00 1.77 0.00 0.00 1.68 0.00 0.00 2.90 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.37 1.32 7.81 140 L 9.12 4.38 0.00 1.47 1.70 0.92 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 141 M 7.58 4.50 0.00 2.23 2.31 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.42 0.00 142 D 7.71 4.93 0.00 2.64 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 0.00 143 L 7.72 4.87 0.00 1.74 1.58 0.92 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 144 L 7.51 4.43 0.00 1.69 1.70 0.92 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 145 P 0.00 4.75 0.00 2.03 2.22 0.00 3.64 0.00 0.00 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.03 0.00 146 K 8.03 4.37 0.00 1.74 1.66 0.00 1.76 0.00 0.00 1.74 0.00 0.00 2.94 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.25 0.96 7.81 147 R 7.78 4.56 0.00 1.81 1.76 0.00 3.24 0.00 0.00 3.27 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.39 0.00 148 E 8.61 4.33 0.00 2.06 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 2.29 0.00 149 L 8.18 4.55 0.00 1.55 1.52 0.92 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 150 H 9.84 3.97 0.00 3.12 3.56 0.00 5.67 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 G 9.42 4.04 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 0.00 0.00 0.00 152 Q 7.74 4.56 0.00 2.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.82 0.00 0.00 0.00 0.00 0.00 2.26 2.30 0.00 153 N 8.48 5.05 0.00 2.68 2.73 0.00 0.00 7.00 8.02 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 0.00 154 P 0.00 4.73 0.00 2.07 1.96 0.00 3.52 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.06 0.00 155 V 8.15 4.62 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 0.93 0.00 0.00 0.93 0.00 0.00 156 V 8.39 4.85 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 1.02 0.00 0.00 157 T 8.71 4.80 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 1.07 0.00 0.00 158 P 0.00 4.41 0.00 2.14 2.02 0.00 3.73 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 1.91 1.92 0.00 * Residues marked with a * may have inaccurate shift predictions.