NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 86 Q 4.2706 8.3449 121.7155 55.3065 31.3946 176.1329 87 P 4.2423 0.0000 0.0000 61.6115 33.1481 175.4762 88 L 3.9596 8.5210 121.5781 58.4945 42.6743 178.5753 89 N 4.3665 8.1530 116.3440 56.3405 38.7946 176.5483 90 Q 4.1200 7.9718 122.2820 58.5209 29.3177 177.8505 91 V 3.6765 7.7464 119.0225 66.0300 31.5380 178.1462 92 I 3.9163 8.1158 119.9192 64.6851 36.8939 178.5611 93 T 3.9836 8.1314 110.6997 65.0138 68.5986 176.3753 94 N 4.4408 8.7348 120.0660 55.8872 38.5596 177.6160 95 S 4.4554 8.4205 116.2453 61.5948 63.2317 176.6797 96 T 3.5884 8.3110 113.5196 64.4208 68.3261 176.7175 97 R 3.8607 7.9808 120.9339 59.2027 29.9478 178.8941 98 Q 3.9353 8.0239 117.7527 58.4442 29.0745 177.1521 99 F 4.1161 8.0107 116.0255 56.0131 39.3247 175.2538 100 N 4.1747 7.5499 114.6581 54.3033 36.4748 173.9975 101 I 4.0689 7.6071 118.1332 59.9336 38.6868 175.8191 102 E 4.3333 8.3120 124.3986 55.0379 30.2315 174.8594 103 L 4.3937 8.3177 127.5390 55.0141 42.4893 176.1305 104 I 4.2359 8.8465 127.6917 63.1702 38.3500 176.1831 105 R 4.6483 7.7024 119.0658 55.4511 33.1274 173.7676 106 V 5.2875 8.5898 117.4278 59.7781 35.4575 175.1488 107 Q 4.6121 9.1148 124.0035 53.6971 31.4387 173.0319 108 P 4.5036 0.0000 0.0000 63.0202 32.2818 176.8396 109 R 4.7423 8.0853 122.0746 55.6320 32.2836 176.4515 110 G 4.0236 8.0081 114.7219 46.6148 0.0000 174.4975 111 E 4.1511 8.8386 122.5653 56.5884 29.0888 175.0363 *114 Q 4.2524 7.9167 119.8136 55.9475 30.4783 173.8707 115 V 4.9716 8.2338 125.4084 60.9054 34.7538 174.4342 116 W 5.0150 9.7586 127.7761 54.9171 31.6804 174.7039 117 I 5.1281 8.3947 117.1801 58.8129 40.4356 175.2002 118 Q 4.3011 8.6753 122.1731 55.0142 29.3428 174.5342 119 P 4.6660 0.0000 0.0000 63.7337 32.1618 175.4343 120 L 4.6658 8.6633 121.5130 53.7934 44.4173 173.2760 121 P 4.6138 0.0000 0.0000 62.5384 32.1470 177.3360 122 F 4.1914 9.1880 124.1395 61.6173 39.2087 177.6001 123 S 4.0482 8.2261 113.2854 61.6311 62.6973 176.2276 124 Q 4.0280 8.0327 122.6637 58.6010 28.8024 177.6690 125 L 4.0773 7.8880 121.4539 58.2114 42.0843 179.0856 126 V 3.3668 7.6039 118.3232 66.1697 31.4235 178.1854 127 S 4.1760 8.1380 114.8420 61.1568 62.6029 176.6194 128 W 3.0478 8.2360 131.0330 60.2667 30.5084 178.1427 129 I 3.0338 7.8955 119.8274 64.0513 36.3911 178.2073 130 A 3.8737 8.0716 121.7298 55.2544 18.1437 178.8839 131 Y 4.0169 7.8332 117.9040 61.0013 38.8190 178.5240 132 L 3.6067 7.6964 120.0024 57.5880 41.4048 179.5199 133 Q 4.0249 7.6053 117.9926 58.4543 28.7770 177.8688 134 E 4.0738 8.1089 119.8196 58.1893 29.7642 178.2587 135 R 4.4296 7.8384 115.6889 55.8202 31.9028 176.6222 136 Q 4.3230 7.2465 114.1112 54.4466 30.2835 175.4052 137 G 3.7438 8.0324 105.1721 46.3233 0.0000 173.4712 138 V 4.3773 7.6726 120.3278 60.9680 33.4344 174.8296 139 S 4.5658 8.7154 124.6511 57.0544 65.3429 173.7413 140 V 4.0866 8.0557 122.7419 62.8682 31.1928 175.0754 141 D 4.6790 9.2211 128.4063 56.1372 42.3032 176.3172 142 A 4.7006 7.6161 117.7224 50.9101 22.6470 175.1124 143 I 4.9135 7.9944 119.6535 59.9078 41.5452 173.3617 144 D 4.8102 9.2154 127.9829 52.6669 44.1404 173.9601 145 I 5.1010 8.5576 126.3074 59.6825 40.0051 174.6359 146 D 5.1046 8.9623 125.5340 51.8077 45.1662 175.4511 147 R 3.7910 8.6368 118.9454 58.1221 30.2041 175.5390 148 G 3.2900 8.9043 113.4442 47.6930 0.0000 175.0683 *153 V 4.1442 8.0235 111.5265 61.0577 34.6524 175.2650 154 V 4.9557 8.8697 113.9896 59.8370 35.6138 174.7743 155 E 4.7703 9.1117 122.8884 55.1180 31.5613 175.6598 156 V 4.4691 8.3807 124.9762 61.5872 30.7152 175.1883 157 K 4.3082 8.9585 127.8772 58.6210 32.9331 177.5959 158 R 4.5133 7.7432 118.9740 54.7177 33.9859 173.9217 159 L 4.8721 8.2009 125.9905 54.0978 46.0441 174.0451 160 Q 4.7495 9.2921 125.8468 54.0758 31.7587 174.5040 161 L 5.0890 8.5156 123.6839 52.8942 44.2209 175.8252 162 K 4.8001 9.0133 123.2534 54.6959 35.8824 176.0048 163 R 4.2127 8.7659 126.1979 56.6566 30.0169 174.4181 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 86 Q 8.34 4.27 0.00 2.02 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.91 0.00 0.00 0.00 0.00 0.00 2.24 2.46 0.00 87 P 0.00 4.24 0.00 2.30 1.99 0.00 3.67 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.21 0.00 88 L 8.52 3.96 0.00 1.72 1.67 0.92 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 89 N 8.15 4.37 0.00 2.93 2.84 0.00 0.00 6.81 7.13 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 90 Q 7.97 4.12 0.00 2.19 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.68 0.00 0.00 0.00 0.00 0.00 2.47 2.31 0.00 91 V 7.75 3.68 2.25 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 1.02 0.00 0.00 0.96 0.00 0.00 92 I 8.12 3.92 1.98 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.85 1.14 0.00 0.00 93 T 8.13 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 1.33 0.00 0.00 94 N 8.73 4.44 0.00 2.88 2.99 0.00 0.00 6.78 7.30 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 95 S 8.42 4.46 0.00 4.51 4.55 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 96 T 8.31 3.59 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 97 R 7.98 3.86 0.00 2.11 2.03 0.00 3.13 0.00 0.00 3.10 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.86 0.00 98 Q 8.02 3.94 0.00 2.00 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 7.00 0.00 0.00 0.00 0.00 0.00 2.30 1.92 0.00 99 F 8.01 4.12 0.00 3.08 3.02 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 N 7.55 4.17 0.00 2.76 2.85 0.00 0.00 6.85 8.34 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 0.00 101 I 7.61 4.07 1.38 0.00 0.00 0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.50 0.36 0.00 0.00 102 E 8.31 4.33 0.00 1.88 1.88 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 2.31 2.24 0.00 103 L 8.32 4.39 0.00 1.60 1.56 1.07 1.14 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 0.00 104 I 8.85 4.24 2.11 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.74 0.85 0.00 0.00 105 R 7.70 4.65 0.00 1.64 1.51 0.00 2.43 0.00 0.00 2.25 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.46 0.00 106 V 8.59 5.29 2.21 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 0.88 0.00 0.00 1.06 0.00 0.00 107 Q 9.11 4.61 0.00 2.43 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.82 0.00 0.00 0.00 0.00 0.00 2.38 2.41 0.00 108 P 0.00 4.50 0.00 2.25 2.08 0.00 3.83 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 2.02 2.02 0.00 109 R 8.09 4.74 0.00 1.76 1.89 0.00 3.25 0.00 0.00 3.24 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.80 0.00 110 G 8.01 4.02 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 0.00 0.00 0.00 111 E 8.84 4.15 0.00 2.03 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.29 0.00 *114 Q 7.92 4.25 0.00 2.04 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.87 0.00 0.00 0.00 0.00 0.00 1.16 1.16 0.00 115 V 8.23 4.97 2.14 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 1.05 0.00 0.00 1.01 0.00 0.00 116 W 9.76 5.02 0.00 3.24 2.93 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 0.00 117 I 8.39 5.13 1.76 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.67 0.80 0.00 0.00 118 Q 8.68 4.30 0.00 1.95 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.63 6.78 0.00 0.00 0.00 0.00 0.00 2.52 2.48 0.00 119 P 0.00 4.67 0.00 1.95 2.13 0.00 3.71 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 2.06 2.15 0.00 120 L 8.66 4.67 0.00 1.87 1.69 0.85 1.08 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 0.00 121 P 0.00 4.61 0.00 2.24 2.06 0.00 3.86 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 2.13 2.10 0.00 122 F 9.19 4.19 0.00 3.15 3.13 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 0.00 123 S 8.23 4.05 0.00 4.12 4.18 0.00 0.00 0.00 0.00 0.00 0.00 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 8.03 4.03 0.00 2.18 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.94 0.00 0.00 0.00 0.00 0.00 2.46 2.49 0.00 125 L 7.89 4.08 0.00 1.85 1.70 1.17 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 126 V 7.60 3.37 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 0.98 0.00 0.00 0.17 0.00 0.00 127 S 8.14 4.18 0.00 4.17 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 0.00 128 W 8.24 3.05 0.00 3.02 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 0.00 129 I 7.90 3.03 1.70 0.00 0.00 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.70 0.71 0.00 0.00 130 A 8.07 3.87 1.37 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 0.00 0.00 131 Y 7.83 4.02 0.00 3.18 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 0.00 132 L 7.70 3.61 0.00 1.41 1.49 -0.15 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 133 Q 7.61 4.02 0.00 2.09 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.99 0.00 0.00 0.00 0.00 0.00 2.52 2.14 0.00 134 E 8.11 4.07 0.00 1.95 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.46 0.00 135 R 7.84 4.43 0.00 0.94 1.67 0.00 3.34 0.00 0.00 3.21 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.78 0.00 136 Q 7.25 4.32 0.00 1.91 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.76 0.00 0.00 0.00 0.00 0.00 1.72 2.17 0.00 137 G 8.03 3.74 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 0.00 0.00 0.00 138 V 7.67 4.38 1.90 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 0.82 0.00 0.00 0.92 0.00 0.00 139 S 8.72 4.57 0.00 3.73 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 0.00 140 V 8.06 4.09 1.99 0.00 0.00 0.00 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 0.78 0.00 0.00 141 D 9.22 4.68 0.00 2.60 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 0.00 142 A 7.62 4.70 1.15 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 0.00 0.00 143 I 7.99 4.91 1.85 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.83 0.91 0.00 0.00 144 D 9.22 4.81 0.00 2.70 2.53 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.56 5.10 1.94 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.87 1.08 0.00 0.00 146 D 8.96 5.10 0.00 2.64 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 R 8.64 3.79 0.00 1.69 1.88 0.00 3.19 0.00 0.00 3.22 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.64 0.00 148 G 8.90 3.29 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 0.00 *153 V 8.02 4.14 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 0.86 0.00 0.00 0.96 0.00 0.00 154 V 8.87 4.96 2.29 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 0.82 0.00 0.00 1.16 0.00 0.00 155 E 9.11 4.77 0.00 1.93 1.89 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 2.28 2.29 0.00 156 V 8.38 4.47 2.14 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 0.87 0.00 0.00 1.01 0.00 0.00 157 K 8.96 4.31 0.00 1.86 1.87 0.00 1.93 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.51 1.41 7.81 158 R 7.74 4.51 0.00 1.78 1.64 0.00 3.11 0.00 0.00 3.22 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.63 0.00 159 L 8.20 4.87 0.00 1.78 1.56 0.94 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 160 Q 9.29 4.75 0.00 1.89 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.55 6.54 0.00 0.00 0.00 0.00 0.00 2.22 2.18 0.00 161 L 8.52 5.09 0.00 1.45 1.46 0.77 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 162 K 9.01 4.80 0.00 1.70 1.53 0.00 1.55 0.00 0.00 1.54 0.00 0.00 2.76 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.27 1.31 7.81 163 R 8.77 4.21 0.00 1.74 1.67 0.00 3.31 0.00 0.00 3.22 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.75 0.00 * Residues marked with a * may have inaccurate shift predictions.