NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 83 L 4.4860 8.0433 122.7767 55.0260 43.6846 175.8771 84 Y 4.5574 8.8585 124.3561 57.7033 39.7084 173.4790 85 I 4.6421 9.3256 123.4510 59.9364 41.4799 174.8074 86 G 4.2536 8.8361 114.8392 44.6028 0.0000 172.2993 87 N 4.4766 8.7562 114.3222 54.3394 36.7275 173.6543 88 L 4.3611 8.0291 116.5308 53.4157 42.8841 176.7138 89 T 3.7240 7.6801 112.1503 60.4160 69.4042 175.5353 90 W 4.3918 7.9849 119.4038 57.7789 28.0623 176.2958 91 W 4.7098 6.4994 115.6280 56.4963 27.7386 175.7119 92 T 4.2082 7.6975 117.4968 63.6648 68.0201 175.5558 93 T 4.3063 8.7262 120.7104 60.9894 71.7538 176.1550 94 D 4.7383 8.4957 122.0788 58.8409 39.7657 175.6909 95 E 4.1680 8.2613 119.9450 59.3732 29.6403 178.9600 96 D 4.3974 8.5611 119.1530 57.6064 40.9528 178.9302 97 L 4.0387 7.9004 120.2777 58.1936 41.9956 179.1133 98 T 3.8005 7.9844 118.3503 67.1757 68.4072 176.8785 99 E 3.9518 8.3137 120.0239 61.2251 29.4773 180.8979 100 A 4.1804 7.6210 120.3077 55.0311 18.4464 179.7006 101 V 3.7017 7.8577 116.7817 66.2347 31.7117 177.7361 102 H 4.5681 8.6564 118.0954 58.4870 28.4685 177.5043 103 S 4.6557 7.8203 120.8806 61.3817 62.2028 179.9207 104 L 4.9145 7.9110 118.3137 54.3757 43.3418 181.5810 105 G 4.1273 9.4512 108.0293 47.4652 0.0000 176.0757 106 V 4.4194 7.6982 117.6916 59.8113 32.8027 177.5919 107 N 4.7473 8.3752 121.4562 52.4190 38.1985 176.8316 108 D 4.8764 7.6030 119.3066 52.0313 39.7754 177.1650 109 I 4.9037 7.9666 127.0343 59.2564 40.8822 174.9207 110 L 4.1310 12.0000 132.6751 56.7690 40.7418 175.8123 111 E 4.7824 9.4781 115.1325 55.4602 32.7234 177.6796 112 I 4.8522 8.2795 117.7715 58.1057 40.2409 175.0407 113 K 4.3556 8.8931 126.0994 54.6421 35.1243 175.0433 114 F 4.5362 8.7847 126.7660 57.2165 40.1373 175.1679 115 F 4.4047 8.6010 122.4680 56.6649 39.9326 174.7226 116 E 5.0866 8.5105 120.5922 54.1068 33.2053 174.6682 117 N 4.4028 9.1460 121.0358 53.8580 39.2619 176.0232 118 R 3.8837 8.8156 126.6796 58.8617 30.6664 177.2629 119 A 4.1918 8.1550 120.6910 54.2382 18.4592 177.5538 120 N 4.8095 7.8883 108.5577 51.8297 38.7861 175.2630 121 G 3.8567 8.5022 107.4047 45.4317 0.0000 173.5191 122 Q 4.0437 7.8232 122.2421 55.3741 30.2464 175.2425 123 S 4.3907 8.7510 121.1370 58.9971 62.5884 173.9417 124 K 4.2071 9.2557 126.1782 57.0019 32.0735 178.2341 125 G 4.1428 9.6886 110.4858 45.7168 0.0000 173.0495 126 F 5.4250 7.4448 114.4098 55.4033 41.2601 173.5615 127 A 4.9521 8.8437 124.6862 50.1380 22.1334 174.8645 128 L 5.0090 8.9759 122.0083 53.2436 44.4493 175.5602 129 V 4.8518 9.0289 126.1439 60.9575 34.5660 174.6451 130 G 4.1639 9.4450 113.5923 44.5626 0.0000 171.5343 131 V 4.8823 8.5168 121.2095 62.3625 31.1896 179.1080 *133 S 4.3145 9.0690 115.2395 58.8736 64.7734 173.8917 134 E 3.7889 8.6949 125.0243 60.6132 29.4930 175.9196 135 A 4.4291 8.1661 120.1668 55.0596 18.6390 179.2047 136 S 4.5994 7.8149 118.8728 62.5688 63.7425 182.3136 137 S 4.4702 8.7461 125.5960 64.0758 62.0058 179.4977 138 K 4.3016 8.1734 129.9261 60.0946 31.2729 181.6086 139 K 4.3835 8.1437 126.2848 59.3583 31.4758 181.7423 140 L 4.5764 7.7168 119.7059 58.4640 41.5552 183.6304 141 M 4.3788 8.2012 118.3439 58.0014 32.5199 177.2634 142 D 4.7313 7.7626 118.3028 54.9339 41.6162 183.7596 143 L 4.4505 7.4397 121.4416 57.4242 41.6060 180.5921 144 L 4.2940 7.6385 119.0294 58.3791 42.0241 176.9554 145 P 4.6937 0.0000 0.0000 64.1504 31.2793 178.9168 146 K 4.2488 7.8075 125.1689 59.2131 32.1285 183.7299 147 R 4.3878 7.4586 118.3610 55.1746 30.0405 177.3980 148 E 4.5310 8.5507 121.7187 54.5788 30.4709 176.2212 149 L 4.0795 8.7029 125.1724 56.8760 42.7401 177.3671 150 H 4.8395 7.6408 114.0380 54.8987 29.0621 174.8277 151 G 4.0247 8.4020 105.1803 45.4462 0.0000 172.3532 152 Q 4.5370 7.5370 118.0004 53.7324 32.1158 174.1504 153 N 4.7572 8.6699 119.8760 51.9585 39.1487 173.4516 154 P 4.5115 0.0000 0.0000 62.9285 33.2261 175.8306 155 V 4.3877 8.6293 122.2061 61.2181 33.6155 174.1302 156 V 4.6644 8.4618 130.4635 62.9379 32.5806 175.5107 157 T 4.7828 8.2915 123.6268 59.4783 72.6407 169.1562 158 P 4.6203 0.0000 0.0000 64.6799 31.6321 173.9815 159 S 4.3491 8.2171 120.3935 56.7385 62.1484 170.7618 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 4.49 0.00 1.84 1.67 1.00 0.65 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 84 Y 8.86 4.56 0.00 2.95 2.86 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 85 I 9.33 4.64 1.87 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 1.18 0.87 0.93 0.00 0.00 86 G 8.84 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 0.00 0.00 0.00 0.00 87 N 8.76 4.48 0.00 2.86 2.94 0.00 0.00 6.93 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 8.03 4.36 0.00 1.89 1.59 1.08 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 89 T 7.68 3.72 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 0.58 0.00 0.00 90 W 7.98 4.39 0.00 3.53 3.38 0.00 0.00 0.00 0.00 0.00 0.00 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 6.50 4.71 0.00 3.11 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 T 7.70 4.21 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 1.29 0.00 0.00 93 T 8.73 4.31 4.26 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 0.00 0.00 0.00 1.28 0.00 0.00 94 D 8.50 4.74 0.00 2.71 2.72 0.00 0.00 0.00 0.00 0.00 0.00 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 8.26 4.17 0.00 2.04 2.06 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 2.43 2.44 0.00 96 D 8.56 4.40 0.00 2.97 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 L 7.90 4.04 0.00 2.02 1.67 0.94 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 98 T 7.98 3.80 4.33 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 0.00 0.00 0.00 0.99 0.00 0.00 99 E 8.31 3.95 0.00 1.97 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 2.25 2.21 0.00 100 A 7.62 4.18 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.86 3.70 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 1.10 0.00 0.00 0.93 0.00 0.00 102 H 8.66 4.57 0.00 3.28 3.31 0.00 5.68 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 S 7.82 4.66 0.00 3.73 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 0.00 104 L 7.91 4.91 0.00 1.63 1.50 0.92 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 105 G 9.45 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 0.00 106 V 7.70 4.42 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 8.38 4.75 0.00 2.73 2.70 0.00 0.00 6.69 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 7.60 4.88 0.00 2.61 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 0.00 109 I 7.97 4.90 1.89 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 1.33 1.16 0.91 0.00 0.00 110 L 12.00 4.13 0.00 1.44 1.18 0.92 0.84 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 0.00 111 E 9.48 4.78 0.00 1.64 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 2.23 1.85 0.00 112 I 8.28 4.85 1.65 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 1.08 0.69 0.00 0.00 113 K 8.89 4.36 0.00 1.67 1.41 0.00 1.74 0.00 0.00 1.65 0.00 0.00 2.78 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.32 1.27 7.81 114 F 8.78 4.54 0.00 2.90 2.86 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 0.00 115 F 8.60 4.40 0.00 2.12 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 0.00 116 E 8.51 5.09 0.00 1.95 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 2.11 2.24 0.00 117 N 9.15 4.40 0.00 2.73 2.90 0.00 0.00 7.06 7.64 0.00 0.00 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 8.82 3.88 0.00 1.81 1.94 0.00 3.29 0.00 0.00 3.23 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.62 0.00 119 A 8.15 4.19 1.33 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 0.00 0.00 0.00 0.00 0.00 0.00 120 N 7.89 4.81 0.00 2.70 2.80 0.00 0.00 6.12 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 8.50 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 0.00 0.00 0.00 122 Q 7.82 4.04 0.00 2.06 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.89 0.00 0.00 0.00 0.00 0.00 2.22 1.91 0.00 123 S 8.75 4.39 0.00 3.82 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 0.00 124 K 9.26 4.21 0.00 1.50 1.71 0.00 1.75 0.00 0.00 1.81 0.00 0.00 2.99 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.50 1.36 7.81 125 G 9.69 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 0.00 0.00 0.00 0.00 126 F 7.44 5.42 0.00 3.16 3.12 0.00 0.00 0.00 0.00 0.00 0.00 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 8.84 4.95 0.45 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 0.00 0.00 0.00 0.00 0.00 0.00 128 L 8.98 5.01 0.00 1.60 1.61 1.03 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 129 V 9.03 4.85 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 0.79 0.00 0.00 0.83 0.00 0.00 130 G 9.45 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 0.00 131 V 8.52 4.88 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 1.36 0.00 0.00 0.95 0.00 0.00 *133 S 9.07 4.31 0.00 4.02 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 0.00 134 E 8.69 3.79 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 8.17 4.43 1.30 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 0.00 0.00 136 S 7.81 4.60 0.00 3.73 3.85 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 0.00 0.00 0.00 137 S 8.75 4.47 0.00 3.69 3.92 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 0.00 0.00 0.00 0.00 138 K 8.17 4.30 0.00 1.78 1.85 0.00 1.78 0.00 0.00 1.68 0.00 0.00 2.93 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.37 1.33 7.81 139 K 8.14 4.38 0.00 1.72 1.85 0.00 1.76 0.00 0.00 1.68 0.00 0.00 2.92 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.37 1.32 7.81 140 L 7.72 4.58 0.00 1.64 1.68 0.92 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 141 M 8.20 4.38 0.00 2.00 2.15 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.84 2.49 0.00 142 D 7.76 4.73 0.00 2.81 2.54 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 0.00 0.00 0.00 0.00 143 L 7.44 4.45 0.00 1.70 1.60 0.92 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 144 L 7.64 4.29 0.00 1.79 1.75 0.92 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 145 P 0.00 4.69 0.00 2.05 2.21 0.00 3.93 0.00 0.00 4.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.09 0.00 146 K 7.81 4.25 0.00 1.90 1.71 0.00 1.80 0.00 0.00 1.74 0.00 0.00 3.00 0.00 0.00 2.67 0.00 0.00 0.00 0.00 1.39 1.32 7.81 147 R 7.46 4.39 0.00 1.83 1.75 0.00 3.22 0.00 0.00 3.28 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.18 0.00 148 E 8.55 4.53 0.00 2.15 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 2.24 2.31 0.00 149 L 8.70 4.08 0.00 1.58 1.65 0.92 1.16 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 0.00 150 H 7.64 4.84 0.00 2.80 3.26 0.00 5.73 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 8.40 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 0.00 152 Q 7.54 4.54 0.00 1.98 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 7.04 0.00 0.00 0.00 0.00 0.00 2.30 2.28 0.00 153 N 8.67 4.76 0.00 2.71 2.91 0.00 0.00 7.04 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 4.51 0.00 2.07 1.98 0.00 3.56 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.08 0.00 155 V 8.63 4.39 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 0.98 0.00 0.00 156 V 8.46 4.66 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 0.90 0.00 0.00 0.96 0.00 0.00 157 T 8.29 4.78 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 0.00 158 P 0.00 4.62 0.00 1.85 1.87 0.00 3.75 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.59 0.00 159 S 8.22 4.35 0.00 3.64 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.