NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 19 G 3.8271 8.3544 109.7354 45.3753 0.0000 173.5649 20 K 4.0412 8.2674 125.9795 54.9164 34.0926 174.7383 21 D 4.5875 8.5996 117.2049 54.3304 41.1191 173.5581 22 S 4.4182 7.3928 112.6468 58.0275 64.0024 173.5225 23 P 4.0280 0.0000 0.0000 65.5021 30.9219 178.7415 24 L 3.8514 7.7446 118.5828 58.1991 42.0450 178.9921 25 V 3.5242 7.6606 118.1270 66.1129 31.3506 177.7474 26 N 4.2959 8.2158 116.3231 56.0593 38.3028 177.2001 27 F 4.1866 7.8164 122.2232 61.4115 39.5119 177.1896 28 L 3.9966 8.2218 118.9539 57.6730 41.3368 179.8289 29 G 3.6240 8.2884 105.9098 47.9268 0.0000 175.5522 30 D 4.4970 8.6414 121.8260 57.0781 40.7952 178.8631 31 L 4.0463 8.2992 119.6748 57.8029 41.5208 179.0755 32 D 4.2127 8.1467 118.0072 57.1561 41.1885 177.8410 33 E 3.9632 8.3702 119.8791 59.2372 29.6249 178.4955 34 L 4.1495 8.2753 120.5170 58.3742 42.2634 178.3770 35 N 4.3694 8.6538 117.3524 56.9112 38.7863 177.0432 36 S 4.1797 8.5434 116.9408 61.6055 62.9272 176.6128 37 F 4.1612 8.4151 120.5124 60.5668 38.5238 177.7995 38 I 3.9920 8.4121 119.9129 64.3544 36.9060 178.6231 39 G 3.7159 8.4336 106.6900 47.7807 0.0000 175.5437 40 F 4.3679 8.2652 121.9152 61.0233 39.7582 176.7139 41 A 3.9445 8.5804 120.8630 55.2214 18.1228 179.5487 42 I 3.6622 8.1182 118.8171 64.6440 37.0338 178.8247 43 S 4.2209 7.9610 113.2818 60.3831 62.8648 175.5037 44 K 4.2654 7.4179 119.8838 55.0301 32.6411 175.7858 45 I 4.0398 6.8695 121.0447 58.8013 38.5464 173.9452 46 P 4.2499 0.0000 0.0000 63.0338 31.9533 175.9236 47 W 4.6813 7.2183 119.9942 55.9005 30.0074 176.2844 48 E 4.2051 9.0819 123.3845 59.4782 29.4623 179.0383 49 D 4.7047 8.2542 114.8322 54.2152 39.1091 177.9370 *51 K 4.2774 8.1576 120.9084 57.0896 34.3915 177.9995 52 K 3.9832 8.3911 119.2536 59.7068 32.0523 178.5082 53 D 4.8712 8.3021 118.9591 57.7291 40.8652 178.8828 54 L 4.2277 8.1207 118.9517 57.9047 41.5492 179.2667 55 E 4.1045 8.7098 118.9560 59.3205 29.3411 179.3958 56 R 3.8545 8.0903 118.5910 59.2686 30.0187 178.6311 57 V 3.9695 8.1299 118.1770 66.3180 31.5026 177.9580 58 Q 4.6249 8.3054 119.0659 58.5158 28.5986 179.0718 59 V 3.7329 7.7406 119.1955 66.2622 31.5876 178.0495 60 E 4.1743 8.5415 118.1122 59.2120 29.2150 179.3468 61 L 3.9869 8.3024 119.6966 57.6401 41.6209 179.4382 62 F 3.8943 8.1256 117.5918 60.4165 38.7400 177.5958 63 E 4.0390 8.3652 118.3720 59.3580 29.1358 179.4382 64 I 3.5610 8.0266 120.5251 64.2160 37.0520 178.6865 65 G 3.4067 8.0558 106.5791 47.7769 0.0000 175.6384 66 E 3.9544 8.1342 120.8834 58.9014 29.4370 178.6416 67 D 4.3747 8.2623 118.5161 57.4231 41.0745 178.1721 68 L 3.8577 7.6324 118.1666 58.1825 41.7888 179.7971 69 S 4.3401 8.0943 113.2268 60.3856 62.8941 175.1311 70 T 4.4750 7.4782 110.8288 60.3778 69.2002 173.7535 71 Q 3.4194 9.0285 119.7359 58.0652 27.2774 173.8227 72 S 4.5771 8.2978 106.9161 59.3979 61.4033 173.6449 73 S 4.2977 8.1411 118.5460 61.2202 62.8200 175.7758 74 K 4.2181 8.0549 119.7702 58.0681 32.6662 176.8187 75 K 4.6005 7.5383 116.3051 54.6767 36.0188 175.0561 76 K 4.5210 8.3105 122.3603 54.4635 34.0086 175.9601 77 I 3.0848 8.6417 129.0827 61.0772 37.6665 175.3874 78 D 5.0384 8.3678 123.2787 50.7122 42.8014 175.6186 79 E 4.1112 8.9600 117.1527 59.9486 29.2662 179.7201 80 K 4.1754 8.1848 117.8704 59.4102 31.5019 179.0449 81 Y 4.1825 8.4646 116.8552 61.2432 37.9187 178.6126 82 V 3.7359 8.2124 118.7085 65.7662 31.6045 177.4479 83 K 4.0082 8.6108 119.8803 59.5807 32.0587 178.1814 84 W 4.4975 8.1176 129.2007 59.8938 30.5801 177.8006 85 L 3.2705 7.6935 117.8139 57.6912 41.0320 179.4144 86 E 3.9607 8.0889 118.4216 59.4334 29.3357 179.3364 87 E 3.9510 8.3289 118.8066 59.4792 29.5384 179.6695 88 R 3.8821 7.7079 118.0972 59.1865 29.5758 179.1934 89 T 4.0438 7.8978 115.7215 66.7400 68.5104 176.6461 90 V 3.6285 7.9384 120.0753 66.1574 31.3579 177.9182 91 E 3.8611 8.0429 118.1096 59.5822 29.1754 178.9992 92 Y 4.0369 7.8592 116.7891 61.0342 37.8546 178.4796 93 R 3.8568 8.1068 121.0032 58.6347 29.8424 178.7067 94 K 3.8509 7.6945 117.8628 59.2086 32.0398 178.5889 95 E 4.0428 7.5985 119.2915 59.1472 29.5564 178.6458 96 S 4.2381 8.3808 114.5010 58.8885 63.2049 175.2292 97 G 3.7829 8.0913 110.2326 43.5089 0.0000 170.9808 98 P 4.6290 0.0000 0.0000 62.5776 32.0941 176.0124 99 V 4.6474 8.6571 119.4684 59.7707 34.6731 175.2007 100 K 4.6555 8.9312 122.5023 56.6752 32.9629 176.1452 101 L 5.0276 8.9507 122.9085 53.1734 44.7720 175.9232 102 F 5.2051 8.9400 121.0935 56.8932 40.9711 175.0002 103 V 4.4864 8.6974 121.9014 62.4137 32.4611 175.3565 104 I 4.2632 8.7989 130.2906 59.6435 37.6459 174.3170 105 P 3.8101 0.0000 0.0000 61.7618 31.7553 176.9574 106 G 3.9080 9.3281 110.1852 45.2345 0.0000 170.9336 107 G 4.1390 8.2240 109.5236 44.1100 0.0000 178.1678 108 S 4.3828 9.6038 120.4286 57.7009 64.6666 173.9576 109 E 3.9249 8.6848 122.9745 59.3180 29.3903 178.9628 110 E 3.8902 8.1675 118.0581 59.4783 29.6386 179.0368 111 A 4.0256 8.1359 120.7153 55.1622 18.2450 179.8977 112 S 4.1117 8.4291 114.1188 61.8658 62.9291 177.1309 113 V 3.7303 8.1091 121.0816 65.8029 31.1523 178.1154 114 L 4.0193 7.9328 119.0265 58.0512 41.3563 179.1614 115 H 4.2574 8.4650 116.4278 58.6359 28.5974 178.0408 116 V 3.5167 7.9429 120.1549 66.3297 31.3160 178.2269 117 T 3.8117 8.0742 115.5062 66.5306 68.2885 176.5385 118 R 3.8906 8.3542 121.3069 59.5427 30.1718 178.8086 119 S 4.1185 8.2890 114.1253 61.2676 62.8702 176.6523 120 V 3.4808 7.7445 121.8598 65.5571 31.1345 177.8007 121 A 4.0262 8.2321 120.8367 55.3704 18.1951 179.8865 122 R 3.8379 8.1236 116.5064 59.1798 29.9879 179.3202 123 R 3.8181 7.8347 118.7477 59.2967 30.0413 178.7493 124 V 3.5720 8.0580 118.3533 65.7607 31.6403 177.5548 125 E 3.9130 8.4896 119.4360 59.3975 29.5511 179.0437 126 R 3.8110 7.9886 117.9640 59.3788 30.1515 178.7933 127 N 3.7686 8.1313 116.0822 55.9469 38.4070 177.1627 128 A 3.2654 7.9101 122.5000 54.9752 18.1744 179.8002 129 V 3.4607 7.1663 115.0895 65.9957 31.9524 177.8978 130 K 3.9635 7.4500 118.8439 59.6804 31.9589 178.5161 131 Y 4.3957 7.8817 117.5783 61.0921 37.6962 178.4234 132 T 4.1105 8.1530 110.8895 64.6710 68.4641 176.7352 133 K 4.1220 7.6825 120.3378 59.0316 32.2249 177.9188 134 E 4.3548 8.0168 116.4311 57.5796 30.5290 176.5693 135 L 5.0144 7.8387 117.9416 50.6520 42.0010 175.2701 136 P 4.5368 0.0000 0.0000 63.9184 32.1240 177.4532 137 E 4.2088 8.0667 116.9787 57.1204 29.9834 176.3849 138 I 3.7143 7.5787 120.0664 60.6500 38.4523 174.8096 139 N 4.3452 8.6531 125.9971 53.5751 39.2473 176.2369 140 R 4.1252 8.5019 131.7160 56.1381 29.6284 177.7718 *142 I 4.1466 7.7595 120.0201 61.5665 39.6702 178.7978 143 I 3.8659 7.7747 120.4935 64.2868 36.8874 178.4709 144 V 3.6122 7.7089 119.3056 66.0256 31.2688 177.3818 145 Y 4.0188 8.1060 118.7497 60.8527 38.6240 177.9333 146 L 4.1219 8.2962 119.8422 57.8372 41.8670 179.0972 147 N 4.4114 8.4020 116.9860 56.9187 38.9550 177.2686 148 R 3.9707 8.1239 119.4766 58.8600 29.9769 178.7956 149 L 3.8423 8.0309 120.8842 58.0954 42.1152 179.2120 150 S 4.1091 7.8755 114.0038 61.5781 62.7741 176.7217 151 S 3.9993 7.6471 117.5755 60.9889 62.2651 176.3222 152 L 4.0446 7.5910 123.7382 57.6503 41.9360 178.6633 153 L 4.0673 7.9055 117.9008 57.6256 41.8362 179.0214 154 F 4.1692 8.3363 120.3076 61.0464 39.5239 178.8133 155 A 4.2347 8.3881 119.6693 52.2979 18.2478 179.0849 *157 A 4.1304 8.0561 125.9904 53.7655 20.9201 180.1813 158 L 4.1422 7.6141 117.1031 57.4987 41.5994 179.9436 159 V 3.4821 7.6288 117.6181 65.5955 31.4926 177.8085 160 A 3.3800 7.7254 120.1142 55.1723 18.2012 179.2215 161 N 4.3107 8.0451 114.8786 56.2151 38.6155 177.4575 162 K 3.8271 7.9184 121.0124 59.7873 32.0905 179.0806 163 R 3.9794 8.0390 116.7842 58.2837 29.8705 178.1679 164 R 4.5453 7.4540 115.4220 54.8422 30.5311 175.6480 165 N 4.2003 7.9706 114.9442 54.3672 36.7084 174.0373 166 V 4.3702 7.8274 117.0960 61.0225 33.4401 175.3951 167 S 4.4692 8.4285 122.9640 57.9595 63.5297 173.8293 168 E 4.2255 8.5199 122.8339 56.2432 30.2979 175.8472 169 K 4.6729 8.4735 121.7911 55.3351 34.1383 175.5086 170 I 5.0431 8.4193 124.4762 59.8482 40.4331 175.0768 171 Y 4.5344 9.0082 128.2902 55.2138 39.2658 172.3097 172 D 4.8022 8.3439 123.2986 54.1507 41.7592 175.2986 173 I 4.0838 8.7191 119.2523 60.3960 37.9411 176.5970 174 G 3.9223 8.9582 109.6422 45.4260 0.0000 173.4450 175 K 4.7099 7.5540 118.1796 54.2256 35.5160 174.8073 176 F 5.4550 7.9241 114.1233 54.9672 41.2654 174.6235 177 W 4.5120 9.6431 130.7030 57.6865 30.7346 175.0466 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 19 G 8.35 3.83 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 0.00 0.00 0.00 0.00 0.00 0.00 20 K 8.27 4.04 0.00 1.87 1.71 0.00 1.82 0.00 0.00 1.78 0.00 0.00 2.89 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.44 1.48 7.81 21 D 8.60 4.59 0.00 2.86 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 22 S 7.39 4.42 0.00 4.02 3.96 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 0.00 0.00 0.00 23 P 0.00 4.03 0.00 2.17 2.20 0.00 3.59 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.41 0.00 24 L 7.74 3.85 0.00 1.72 1.62 0.84 0.84 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 25 V 7.66 3.52 2.04 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 1.03 0.00 0.00 0.90 0.00 0.00 26 N 8.22 4.30 0.00 2.75 2.83 0.00 0.00 6.67 7.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 F 7.82 4.19 0.00 2.61 2.82 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 28 L 8.22 4.00 0.00 1.81 1.63 0.85 0.96 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 29 G 8.29 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 D 8.64 4.50 0.00 3.09 2.88 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 31 L 8.30 4.05 0.00 1.77 1.62 0.56 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 32 D 8.15 4.21 0.00 2.73 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 33 E 8.37 3.96 0.00 2.17 2.19 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 2.68 2.53 0.00 34 L 8.28 4.15 0.00 1.90 1.91 1.02 0.86 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 35 N 8.65 4.37 0.00 3.01 2.90 0.00 0.00 7.29 6.75 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 36 S 8.54 4.18 0.00 3.92 3.76 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 0.00 0.00 0.00 37 F 8.42 4.16 0.00 3.32 3.21 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 38 I 8.41 3.99 2.17 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.98 1.04 0.00 0.00 39 G 8.43 3.72 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 0.00 0.00 0.00 40 F 8.27 4.37 0.00 2.87 3.34 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 41 A 8.58 3.94 1.40 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 0.00 0.00 42 I 8.12 3.66 2.08 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.46 0.94 0.00 0.00 43 S 7.96 4.22 0.00 4.06 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 44 K 7.42 4.27 0.00 1.56 1.63 0.00 1.52 0.00 0.00 1.53 0.00 0.00 2.97 0.00 0.00 2.85 0.00 0.00 0.00 0.00 0.88 0.68 7.81 45 I 6.87 4.04 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 1.40 0.59 1.08 0.00 0.00 46 P 0.00 4.25 0.00 1.75 1.77 0.00 2.20 0.00 0.00 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 1.10 0.00 47 W 7.22 4.68 0.00 3.57 3.24 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 0.00 48 E 9.08 4.21 0.00 2.09 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 0.00 2.47 2.30 0.00 49 D 8.25 4.70 0.00 2.95 2.98 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 0.00 0.00 0.00 *51 K 8.16 4.28 0.00 2.10 2.00 0.00 1.70 0.00 0.00 1.76 0.00 0.00 2.90 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.46 1.70 7.81 52 K 8.39 3.98 0.00 1.96 2.18 0.00 1.71 0.00 0.00 1.76 0.00 0.00 3.06 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.57 1.55 7.81 53 D 8.30 4.87 0.00 3.03 3.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 L 8.12 4.23 0.00 1.80 1.83 0.98 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 55 E 8.71 4.10 0.00 2.26 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 0.00 2.39 2.46 0.00 56 R 8.09 3.85 0.00 1.73 2.01 0.00 2.37 0.00 0.00 2.25 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 1.25 0.00 57 V 8.13 3.97 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 1.42 0.00 0.00 58 Q 8.31 4.62 0.00 2.45 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.58 0.00 0.00 0.00 0.00 0.00 2.65 2.59 0.00 59 V 7.74 3.73 2.27 0.00 0.00 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 0.99 0.00 0.00 60 E 8.54 4.17 0.00 2.39 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 0.00 2.50 2.62 0.00 61 L 8.30 3.99 0.00 1.84 1.63 1.08 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 62 F 8.13 3.89 0.00 3.35 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 63 E 8.37 4.04 0.00 2.22 2.01 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 2.39 2.63 0.00 64 I 8.03 3.56 1.82 0.00 0.00 0.41 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 0.43 0.65 0.00 0.00 65 G 8.06 3.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 E 8.13 3.95 0.00 2.16 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 2.35 2.59 0.00 67 D 8.26 4.37 0.00 2.64 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 L 7.63 3.86 0.00 1.58 1.52 -0.26 0.99 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 69 S 8.09 4.34 0.00 3.82 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 70 T 7.48 4.47 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 1.23 0.00 0.00 71 Q 9.03 3.42 0.00 2.13 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.16 6.69 0.00 0.00 0.00 0.00 0.00 2.25 2.35 0.00 72 S 8.30 4.58 0.00 4.01 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 73 S 8.14 4.30 0.00 3.92 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 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 1.12 0.00 0.00 83 K 8.61 4.01 0.00 2.03 2.14 0.00 1.75 0.00 0.00 1.62 0.00 0.00 3.04 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.53 1.60 7.81 84 W 8.12 4.50 0.00 3.57 3.57 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 85 L 7.69 3.27 0.00 1.79 1.45 0.05 0.77 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 86 E 8.09 3.96 0.00 2.16 2.00 0.00 0.00 0.00 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 2.56 0.00 87 E 8.33 3.95 0.00 1.93 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 2.34 2.60 0.00 88 R 7.71 3.88 0.00 1.38 1.91 0.00 3.19 0.00 0.00 3.31 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.32 0.00 89 T 7.90 4.04 4.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 90 V 7.94 3.63 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 150 S 7.88 4.11 0.00 4.02 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 0.00 151 S 7.65 4.00 0.00 3.98 3.72 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 0.00 152 L 7.59 4.04 0.00 1.53 1.80 0.93 0.78 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 0.00 153 L 7.91 4.07 0.00 1.82 1.72 0.96 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 154 F 8.34 4.17 0.00 3.13 3.15 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 0.00 155 A 8.39 4.23 1.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.06 4.13 1.10 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 0.00 0.00 158 L 7.61 4.14 0.00 1.84 1.69 1.25 0.52 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 0.00 159 V 7.63 3.48 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 0.91 0.00 0.00 1.01 0.00 0.00 160 A 7.73 3.38 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 161 N 8.05 4.31 0.00 2.88 3.11 0.00 0.00 6.70 8.28 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 0.00 162 K 7.92 3.83 0.00 1.77 1.87 0.00 1.58 0.00 0.00 1.57 0.00 0.00 3.07 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.36 1.44 7.81 163 R 8.04 3.98 0.00 1.30 1.79 0.00 2.21 0.00 0.00 2.25 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.40 0.00 164 R 7.45 4.55 0.00 2.08 2.03 0.00 3.59 0.00 0.00 3.43 7.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.13 0.00 165 N 7.97 4.20 0.00 2.89 2.91 0.00 0.00 6.66 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 166 V 7.83 4.37 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 0.84 0.00 0.00 0.99 0.00 0.00 167 S 8.43 4.47 0.00 3.91 3.78 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 0.00 0.00 0.00 0.00 168 E 8.52 4.23 0.00 2.03 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 0.00 2.40 2.29 0.00 169 K 8.47 4.67 0.00 1.72 1.76 0.00 1.65 0.00 0.00 1.84 0.00 0.00 2.83 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.50 1.43 7.81 170 I 8.42 5.04 1.92 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.93 1.04 0.00 0.00 171 Y 9.01 4.53 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 0.00 172 D 8.34 4.80 0.00 2.66 2.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173 I 8.72 4.08 1.60 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.49 0.67 0.00 0.00 174 G 8.96 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 0.00 0.00 0.00 175 K 7.55 4.71 0.00 1.64 1.57 0.00 1.55 0.00 0.00 1.80 0.00 0.00 2.89 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.31 1.22 7.81 176 F 7.92 5.45 0.00 3.26 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177 W 9.64 4.51 0.00 3.30 3.28 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 * Residues marked with a * may have inaccurate shift predictions.