NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 7 E 4.2938 8.4029 116.7522 56.0104 31.5631 176.5489 *8 H 4.3790 8.4009 116.0035 57.5390 28.0119 175.7469 9 I 3.8204 7.5006 121.3473 64.8280 38.1680 177.3520 10 K 3.8542 7.9328 120.0711 59.6763 32.0674 178.4597 11 Q 3.9450 7.9834 119.2199 59.0318 29.0116 177.8761 12 Q 3.8804 8.1883 119.0698 58.8026 28.7346 178.7398 13 A 3.4446 7.8673 121.5025 54.9860 18.3494 179.5013 14 L 3.8655 7.6428 117.3870 58.2340 41.7148 179.6485 15 D 4.3150 8.2687 118.9107 57.2830 40.7047 178.9167 16 L 3.9902 7.6682 119.4877 57.6721 41.6073 179.5430 17 F 4.5787 7.9803 118.1089 60.9776 38.9232 177.9135 18 T 4.0372 8.3475 109.6661 64.6018 68.6037 176.6977 19 R 3.9428 8.2232 121.6593 59.2349 30.0997 178.2874 20 L 4.0075 8.1695 120.1481 58.2317 41.8610 178.7834 21 Q 4.0241 8.0897 117.0966 58.9276 29.0815 178.4921 22 F 4.3558 8.3765 121.4550 61.3967 39.5127 177.1339 23 L 3.6910 8.0166 118.5356 57.7109 41.2518 179.3312 24 L 4.1384 7.9026 116.9681 56.5427 41.5468 177.7223 25 Q 4.3116 7.3236 116.5614 55.8425 28.7926 176.1311 26 K 4.1467 7.4781 116.7914 56.5027 31.5676 176.4066 27 H 4.6332 7.4245 117.5217 54.5933 29.8622 175.9369 28 D 4.5603 8.6379 120.1416 56.9170 40.7762 176.5667 29 T 4.8272 7.3727 104.1730 59.9741 72.0805 173.1475 30 I 4.6189 8.1184 119.1888 60.9273 40.6582 176.7112 31 E 3.9597 8.6173 120.9848 59.0689 29.0454 176.8750 32 P 4.2172 0.0000 0.0000 64.9048 31.5469 176.6822 33 Y 4.5830 7.8624 115.6182 58.0550 38.4940 177.0858 34 Q 4.0252 7.9429 121.5840 59.3308 29.0919 177.5448 35 Y 3.9341 8.0429 120.0182 60.8049 38.9332 178.0827 36 V 3.7784 8.0508 118.6803 66.0717 31.6322 177.8203 37 L 4.0865 8.2829 118.9864 57.7392 41.3508 179.1699 38 D 4.2976 8.3473 119.2004 57.3863 40.6756 178.7445 39 I 3.6380 7.9061 120.3117 64.4913 37.0235 178.5391 40 L 3.7212 7.9051 119.7473 57.5862 41.3754 179.1419 41 E 3.9189 8.3579 119.4557 59.5590 29.4741 179.0901 42 T 3.9547 8.2063 116.1918 66.4463 68.5181 177.0179 43 G 3.3350 8.1085 107.8514 47.6850 0.0000 175.8473 44 I 3.9298 7.9537 122.5262 64.1766 37.1136 178.4735 45 S 4.0640 8.2559 114.0493 61.4030 62.2131 176.3231 46 K 4.0197 8.3904 121.5194 59.8051 31.7683 179.5765 47 T 3.9524 8.1625 115.9658 66.6162 68.2164 177.0000 48 K 4.0119 8.3355 119.6547 59.5600 32.0705 178.0830 49 H 4.7107 8.1155 113.8943 54.6611 29.1829 174.9325 50 N 4.2049 8.0002 116.8156 54.3056 36.5783 174.4733 51 Q 4.4506 8.2611 115.7228 56.2773 31.2266 176.4986 52 Q 3.2653 8.4005 121.1415 57.2804 28.2219 176.8068 53 T 4.7877 8.1287 115.9072 59.5258 72.9709 172.1324 54 P 4.3104 0.0000 0.0000 65.7971 31.3676 178.8662 55 E 3.9712 8.1451 117.0518 59.4067 29.4450 179.2207 56 R 3.9412 8.1521 118.7326 59.5814 30.1420 178.6462 57 Q 4.0910 8.4730 117.7771 58.8143 28.5863 178.5693 58 A 4.4283 8.5390 122.2928 55.0490 18.3269 179.6450 59 R 3.9007 8.1595 117.3383 59.6384 30.1361 178.9048 60 V 3.6054 7.8755 118.0064 65.9547 31.4999 178.0592 61 V 3.4897 7.9555 117.9638 66.0943 31.2732 177.2501 62 Y 3.9859 8.3364 119.3364 60.9237 38.7262 177.8005 63 N 4.3309 8.6392 117.6055 56.4038 38.6080 177.6424 64 K 4.0449 8.4268 120.1624 59.4146 32.0142 179.6100 65 I 3.7287 7.9530 120.0565 64.1849 37.1842 178.2181 66 A 3.8739 7.9457 122.0048 55.0894 18.1355 179.6962 67 S 4.0472 8.0177 111.5415 61.6501 62.4633 176.2317 68 Q 3.7173 8.2189 122.1134 58.9223 28.7095 177.9581 69 A 3.3984 8.3140 122.1882 54.7188 18.1492 179.7556 70 L 3.8336 7.3176 116.4756 57.8935 41.6191 179.6287 71 V 3.4581 7.4316 117.0802 65.7396 31.4659 176.3727 72 D 4.4769 8.6243 117.1880 52.8294 41.3137 176.4506 73 K 3.6110 7.0614 119.5174 57.1556 30.7737 174.5114 74 L 3.9518 7.5071 118.2296 53.9126 43.0870 177.3241 75 H 4.5669 8.0247 119.3393 53.9160 29.5843 173.7650 76 F 5.0125 8.0688 123.1282 57.0067 39.9212 176.6521 77 T 4.4000 9.2727 114.7772 60.8600 71.1573 175.8008 78 A 4.0148 8.4644 122.4580 55.3299 18.3379 179.4458 79 E 3.9156 8.1304 117.2737 59.4439 29.7426 178.7683 80 E 3.9292 8.2286 118.6534 59.5722 29.4752 179.1150 81 N 4.3338 8.5844 116.8634 56.0014 38.5309 177.4387 82 K 3.9292 8.1888 121.2089 59.5303 32.3472 179.1329 83 V 3.6142 7.7726 118.4938 65.9282 31.4621 177.9432 84 L 4.1010 8.2283 118.7911 57.8548 41.3781 179.4003 85 A 3.9981 8.4551 120.7438 55.0341 18.2043 179.5686 86 A 3.9069 7.9615 119.4151 55.2636 18.4192 179.9979 87 I 3.6774 7.8908 118.4739 64.4653 36.9858 178.1231 88 N 3.9290 7.8736 116.8846 56.3543 38.8323 176.2354 89 E 3.9508 8.2588 120.8877 59.2440 29.9208 178.4216 90 L 3.8962 8.1126 120.3159 58.1430 41.9307 178.3349 91 A 4.4167 8.0498 118.1238 53.8613 18.4124 177.8448 92 H 4.7470 8.0793 115.7216 55.6527 30.2315 175.1743 93 S 4.4721 7.6593 121.8457 58.9296 64.3423 182.2956 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 7 E 8.40 4.29 0.00 1.91 1.91 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 2.21 1.88 0.00 *8 H 8.40 4.38 0.00 2.99 3.07 0.00 7.16 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 I 7.50 3.82 1.85 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.00 0.90 0.00 0.00 10 K 7.93 3.85 0.00 1.85 1.77 0.00 1.78 0.00 0.00 1.74 0.00 0.00 2.90 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.49 1.50 7.81 11 Q 7.98 3.95 0.00 2.17 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.67 0.00 0.00 0.00 0.00 0.00 2.40 2.67 0.00 12 Q 8.19 3.88 0.00 2.22 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.58 0.00 0.00 0.00 0.00 0.00 2.54 2.46 0.00 13 A 7.87 3.44 1.04 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 14 L 7.64 3.87 0.00 1.80 1.74 0.92 1.00 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 15 D 8.27 4.32 0.00 2.73 2.67 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 16 L 7.67 3.99 0.00 1.60 1.68 0.83 1.06 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 17 F 7.98 4.58 0.00 3.20 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 18 T 8.35 4.04 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 1.30 0.00 0.00 19 R 8.22 3.94 0.00 2.05 2.21 0.00 3.25 0.00 0.00 3.11 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.75 0.00 20 L 8.17 4.01 0.00 1.95 1.87 0.82 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 21 Q 8.09 4.02 0.00 2.34 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.72 0.00 0.00 0.00 0.00 0.00 2.45 2.58 0.00 22 F 8.38 4.36 0.00 3.14 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 23 L 8.02 3.69 0.00 1.86 1.63 0.95 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 24 L 7.90 4.14 0.00 1.58 1.64 0.99 1.04 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 25 Q 7.32 4.31 0.00 2.05 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.97 0.00 0.00 0.00 0.00 0.00 2.33 2.46 0.00 26 K 7.48 4.15 0.00 1.56 1.61 0.00 1.22 0.00 0.00 1.41 0.00 0.00 2.87 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.03 1.06 7.81 27 H 7.42 4.63 0.00 3.28 3.32 0.00 5.62 0.00 0.00 0.00 0.00 6.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 D 8.64 4.56 0.00 2.72 2.76 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 29 T 7.37 4.83 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 1.24 0.00 0.00 30 I 8.12 4.62 1.94 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.82 0.96 0.00 0.00 31 E 8.62 3.96 0.00 2.08 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 2.37 2.40 0.00 32 P 0.00 4.22 0.00 1.61 1.91 0.00 3.69 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.87 0.00 33 Y 7.86 4.58 0.00 3.19 3.09 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 34 Q 7.94 4.03 0.00 2.26 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.81 0.00 0.00 0.00 0.00 0.00 2.38 2.44 0.00 35 Y 8.04 3.93 0.00 3.06 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 36 V 8.05 3.78 2.45 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 1.13 0.00 0.00 1.10 0.00 0.00 37 L 8.28 4.09 0.00 1.96 1.74 0.99 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 38 D 8.35 4.30 0.00 2.70 2.55 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 39 I 7.91 3.64 2.10 0.00 0.00 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 1.62 0.88 0.88 0.00 0.00 40 L 7.91 3.72 0.00 1.89 1.77 0.95 0.82 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 41 E 8.36 3.92 0.00 2.19 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 0.00 2.30 2.39 0.00 42 T 8.21 3.95 4.31 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 1.18 0.00 0.00 43 G 8.11 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 0.00 0.00 0.00 44 I 7.95 3.93 2.07 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 1.67 0.77 0.97 0.00 0.00 45 S 8.26 4.06 0.00 3.96 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 K 8.39 4.02 0.00 2.03 1.88 0.00 1.79 0.00 0.00 1.83 0.00 0.00 2.93 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.48 1.59 7.81 47 T 8.16 3.95 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 1.27 0.00 0.00 48 K 8.34 4.01 0.00 1.78 1.78 0.00 1.68 0.00 0.00 1.67 0.00 0.00 3.02 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.47 1.68 7.81 49 H 8.12 4.71 0.00 3.23 3.30 0.00 5.81 0.00 0.00 0.00 0.00 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 N 8.00 4.20 0.00 2.87 2.88 0.00 0.00 6.87 7.31 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 51 Q 8.26 4.45 0.00 2.16 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.33 6.03 0.00 0.00 0.00 0.00 0.00 2.49 2.49 0.00 52 Q 8.40 3.27 0.00 2.20 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.81 0.00 0.00 0.00 0.00 0.00 2.29 2.34 0.00 53 T 8.13 4.79 4.40 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 1.22 0.00 0.00 54 P 0.00 4.31 0.00 2.17 2.13 0.00 3.61 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.19 0.00 55 E 8.15 3.97 0.00 2.06 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 2.40 2.43 0.00 56 R 8.15 3.94 0.00 1.96 2.12 0.00 3.17 0.00 0.00 3.19 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.75 0.00 57 Q 8.47 4.09 0.00 2.44 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.58 0.00 0.00 0.00 0.00 0.00 2.70 2.61 0.00 58 A 8.54 4.43 1.53 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 0.00 0.00 59 R 8.16 3.90 0.00 1.94 2.17 0.00 3.10 0.00 0.00 3.11 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.69 0.00 60 V 7.88 3.61 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 1.04 0.00 0.00 1.03 0.00 0.00 61 V 7.96 3.49 2.24 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 0.81 0.00 0.00 0.43 0.00 0.00 62 Y 8.34 3.99 0.00 3.25 3.17 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.64 4.33 0.00 2.91 2.90 0.00 0.00 7.13 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 64 K 8.43 4.04 0.00 1.89 1.93 0.00 1.68 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.51 1.61 7.81 65 I 7.95 3.73 1.84 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.87 0.87 0.00 0.00 66 A 7.95 3.87 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 S 8.02 4.05 0.00 3.94 3.97 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 0.00 0.00 0.00 68 Q 8.22 3.72 0.00 2.15 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.56 0.00 0.00 0.00 0.00 0.00 1.87 2.23 0.00 69 A 8.31 3.40 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 70 L 7.32 3.83 0.00 1.88 1.65 0.89 0.70 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 71 V 7.43 3.46 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 0.60 0.00 0.00 0.86 0.00 0.00 72 D 8.62 4.48 0.00 2.52 2.45 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 73 K 7.06 3.61 0.00 1.63 1.62 0.00 1.62 0.00 0.00 1.60 0.00 0.00 3.07 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.30 1.26 7.81 74 L 7.51 3.95 0.00 1.05 0.86 0.86 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 75 H 8.02 4.57 0.00 3.07 3.18 0.00 5.69 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 F 8.07 5.01 0.00 3.13 3.01 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 77 T 9.27 4.40 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 1.26 0.00 0.00 78 A 8.46 4.01 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 79 E 8.13 3.92 0.00 2.07 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 2.41 2.43 0.00 80 E 8.23 3.93 0.00 2.39 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 2.30 2.35 0.00 81 N 8.58 4.33 0.00 3.03 2.93 0.00 0.00 6.69 8.25 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 82 K 8.19 3.93 0.00 1.96 2.03 0.00 1.65 0.00 0.00 1.59 0.00 0.00 2.90 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.45 1.45 7.81 83 V 7.77 3.61 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 1.04 0.00 0.00 1.01 0.00 0.00 84 L 8.23 4.10 0.00 1.89 1.88 0.32 0.77 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 85 A 8.46 4.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 A 7.96 3.91 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.89 3.68 2.22 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.04 1.21 0.00 0.00 88 N 7.87 3.93 0.00 1.70 2.56 0.00 0.00 7.21 7.15 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 89 E 8.26 3.95 0.00 2.10 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 0.00 2.27 2.26 0.00 90 L 8.11 3.90 0.00 1.82 1.81 0.81 1.52 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 91 A 8.05 4.42 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 92 H 8.08 4.75 0.00 3.16 3.32 0.00 5.94 0.00 0.00 0.00 0.00 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 S 7.66 4.47 0.00 3.65 3.58 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 * Residues marked with a * may have inaccurate shift predictions.