NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 D 4.5505 8.3649 120.5300 54.2229 41.5499 173.7246 2 E 4.2306 7.5375 121.0771 53.6147 32.2808 174.3216 3 A 4.5315 8.4941 122.2070 52.0715 21.5938 175.8785 4 I 4.0403 8.3333 124.1786 61.8200 37.6609 175.6749 5 H 5.0310 8.3750 121.7395 53.4134 32.0363 174.4160 6 C 4.4117 8.6803 118.6896 56.3550 40.6200 172.4563 7 P 4.5207 0.0000 0.0000 61.9694 31.4513 174.5195 8 P 4.4096 0.0000 0.0000 62.6883 31.9803 176.8843 9 C 4.4613 8.6278 118.9563 56.9950 41.6783 173.9829 10 S 4.9199 8.4267 121.1670 57.4197 66.1619 175.7618 *11 E 4.0515 8.7450 124.8895 61.9972 29.2264 180.8825 12 E 4.2373 8.2473 120.2491 61.5533 30.1239 181.4630 13 K 4.3358 8.1223 124.8973 59.6952 31.9445 180.9099 14 L 4.1866 8.0091 120.3473 57.6282 41.3489 179.6375 15 A 4.1537 7.9290 121.6081 55.4686 18.2835 180.1429 *16 R 4.0613 7.8468 118.8193 60.1816 29.8888 181.6215 17 C 4.1166 7.2759 114.6228 57.7627 40.7245 173.3534 18 R 4.3838 8.3676 124.1211 53.9581 30.3798 173.9955 19 P 4.2716 0.0000 0.0000 62.0823 31.6014 174.6098 20 P 4.4630 0.0000 0.0000 62.3629 32.1394 175.8455 21 V 4.1156 8.2226 119.8970 61.4572 32.6992 175.9337 22 G 3.7952 8.7246 112.3634 46.8385 0.0000 173.5493 23 C 4.7815 8.0619 116.1892 55.1760 41.8913 174.1685 24 E 4.1311 8.8962 124.4547 58.7600 29.2000 176.8602 25 E 4.8305 7.7561 114.9148 54.4458 33.4080 174.3351 26 L 4.8817 8.4825 120.8630 53.9076 43.6804 176.0503 27 V 4.6022 8.1906 114.4340 59.2967 36.3977 174.9141 28 R 4.6348 8.4590 121.8163 55.8191 30.6907 175.7820 29 E 4.2185 9.1993 122.8564 55.7316 30.5864 175.3236 30 P 4.3293 0.0000 0.0000 64.0504 33.0345 177.1318 31 G 3.9897 8.1765 109.6877 47.6865 0.0000 175.1451 32 C 4.7665 8.9038 122.2948 56.0799 40.3540 173.7413 33 G 3.9643 7.4113 108.4760 45.7668 0.0000 173.4182 34 C 4.5600 8.6209 119.0082 57.7764 37.8676 174.5871 35 C 4.7324 8.0006 116.5404 55.9361 42.6176 172.0132 36 A 5.4204 8.5072 119.8988 51.0746 22.0932 175.4503 37 T 4.7484 8.2717 108.3312 59.8704 72.9593 172.4793 38 C 4.9204 8.7491 118.0094 56.9329 41.0634 173.5800 39 A 4.6456 8.1522 123.4218 51.1673 19.2582 177.7173 40 L 4.0376 9.0450 123.1566 55.0608 42.8608 177.6839 41 G 3.9406 8.2762 111.4580 43.5131 0.0000 171.9221 42 L 4.0331 8.2629 121.3832 56.6259 42.1375 177.8242 43 G 3.9910 8.9592 114.8216 45.3445 0.0000 173.1124 44 M 4.4210 7.4863 118.7300 53.8513 33.5355 174.1971 45 P 4.9698 0.0000 0.0000 63.6359 32.1673 174.3923 46 C 4.8086 8.8540 117.8009 54.6289 45.2864 173.4912 47 G 3.5554 8.0355 104.8203 46.1383 0.0000 173.8882 48 V 3.3821 8.5113 119.1475 65.3543 31.4325 177.5750 49 Y 4.6866 7.5942 113.8064 57.6827 38.5305 175.4364 50 T 4.3857 7.3136 110.0507 59.6465 70.2451 172.5454 51 P 4.4603 0.0000 0.0000 62.4968 31.9906 176.6783 52 R 4.2910 8.2064 118.6309 56.1405 31.3493 177.1350 53 C 4.8850 8.7410 119.2833 56.7396 35.6600 173.7570 54 G 4.0996 9.3024 109.7958 45.2466 0.0000 173.2889 55 S 4.3731 8.3993 115.4009 59.3478 63.2698 174.8225 56 G 3.9544 8.8176 108.5704 46.0141 0.0000 173.2036 57 L 5.0257 7.7131 118.0558 52.6399 45.2207 175.9321 58 R 4.6812 8.7025 123.1874 54.3476 33.1686 173.8644 59 C 4.9503 8.7889 126.0979 56.8136 44.2873 171.9544 60 Y 4.8553 8.9603 127.0592 55.1727 42.4456 172.2184 61 P 4.5425 0.0000 0.0000 61.7257 31.4178 173.8612 62 P 4.1025 0.0000 0.0000 66.0055 31.7283 178.3134 *64 G 3.9028 7.6797 106.9636 45.6505 0.0000 173.5318 65 V 3.7719 7.3446 115.6848 61.1568 32.2272 177.4005 66 E 4.1800 8.7376 118.5165 58.3588 30.1660 178.3587 67 K 4.6047 7.5224 118.5168 52.7135 32.9617 174.5853 68 P 4.1717 0.0000 0.0000 65.3148 31.5309 177.8459 69 L 3.8893 7.7221 117.2097 58.2022 41.7276 179.1198 *70 H 4.1281 8.0393 115.4653 58.3525 28.5070 177.6774 71 T 3.9815 7.7735 111.8611 64.4739 68.6941 176.8899 72 L 3.9287 7.8731 121.9876 57.7020 41.3534 179.2402 73 M 4.1094 7.8774 118.2008 58.2125 31.9209 177.4673 74 H 4.9629 7.8039 113.6062 55.1306 29.0519 175.8871 75 G 3.9321 7.9263 107.5658 46.5983 0.0000 174.0462 76 Q 4.4925 8.3663 116.7134 55.6195 29.5057 176.1624 77 G 4.1468 8.4336 109.5792 45.3403 0.0000 173.2710 78 V 5.1477 8.6041 118.4710 59.5948 35.1816 174.6360 79 C 4.9092 8.9032 120.7917 57.7534 42.2571 172.4992 80 M 5.1511 8.9676 124.3235 53.0465 34.5930 176.0712 81 E 4.5049 8.6437 121.2876 56.0981 30.6724 177.9511 82 L 3.8691 8.5107 122.3716 58.2473 42.0800 179.2289 83 A 3.9452 7.9022 120.3738 55.0581 18.2944 179.1048 84 E 3.8244 7.9904 117.3214 59.2688 29.7620 178.7340 85 I 3.1243 7.1918 119.4656 64.2937 37.1476 177.9241 86 E 3.9650 8.1434 119.7121 59.1768 29.1830 178.5957 87 A 3.9730 7.6604 119.7786 55.2034 18.6514 179.4691 88 I 3.8217 7.8284 118.4136 64.6653 36.9232 178.7894 89 Q 4.0991 8.3602 118.7506 59.2524 28.1627 177.8620 90 E 4.1685 8.1733 118.8458 57.6399 29.6387 177.9112 91 S 4.6097 8.1194 113.4703 58.3034 64.0117 174.0310 92 L 4.2627 7.5187 127.1904 55.0054 41.5627 176.1611 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 1 D 8.36 4.55 0.00 2.68 2.71 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 0.00 0.00 0.00 0.00 2 E 7.54 4.23 0.00 2.03 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 2.23 2.32 0.00 3 A 8.49 4.53 1.23 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 0.00 0.00 0.00 4 I 8.33 4.04 1.84 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.84 0.90 0.00 0.00 5 H 8.37 5.03 0.00 3.11 3.16 0.00 5.72 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 C 8.68 4.41 0.00 2.98 3.05 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 0.00 0.00 0.00 7 P 0.00 4.52 0.00 2.18 2.07 0.00 3.78 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.97 0.00 8 P 0.00 4.41 0.00 2.20 2.09 0.00 3.77 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.98 0.00 9 C 8.63 4.46 0.00 2.99 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 10 S 8.43 4.92 0.00 4.04 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 *11 E 8.74 4.05 0.00 1.99 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 2.32 1.95 0.00 12 E 8.25 4.24 0.00 2.06 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 2.23 1.95 0.00 13 K 8.12 4.34 0.00 1.76 1.85 0.00 1.79 0.00 0.00 1.65 0.00 0.00 2.89 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.37 1.36 7.81 14 L 8.01 4.19 0.00 1.79 1.75 0.96 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 15 A 7.93 4.15 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 *16 R 7.85 4.06 0.00 1.94 1.86 0.00 3.31 0.00 0.00 3.22 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.54 0.00 17 C 7.28 4.12 0.00 3.14 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 18 R 8.37 4.38 0.00 1.76 1.84 0.00 3.25 0.00 0.00 3.23 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.64 0.00 19 P 0.00 4.27 0.00 2.08 2.00 0.00 3.73 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.08 0.00 20 P 0.00 4.46 0.00 2.18 2.05 0.00 3.75 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.00 0.00 21 V 8.22 4.12 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 0.74 0.00 0.00 0.93 0.00 0.00 22 G 8.72 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 C 8.06 4.78 0.00 2.97 3.16 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 24 E 8.90 4.13 0.00 1.96 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 2.30 0.00 25 E 7.76 4.83 0.00 1.98 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 2.25 2.31 0.00 26 L 8.48 4.88 0.00 1.55 1.63 0.92 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 27 V 8.19 4.60 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 0.92 0.00 0.00 0.96 0.00 0.00 28 R 8.46 4.63 0.00 1.83 1.82 0.00 3.35 0.00 0.00 3.23 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.79 0.00 29 E 9.20 4.22 0.00 1.83 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 2.35 2.34 0.00 30 P 0.00 4.33 0.00 2.24 2.10 0.00 3.73 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.27 0.00 31 G 8.18 3.99 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 0.00 0.00 0.00 0.00 0.00 0.00 32 C 8.90 4.77 0.00 2.98 3.11 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 0.00 0.00 0.00 0.00 33 G 7.41 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 0.00 0.00 0.00 34 C 8.62 4.56 0.00 2.97 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 35 C 8.00 4.73 0.00 3.21 3.05 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 0.00 0.00 0.00 36 A 8.51 5.42 1.21 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 0.00 0.00 37 T 8.27 4.75 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 38 C 8.75 4.92 0.00 2.89 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 39 A 8.15 4.65 1.26 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 0.00 0.00 0.00 40 L 9.05 4.04 0.00 1.61 1.61 0.99 0.80 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 41 G 8.28 3.94 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 0.00 0.00 0.00 0.00 0.00 0.00 42 L 8.26 4.03 0.00 1.88 1.61 0.92 1.04 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 43 G 8.96 3.99 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 0.00 0.00 0.00 0.00 0.00 0.00 44 M 7.49 4.42 0.00 2.04 2.11 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.53 0.00 45 P 0.00 4.97 0.00 1.94 2.02 0.00 3.69 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.11 0.00 46 C 8.85 4.81 0.00 2.93 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 47 G 8.04 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.51 3.38 1.45 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 -0.12 0.00 0.00 0.72 0.00 0.00 49 Y 7.59 4.69 0.00 3.00 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 50 T 7.31 4.39 4.27 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 0.00 0.00 0.00 1.28 0.00 0.00 51 P 0.00 4.46 0.00 2.07 2.04 0.00 3.69 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.13 0.00 52 R 8.21 4.29 0.00 1.77 1.84 0.00 3.19 0.00 0.00 3.34 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.66 0.00 53 C 8.74 4.88 0.00 2.98 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 G 9.30 4.10 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 0.00 55 S 8.40 4.37 0.00 3.94 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 56 G 8.82 3.95 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 0.00 0.00 0.00 0.00 0.00 0.00 57 L 7.71 5.03 0.00 1.63 1.54 0.94 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 58 R 8.70 4.68 0.00 1.87 1.75 0.00 3.13 0.00 0.00 3.15 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.58 0.00 59 C 8.79 4.95 0.00 3.04 2.99 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 0.00 0.00 0.00 60 Y 8.96 4.86 0.00 3.09 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 61 P 0.00 4.54 0.00 2.08 1.88 0.00 2.20 0.00 0.00 3.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.61 0.00 62 P 0.00 4.10 0.00 2.22 2.11 0.00 3.62 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.13 0.00 *64 G 7.68 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 0.00 0.00 0.00 65 V 7.34 3.77 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 0.65 0.00 0.00 0.90 0.00 0.00 66 E 8.74 4.18 0.00 1.99 1.87 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 2.23 1.90 0.00 67 K 7.52 4.60 0.00 1.73 1.68 0.00 1.64 0.00 0.00 1.82 0.00 0.00 2.88 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.40 1.41 7.81 68 P 0.00 4.17 0.00 2.03 1.95 0.00 3.55 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.13 0.00 69 L 7.72 3.89 0.00 1.63 1.66 0.89 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 *70 H 8.04 4.13 0.00 2.86 2.97 0.00 5.61 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 T 7.77 3.98 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 1.26 0.00 0.00 72 L 7.87 3.93 0.00 1.80 1.65 0.74 0.92 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 73 M 7.88 4.11 0.00 2.07 2.12 0.00 0.00 0.00 0.00 0.00 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.88 0.00 74 H 7.80 4.96 0.00 3.15 3.31 0.00 5.77 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 G 7.93 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 0.00 0.00 0.00 76 Q 8.37 4.49 0.00 2.33 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.79 0.00 0.00 0.00 0.00 0.00 2.33 2.17 0.00 77 G 8.43 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 0.00 0.00 0.00 78 V 8.60 5.15 2.10 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 0.82 0.00 0.00 0.92 0.00 0.00 79 C 8.90 4.91 0.00 3.08 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 80 M 8.97 5.15 0.00 1.98 1.93 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.78 2.51 0.00 81 E 8.64 4.50 0.00 2.10 1.85 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 2.40 1.87 0.00 82 L 8.51 3.87 0.00 1.72 1.62 0.88 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 83 A 7.90 3.95 1.29 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 84 E 7.99 3.82 0.00 2.01 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 2.33 2.37 0.00 85 I 7.19 3.12 1.74 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 0.37 0.17 0.00 0.00 86 E 8.14 3.97 0.00 1.96 2.03 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 2.27 2.29 0.00 87 A 7.66 3.97 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 88 I 7.83 3.82 1.96 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.85 1.06 0.00 0.00 89 Q 8.36 4.10 0.00 2.29 2.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.85 0.00 0.00 0.00 0.00 0.00 2.58 2.38 0.00 90 E 8.17 4.17 0.00 2.09 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 2.34 2.39 0.00 91 S 8.12 4.61 0.00 3.99 4.12 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 92 L 7.52 4.26 0.00 1.69 1.63 0.99 0.73 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 * Residues marked with a * may have inaccurate shift predictions.