NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 P 4.3623 0.0000 0.0000 62.5616 33.7617 174.1042 3 R 4.6283 7.8556 118.1782 54.9399 31.8731 174.1652 4 Y 5.0275 8.5260 119.4740 56.1456 43.4872 173.5955 5 Q 5.2421 9.2076 123.0186 54.3645 32.0114 173.8648 6 A 5.2879 9.5808 128.5937 50.5638 22.1514 175.0953 7 T 5.0292 9.1514 120.1677 62.2210 70.3626 173.6589 8 L 5.2450 9.0583 127.5692 52.8208 44.9514 175.6876 9 L 5.0867 8.9589 123.4400 53.2081 44.1855 175.5416 10 I 4.9326 9.1188 126.2306 59.8988 39.0457 174.7141 11 E 5.0661 8.8873 126.4891 53.7903 33.4195 176.0953 12 L 4.3211 8.3950 121.4482 54.4100 42.6459 177.5518 13 K 4.1302 8.4374 123.5468 55.8590 32.9335 176.2999 14 K 4.1625 8.3132 123.7769 58.0840 32.5207 176.4658 15 G 4.1033 8.8952 110.2869 45.7194 0.0000 174.3270 16 I 3.9313 7.0767 119.4246 60.5805 37.6734 176.0448 17 L 4.1523 8.3519 124.3814 55.2331 42.3556 177.0695 18 D 4.7944 8.1859 120.6603 50.6717 41.4576 173.7247 19 P 4.2657 0.0000 0.0000 65.2390 31.6897 177.6612 20 Q 4.0944 8.1456 116.3020 58.9224 28.6963 178.8916 21 G 3.8023 8.8528 108.2148 47.3678 0.0000 175.7199 22 R 4.0913 8.1407 120.5867 58.9039 30.1000 179.0033 23 A 4.0024 8.1262 120.4558 55.1773 18.3167 179.8797 24 V 3.5373 7.9947 116.7926 66.0857 31.6665 177.9312 25 E 4.0668 8.4075 118.5623 59.4893 29.3148 179.7522 26 G 3.5572 7.9628 105.0620 47.7630 0.0000 175.9595 27 V 3.7650 7.7329 120.9534 65.7003 31.4777 177.9358 28 L 4.0001 8.2929 119.1477 57.6871 41.3811 179.4749 29 K 3.9092 7.9985 119.2170 59.7953 32.0018 178.6527 30 D 4.3979 7.9834 117.5241 56.8923 40.7390 177.8263 31 L 4.4840 7.7648 117.2831 54.2369 41.7935 177.1910 32 G 3.8583 8.2486 107.1113 46.4440 0.0000 174.4183 33 H 4.9201 8.1901 113.3861 53.1000 29.1601 172.2078 34 P 4.3603 0.0000 0.0000 63.0861 32.1135 176.6056 35 V 4.5605 7.8847 112.9028 59.5485 35.7381 175.2588 36 E 4.1648 8.7414 121.0026 58.7580 29.8269 176.0135 37 E 4.9265 7.4942 115.2604 55.1309 32.4366 174.0045 38 V 4.3663 9.0294 123.6568 61.0073 34.2023 174.5084 39 R 4.7604 8.6237 125.7036 54.3775 32.0066 175.1110 40 V 4.1657 9.0832 124.2541 61.4307 32.6345 175.2191 41 G 4.2528 8.3066 115.3860 44.0249 0.0000 170.7564 42 K 4.8219 8.8315 118.0818 54.3707 35.5209 175.8767 43 V 4.9006 8.4485 123.1920 59.8750 33.7284 174.6934 44 L 4.7551 9.1516 125.0529 52.8440 44.6938 175.2041 45 E 5.0289 8.9205 123.4721 55.0675 30.9390 175.2517 46 I 4.5200 9.0834 126.8600 59.4238 39.7912 174.9654 47 V 4.9924 8.4745 127.4377 61.3778 32.9746 174.6325 48 F 5.1086 8.7817 121.7236 55.2615 41.5197 171.4530 49 P 5.2414 0.0000 0.0000 62.7340 32.5129 174.9968 50 A 4.6519 8.3983 121.4132 51.1100 21.8633 176.4969 51 E 4.0572 10.3100 123.0833 58.9437 30.1589 176.8719 52 N 5.0022 7.5516 115.9190 51.1803 41.2439 174.7822 53 L 3.5286 8.4563 121.5785 58.3413 42.0057 178.8280 54 L 3.9662 7.8212 118.3090 57.7287 41.5660 178.9548 55 E 3.9248 8.8701 119.5493 58.9225 29.5295 178.6888 56 A 4.0373 7.7891 121.0217 55.1165 18.3599 179.1431 57 E 3.9202 8.1423 117.8215 59.2880 29.6584 178.6018 58 E 3.8779 8.1270 119.2420 59.4675 29.5687 179.0830 59 K 3.9257 8.2587 117.1594 59.1043 32.1034 179.0078 60 A 3.7815 8.1796 120.8342 55.1215 18.6872 179.5913 61 K 3.9841 8.0138 116.7524 59.1850 32.0174 179.8311 62 A 4.0572 7.7387 117.9464 52.8133 18.0272 179.2670 *64 G 2.9816 8.0962 111.4122 46.6391 0.0000 176.0136 65 A 4.0508 7.3477 122.0146 54.8237 18.6929 178.8828 66 L 4.1095 7.6659 115.3373 57.9196 41.8138 178.7634 67 L 4.0655 7.7022 116.7107 57.0724 41.9872 177.6698 68 A 4.1972 7.7201 121.1842 51.5417 18.6807 176.5763 69 N 4.4465 9.6045 121.8497 52.6451 38.8270 173.8243 70 P 4.0121 0.0000 0.0000 65.6997 31.1061 177.1172 71 V 3.9210 7.1464 115.6410 63.0685 31.3646 174.6155 *73 E 4.4703 7.7361 116.9398 56.8811 30.8519 174.9287 74 V 4.7915 8.8757 113.2966 59.9409 36.2533 174.4404 75 Y 5.5163 8.3107 118.9661 55.4515 41.3251 174.4654 76 A 4.4526 9.0116 121.2196 50.3006 23.1659 175.2025 77 L 4.8129 8.7618 124.3579 54.0769 42.0432 175.7630 78 E 4.5688 8.7516 124.2484 56.5829 30.7660 176.0499 79 A 4.5755 7.6888 119.7149 51.4258 22.5631 175.0613 80 L 5.2286 8.5105 122.4924 53.8822 45.2572 174.7086 81 K 4.7967 8.8986 123.9341 55.4922 36.3258 174.9058 82 E 4.1797 8.8328 122.6567 56.0713 30.5132 175.4643 83 L 4.6956 8.2419 125.2576 51.7693 45.0203 175.0282 84 P 4.3211 0.0000 0.0000 63.0857 31.2509 176.7256 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 2 P 0.00 4.36 0.00 1.64 1.95 0.00 3.88 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.10 0.00 3 R 7.86 4.63 0.00 1.62 1.65 0.00 3.01 0.00 0.00 3.28 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.61 0.00 4 Y 8.53 5.03 0.00 2.06 2.56 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 5 Q 9.21 5.24 0.00 2.10 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.77 0.00 0.00 0.00 0.00 0.00 2.30 2.33 0.00 6 A 9.58 5.29 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 9.15 5.03 4.38 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 1.41 0.00 0.00 8 L 9.06 5.25 0.00 1.54 1.58 0.78 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 9 L 8.96 5.09 0.00 1.60 1.60 0.94 1.03 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 10 I 9.12 4.93 1.90 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 1.31 0.80 1.08 0.00 0.00 11 E 8.89 5.07 0.00 1.89 1.81 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 2.22 2.26 0.00 12 L 8.40 4.32 0.00 1.64 1.61 1.01 0.88 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 13 K 8.44 4.13 0.00 1.79 1.67 0.00 1.72 0.00 0.00 1.82 0.00 0.00 2.93 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.50 1.46 7.81 14 K 8.31 4.16 0.00 1.76 1.73 0.00 1.64 0.00 0.00 1.70 0.00 0.00 3.06 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.44 1.50 7.81 15 G 8.90 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 16 I 7.08 3.93 1.96 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.85 0.91 0.00 0.00 17 L 8.35 4.15 0.00 1.63 1.60 0.92 0.95 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 18 D 8.19 4.79 0.00 2.61 2.48 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 0.00 19 P 0.00 4.27 0.00 2.19 2.09 0.00 3.66 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 2.12 2.19 0.00 20 Q 8.15 4.09 0.00 2.25 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.87 0.00 0.00 0.00 0.00 0.00 2.45 2.44 0.00 21 G 8.85 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 22 R 8.14 4.09 0.00 2.06 2.00 0.00 3.28 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.70 0.00 23 A 8.13 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 24 V 7.99 3.54 2.22 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 1.10 0.00 0.00 1.00 0.00 0.00 25 E 8.41 4.07 0.00 2.26 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 2.34 2.45 0.00 26 G 7.96 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 27 V 7.73 3.77 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 1.03 0.00 0.00 0.93 0.00 0.00 28 L 8.29 4.00 0.00 1.93 1.97 0.92 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 29 K 8.00 3.91 0.00 1.95 2.03 0.00 1.64 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.44 1.49 7.81 30 D 7.98 4.40 0.00 2.85 2.73 0.00 0.00 0.00 0.00 0.00 0.00 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 7.76 4.48 0.00 1.83 1.75 0.93 0.83 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 G 8.25 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 33 H 8.19 4.92 0.00 3.17 3.21 0.00 5.86 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 34 P 0.00 4.36 0.00 2.18 2.06 0.00 3.78 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.99 0.00 35 V 7.88 4.56 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 0.82 0.00 0.00 0.94 0.00 0.00 36 E 8.74 4.16 0.00 1.93 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 2.27 2.29 0.00 37 E 7.49 4.93 0.00 1.92 1.75 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 2.19 2.27 0.00 38 V 9.03 4.37 2.26 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 0.95 0.00 0.00 0.93 0.00 0.00 39 R 8.62 4.76 0.00 1.80 1.81 0.00 3.25 0.00 0.00 3.29 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.57 0.00 40 V 9.08 4.17 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 0.76 0.00 0.00 0.95 0.00 0.00 41 G 8.31 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 42 K 8.83 4.82 0.00 1.66 1.68 0.00 1.62 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.34 1.35 7.81 43 V 8.45 4.90 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 0.75 0.00 0.00 0.95 0.00 0.00 44 L 9.15 4.76 0.00 1.58 1.58 0.92 0.71 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 45 E 8.92 5.03 0.00 1.86 1.93 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 2.25 2.28 0.00 46 I 9.08 4.52 1.93 0.00 0.00 0.77 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 0.90 0.96 0.00 0.00 47 V 8.47 4.99 2.13 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 0.81 0.00 0.00 0.97 0.00 0.00 48 F 8.78 5.11 0.00 3.23 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 49 P 0.00 5.24 0.00 2.15 2.11 0.00 4.03 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.04 0.00 50 A 8.40 4.65 1.07 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 0.00 0.00 0.00 0.00 0.00 0.00 51 E 10.31 4.06 0.00 1.91 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 0.00 2.35 2.27 0.00 52 N 7.55 5.00 0.00 3.00 2.90 0.00 0.00 6.36 6.67 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 53 L 8.46 3.53 0.00 1.75 1.70 0.89 0.73 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 54 L 7.82 3.97 0.00 1.86 1.68 0.92 0.83 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 55 E 8.87 3.92 0.00 2.09 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 0.00 2.32 2.32 0.00 56 A 7.79 4.04 0.56 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 57 E 8.14 3.92 0.00 2.05 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 0.00 2.32 2.35 0.00 58 E 8.13 3.88 0.00 2.17 2.13 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 2.30 2.35 0.00 59 K 8.26 3.93 0.00 1.84 1.73 0.00 1.83 0.00 0.00 1.96 0.00 0.00 3.42 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.49 1.58 7.81 60 A 8.18 3.78 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 61 K 8.01 3.98 0.00 2.01 2.03 0.00 1.73 0.00 0.00 1.76 0.00 0.00 3.03 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.69 1.68 7.81 62 A 7.74 4.06 1.28 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 0.00 0.00 *64 G 8.10 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 0.00 0.00 0.00 65 A 7.35 4.05 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.67 4.11 0.00 1.64 1.66 0.85 1.01 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 67 L 7.70 4.07 0.00 1.55 1.67 0.83 0.72 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 68 A 7.72 4.20 1.41 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 69 N 9.60 4.45 0.00 2.78 2.78 0.00 0.00 6.77 7.67 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 70 P 0.00 4.01 0.00 2.22 2.21 0.00 3.81 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 1.98 0.00 71 V 7.15 3.92 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 0.80 0.00 0.00 0.93 0.00 0.00 *73 E 7.74 4.47 0.00 2.12 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 2.23 2.37 0.00 74 V 8.88 4.79 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 0.72 0.00 0.00 0.99 0.00 0.00 75 Y 8.31 5.52 0.00 2.87 2.89 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 76 A 9.01 4.45 1.18 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 0.00 0.00 77 L 8.76 4.81 0.00 1.85 1.73 1.05 1.00 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 78 E 8.75 4.57 0.00 2.04 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 0.00 2.27 2.50 0.00 79 A 7.69 4.58 1.25 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 80 L 8.51 5.23 0.00 1.67 1.56 1.12 0.55 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 81 K 8.90 4.80 0.00 1.89 1.87 0.00 1.36 0.00 0.00 1.59 0.00 0.00 2.80 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.36 1.40 7.81 82 E 8.83 4.18 0.00 1.99 1.79 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 1.91 1.52 0.00 83 L 8.24 4.70 0.00 1.34 1.46 0.87 0.90 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 84 P 0.00 4.32 0.00 1.99 1.92 0.00 3.65 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.03 0.00 * Residues marked with a * may have inaccurate shift predictions.