NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -1 Q 4.3198 8.3331 119.6876 55.8541 29.8468 174.0379 0 G 4.0867 8.3080 110.9471 42.6475 0.0000 170.1030 1 M 3.9796 8.4972 119.2696 55.5086 33.4333 175.4472 2 S 4.5147 8.7769 116.8033 57.4227 64.3075 174.4733 3 D 4.4314 8.8489 119.1675 56.6031 38.7426 179.1020 4 A 3.7568 7.7996 121.5603 54.1939 18.3159 177.9570 5 F 4.7691 8.0756 112.8832 57.4526 39.5985 176.4811 6 T 4.1031 7.5894 116.2844 61.8662 68.9809 174.5385 7 D 4.4051 8.7262 125.9409 57.7867 40.9620 179.5308 8 V 3.5646 7.7872 117.8032 65.8156 31.6088 177.8135 9 A 3.9493 7.8806 120.1203 55.0697 18.2400 179.6746 10 K 3.9104 8.2317 117.1572 59.7485 32.1724 179.3724 11 M 4.0297 8.3031 118.7374 58.3044 32.1367 178.0585 12 K 3.8110 7.9428 119.7803 59.4407 32.3380 178.5645 13 K 3.8391 7.9868 119.7372 59.5422 32.0910 178.7781 14 I 3.7377 8.0222 120.2329 64.4192 37.0950 178.5764 15 K 3.6522 8.0053 119.2551 59.3039 31.7750 179.3212 16 E 3.8674 8.0164 118.8051 59.4732 29.5098 179.3244 17 E 3.6492 8.3995 119.0072 59.1290 29.1953 179.4908 18 I 3.5964 7.4263 118.9192 64.2163 37.4480 178.0264 19 K 3.9963 7.9903 120.2086 59.5318 31.7879 178.7058 20 A 4.0120 7.7275 119.9313 54.6121 18.5244 178.0163 21 H 4.5053 7.7130 114.8231 55.0011 30.0036 174.2968 22 E 4.0295 7.2367 120.5568 58.3718 29.7176 177.2798 23 G 3.8794 9.3176 115.0031 45.1359 0.0000 172.7716 24 Q 4.5061 7.7048 118.6261 54.0587 32.1565 174.5143 25 V 4.4829 8.0683 119.4104 62.6089 33.0872 175.0612 26 V 4.9225 8.9257 120.0825 59.5169 35.5560 173.9310 27 E 5.0543 8.8620 124.8843 55.1682 31.4503 174.7117 28 M 5.3109 9.2991 125.6763 53.8887 36.4996 174.0947 29 T 4.9047 8.6767 115.1128 60.1456 71.6919 172.3073 30 L 4.7596 8.2190 125.2604 52.7374 43.9167 177.0895 31 E 4.2666 8.7133 129.6567 55.8563 26.1281 177.4612 *38 K 4.1639 7.9235 118.4877 55.1957 34.4269 175.2079 39 N 4.6757 8.0777 114.4538 54.9758 39.2312 174.3702 40 R 4.9277 8.9365 119.2762 54.6274 35.3888 174.0823 41 L 5.2087 9.4913 122.4961 53.5700 44.1855 175.9145 42 G 4.0743 9.1292 109.0310 44.7609 0.0000 171.0711 43 K 4.8388 8.6091 119.9819 54.6694 34.3461 176.5004 44 L 4.5410 8.7755 128.4463 54.5547 40.5870 176.6497 45 I 4.2441 8.4869 118.5188 62.6186 38.8378 176.3539 46 E 4.6379 7.9553 120.6327 54.6510 34.1796 174.4022 47 V 4.6539 7.7663 121.7891 61.4960 34.6328 174.0251 48 Y 5.0923 9.0322 124.2639 55.2352 41.6876 174.7151 49 P 4.4467 0.0000 0.0000 65.1523 31.3555 177.7218 50 S 4.9835 8.0505 109.0878 57.7855 64.2531 172.8370 51 L 4.5450 7.6924 120.1541 55.2589 43.9901 173.5443 52 F 5.5131 8.5883 113.8924 55.3525 42.1571 173.4239 53 I 5.0790 9.0314 120.0752 59.5877 40.5774 174.7217 54 V 4.7245 8.9099 126.5291 60.9520 34.7174 173.5583 55 E 4.7205 8.7888 128.9664 54.8303 31.1378 174.4891 56 F 4.9700 8.7652 126.0236 56.8463 41.7237 176.6497 57 G 4.0708 8.3131 108.1547 45.7146 0.0000 174.5965 58 D 4.8615 7.9020 117.2395 53.6839 42.0209 174.9147 59 V 4.0019 7.5928 117.9293 60.8895 32.4393 174.8415 60 E 4.0034 8.7433 127.6763 58.2677 29.6573 176.6699 61 G 4.1253 9.9968 114.4456 45.5348 0.0000 172.8476 62 D 4.8295 7.8253 119.2319 53.2754 41.6373 175.4764 63 K 4.4285 8.2029 117.0369 56.2747 32.8881 176.7386 64 Q 4.7533 8.6328 121.5126 53.6880 32.6246 175.9841 65 V 3.6878 8.5826 119.2442 65.7445 31.6988 176.0668 66 N 4.7759 8.0915 116.9067 51.9230 39.2567 174.1417 67 V 4.7143 8.4567 124.0652 61.5041 33.0559 174.2175 68 Y 5.0971 8.8023 125.2220 55.5649 42.2194 173.8080 69 V 4.8932 8.6076 118.8070 61.1083 34.3164 174.1467 70 E 4.8352 9.3396 127.8294 54.4465 33.0837 174.2219 71 S 5.0063 8.3868 120.5107 56.9786 65.2764 173.2422 72 F 4.8335 8.4575 120.2038 55.8126 42.0169 174.5413 73 T 4.5171 8.8510 112.1035 60.7673 70.7456 175.5751 74 Y 4.6296 8.4404 119.6009 61.1311 37.8609 178.3705 75 S 4.1880 8.3912 113.9348 61.6050 62.4473 175.5828 76 D 4.5329 8.2286 121.4179 57.5239 40.5665 179.0513 77 I 4.1556 7.3535 121.6006 63.3373 37.1800 177.9440 78 L 4.0598 8.0274 120.2992 58.4409 42.0995 178.6929 79 T 4.1319 8.2703 106.7841 61.9510 68.8572 174.3903 80 E 3.8473 8.0227 119.9409 57.3659 27.9830 175.2773 81 K 4.1527 7.9251 122.1937 59.2663 33.2729 176.2276 82 N 5.4997 8.2375 116.7296 50.4594 41.7456 173.8072 83 L 4.8125 8.4407 122.5714 53.4929 44.3233 175.2471 84 I 4.9975 8.0175 120.6508 59.5913 41.3699 173.7552 85 H 4.6612 8.8552 127.0582 54.5537 33.6292 171.6063 86 Y 4.4945 8.1370 122.6184 56.4553 38.6376 175.0695 87 L 4.3671 8.4902 125.2833 53.8434 43.1126 177.2597 88 D 4.5490 8.5620 121.3630 54.5327 41.0763 176.4112 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 Q 8.33 4.32 0.00 2.06 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.76 0.00 0.00 0.00 0.00 0.00 2.27 2.37 0.00 0 G 8.31 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 0.00 0.00 0.00 1 M 8.50 3.98 0.00 1.91 2.17 0.00 0.00 0.00 0.00 0.00 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.42 0.00 2 S 8.78 4.51 0.00 4.05 4.11 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 3 D 8.85 4.43 0.00 2.90 3.02 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 4 A 7.80 3.76 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 F 8.08 4.77 0.00 3.02 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 6 T 7.59 4.10 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 7 D 8.73 4.41 0.00 2.83 2.75 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 8 V 7.79 3.56 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 1.04 0.00 0.00 0.94 0.00 0.00 9 A 7.88 3.95 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 10 K 8.23 3.91 0.00 1.90 1.91 0.00 1.80 0.00 0.00 1.84 0.00 0.00 3.13 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.45 1.57 7.81 11 M 8.30 4.03 0.00 2.12 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 2.58 2.62 0.00 12 K 7.94 3.81 0.00 1.90 1.98 0.00 1.66 0.00 0.00 1.53 0.00 0.00 2.91 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.38 1.40 7.81 13 K 7.99 3.84 0.00 1.86 1.93 0.00 1.50 0.00 0.00 1.58 0.00 0.00 2.98 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.39 1.67 7.81 14 I 8.02 3.74 2.06 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 1.61 0.89 1.11 0.00 0.00 15 K 8.01 3.65 0.00 1.72 1.54 0.00 1.48 0.00 0.00 1.34 0.00 0.00 2.72 0.00 0.00 2.91 0.00 0.00 0.00 0.00 0.30 1.24 7.81 16 E 8.02 3.87 0.00 2.09 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 2.25 2.40 0.00 17 E 8.40 3.65 0.00 1.82 1.12 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 2.05 2.31 0.00 18 I 7.43 3.60 1.94 0.00 0.00 0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.64 0.68 0.00 0.00 19 K 7.99 4.00 0.00 1.88 1.85 0.00 1.59 0.00 0.00 1.60 0.00 0.00 2.92 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.39 1.43 7.81 20 A 7.73 4.01 1.20 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 0.00 0.00 0.00 0.00 0.00 0.00 21 H 7.71 4.51 0.00 3.19 3.29 0.00 5.62 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 E 7.24 4.03 0.00 1.90 1.80 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 2.27 2.21 0.00 23 G 9.32 3.88 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 0.00 0.00 0.00 24 Q 7.70 4.51 0.00 1.48 1.82 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 2.17 2.19 0.00 25 V 8.07 4.48 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 1.04 0.00 0.00 0.92 0.00 0.00 26 V 8.93 4.92 1.92 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 0.68 0.00 0.00 0.94 0.00 0.00 27 E 8.86 5.05 0.00 2.04 1.80 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 2.23 2.43 0.00 28 M 9.30 5.31 0.00 1.89 2.03 0.00 0.00 0.00 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.34 0.00 29 T 8.68 4.90 4.23 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 1.28 0.00 0.00 30 L 8.22 4.76 0.00 1.65 1.52 1.03 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 31 E 8.71 4.27 0.00 2.07 1.92 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 2.45 2.50 0.00 *38 K 7.92 4.16 0.00 1.73 1.85 0.00 1.79 0.00 0.00 1.68 0.00 0.00 2.95 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.30 1.45 7.81 39 N 8.08 4.68 0.00 2.63 2.77 0.00 0.00 6.77 7.66 0.00 0.00 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 R 8.94 4.93 0.00 1.61 1.82 0.00 2.24 0.00 0.00 2.94 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.67 0.00 41 L 9.49 5.21 0.00 1.61 1.60 0.94 0.80 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 42 G 9.13 4.07 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 0.00 43 K 8.61 4.84 0.00 1.60 1.67 0.00 1.73 0.00 0.00 1.54 0.00 0.00 2.76 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.33 1.29 7.81 44 L 8.78 4.54 0.00 1.79 1.66 1.03 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 45 I 8.49 4.24 1.86 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 1.31 0.73 0.91 0.00 0.00 46 E 7.96 4.64 0.00 1.86 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 2.32 2.40 0.00 47 V 7.77 4.65 2.15 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 0.93 0.00 0.00 0.93 0.00 0.00 48 Y 9.03 5.09 0.00 3.26 2.84 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 0.00 0.00 0.00 49 P 0.00 4.45 0.00 2.15 2.20 0.00 3.85 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.19 0.00 50 S 8.05 4.98 0.00 4.05 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 51 L 7.69 4.54 0.00 1.95 1.75 1.02 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 52 F 8.59 5.51 0.00 3.25 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 53 I 9.03 5.08 1.96 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 1.17 1.00 0.00 0.00 54 V 8.91 4.72 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 0.11 0.00 0.00 1.11 0.00 0.00 55 E 8.79 4.72 0.00 1.98 1.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.22 0.00 56 F 8.77 4.97 0.00 1.71 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 57 G 8.31 4.07 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 0.00 58 D 7.90 4.86 0.00 2.58 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 0.00 59 V 7.59 4.00 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 1.00 0.00 0.00 0.95 0.00 0.00 60 E 8.74 4.00 0.00 1.97 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 2.31 2.34 0.00 61 G 10.00 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 62 D 7.83 4.83 0.00 2.59 2.62 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 63 K 8.20 4.43 0.00 1.81 1.75 0.00 1.77 0.00 0.00 1.62 0.00 0.00 2.88 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.61 1.42 7.81 64 Q 8.63 4.75 0.00 2.19 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.95 0.00 0.00 0.00 0.00 0.00 2.54 2.50 0.00 65 V 8.58 3.69 2.11 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 0.82 0.00 0.00 0.95 0.00 0.00 66 N 8.09 4.78 0.00 2.87 2.88 0.00 0.00 6.72 7.68 0.00 0.00 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 V 8.46 4.71 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 0.88 0.00 0.00 0.97 0.00 0.00 68 Y 8.80 5.10 0.00 3.14 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 69 V 8.61 4.89 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 0.83 0.00 0.00 0.94 0.00 0.00 70 E 9.34 4.84 0.00 2.34 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 1.47 2.01 0.00 71 S 8.39 5.01 0.00 3.78 3.73 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 72 F 8.46 4.83 0.00 1.51 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 73 T 8.85 4.52 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 1.18 0.00 0.00 74 Y 8.44 4.63 0.00 3.21 3.19 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 0.00 0.00 0.00 75 S 8.39 4.19 0.00 3.98 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 76 D 8.23 4.53 0.00 3.09 2.90 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 77 I 7.35 4.16 2.18 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 1.71 1.75 0.99 0.00 0.00 78 L 8.03 4.06 0.00 1.72 1.80 0.98 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 79 T 8.27 4.13 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 1.30 0.00 0.00 80 E 8.02 3.85 0.00 2.19 2.11 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 2.28 2.44 0.00 81 K 7.93 4.15 0.00 1.90 2.05 0.00 1.62 0.00 0.00 1.73 0.00 0.00 2.93 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.50 1.48 7.81 82 N 8.24 5.50 0.00 2.69 2.67 0.00 0.00 6.48 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 83 L 8.44 4.81 0.00 1.57 1.54 0.98 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 84 I 8.02 5.00 1.71 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.42 0.57 0.74 0.00 0.00 85 H 8.86 4.66 0.00 3.09 2.96 0.00 5.81 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 Y 8.14 4.49 0.00 2.75 2.36 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 87 L 8.49 4.37 0.00 1.56 1.59 0.93 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 88 D 8.56 4.55 0.00 2.67 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 * Residues marked with a * may have inaccurate shift predictions.