NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 K 4.2935 8.2993 120.1340 56.3241 33.7624 175.4235 3 T 4.0562 8.0488 112.1101 60.1085 69.4986 172.9675 4 P 4.2528 0.0000 0.0000 66.1802 31.9478 180.0500 5 E 4.0310 8.0450 115.7697 59.3377 29.5897 178.3660 6 D 4.5596 7.7062 116.2301 54.7953 41.4127 176.6947 7 C 4.4202 7.2455 117.9213 60.0193 28.5206 173.7507 8 T 4.2583 8.8026 114.3729 62.5205 69.7375 174.2573 9 G 4.0425 7.2563 109.1901 43.9715 0.0000 173.6241 10 L 4.0552 8.3543 117.9519 57.4801 41.3965 179.3017 11 A 3.9727 8.0039 120.4022 55.4348 18.3396 179.0115 12 D 4.3346 8.1434 116.6508 57.8189 40.8952 179.2736 13 I 3.7545 7.3761 118.9668 64.4501 37.1847 178.7670 14 R 3.9447 8.4206 119.3895 59.2984 29.8719 179.0370 15 E 4.0047 8.3409 118.2813 59.1218 29.3853 179.1172 16 A 4.0162 8.1452 120.9379 55.2259 18.4327 179.7530 17 I 3.6462 7.9492 118.3213 64.4618 37.1388 178.1600 18 D 4.3623 7.9927 119.6666 57.6447 40.7280 179.0880 19 R 3.9482 8.0166 118.8565 59.4280 30.0343 178.6482 20 I 3.7372 8.0732 119.9064 64.5217 37.1778 178.1927 21 D 4.3774 8.5872 120.2199 57.1921 40.5506 178.6250 22 L 3.9754 8.4436 121.3914 58.1406 42.0157 178.5416 23 D 4.3867 8.2545 118.9300 57.6580 40.7182 179.0781 24 I 3.7306 7.8147 120.1400 64.2293 37.0060 178.6785 25 V 3.6116 7.7601 119.0226 66.1313 31.4046 178.1213 26 Q 3.9900 8.3615 117.6879 58.8740 28.4851 178.5652 27 A 4.0699 8.2886 121.9590 55.3704 18.3272 179.7446 28 L 4.1775 8.5404 117.9345 57.7865 41.1134 180.0933 29 G 3.6595 8.4258 106.2200 47.9048 0.0000 176.1409 30 R 4.0690 8.2498 120.6324 58.8367 30.0871 179.0250 31 R 4.1829 8.5244 118.9542 59.7619 29.9973 178.2838 32 M 4.2088 8.3076 117.9698 58.6510 32.2010 177.8683 33 D 4.2077 7.8536 118.3622 57.6567 41.0055 178.4744 34 Y 4.1052 7.8674 116.6635 61.0456 37.6399 178.7736 35 V 3.7579 7.9125 118.3330 66.0095 31.4449 178.0043 36 K 3.8575 8.2804 118.2677 59.1428 31.5738 179.2732 37 A 3.9567 7.9941 121.0276 54.8993 18.2369 179.5098 38 A 4.2431 8.3411 119.4876 55.0379 18.4744 179.8522 39 S 4.2987 7.8580 112.0662 61.6906 62.7081 176.9092 40 R 3.8832 7.3767 120.8563 58.2298 29.6542 177.2557 41 F 5.0462 7.4912 115.4756 56.9794 39.2335 175.2497 42 K 4.6706 7.9307 120.4682 54.6121 33.6949 176.4494 43 A 4.4880 8.7733 126.4104 53.9172 19.1399 177.2169 44 S 4.3483 7.5152 109.2818 56.3506 66.0448 174.7897 45 E 2.8900 7.3449 122.7609 58.9431 29.4167 178.9180 46 A 3.8990 7.4940 119.9042 54.4325 18.6156 177.6611 47 A 4.1643 7.3906 117.0106 52.6446 18.6126 177.1590 48 I 4.1449 7.2442 118.7429 59.3238 37.3189 173.9765 49 P 4.6682 0.0000 0.0000 60.7130 33.5281 175.5900 50 A 4.0805 8.2560 120.3326 51.5362 18.9595 176.5314 51 P 4.2363 0.0000 0.0000 66.0038 31.5957 178.7347 52 E 4.0310 8.1026 116.9767 58.9015 29.3968 179.0537 53 R 3.8134 7.8912 118.5302 59.4950 30.3833 178.3636 54 V 3.5688 7.6789 117.3716 66.2000 31.2539 177.9014 55 A 4.0052 7.8981 118.9345 54.5496 18.5837 178.7658 56 A 4.1922 7.8095 118.6122 54.5180 19.2633 179.3457 57 M 3.8696 8.2642 117.8038 58.5402 31.9533 178.9703 58 L 3.8382 7.6396 118.5061 57.3159 41.9277 177.8257 59 P 4.1057 0.0000 0.0000 65.7447 30.9564 177.9007 60 E 3.4034 7.3939 118.0465 58.9631 29.3349 179.1007 61 R 3.4856 7.3303 117.7329 58.7641 30.0818 178.6453 62 A 3.9657 7.9300 120.8046 55.3050 18.4539 179.6819 63 R 3.8180 8.1438 117.3795 59.3143 29.8367 178.5780 64 W 4.6244 8.1638 118.7690 59.8194 28.9709 178.1395 65 A 4.1526 8.3336 120.7521 55.5239 17.7778 179.3813 66 E 4.2190 8.1779 118.1485 59.1396 29.3711 179.4394 67 E 4.2249 8.1893 116.5045 58.0132 29.5113 177.3695 68 N 4.8486 7.5361 115.3634 52.8967 39.0304 175.2073 69 G 3.9315 8.1105 105.2555 45.8894 0.0000 173.8445 70 L 4.8432 7.8943 118.8433 52.0051 44.9021 175.3875 71 D 4.5746 8.5886 119.8518 53.8298 42.2826 176.7139 72 A 3.9847 8.8219 129.4837 54.9600 18.6055 177.5179 73 P 4.2082 0.0000 0.0000 65.7741 31.3396 178.5716 74 F 4.2194 8.4450 118.9040 61.5113 39.3592 177.4386 75 V 3.2529 7.9115 117.8734 65.6965 31.2052 177.5857 76 E 4.0687 8.9287 119.8304 59.0708 29.4593 179.0545 77 G 3.5187 8.1493 105.8598 47.5401 0.0000 175.3131 78 L 3.6857 7.7429 123.1606 58.0233 41.9950 179.2655 79 F 3.9156 8.3543 117.3737 60.0862 38.7707 177.4183 80 A 4.0498 8.3291 120.9318 55.4294 18.1000 179.7739 81 Q 4.0130 8.0408 116.3308 59.0767 28.7074 178.7773 82 I 3.7634 7.6711 120.7567 64.6663 37.1016 178.4025 83 I 3.7350 8.1770 120.7689 64.6991 37.0866 178.0269 84 H 4.1864 8.4785 118.9022 59.1337 29.7421 177.1807 85 W 4.1416 8.6772 130.2995 60.7969 30.5979 177.5976 86 Y 3.9788 8.9275 117.0496 61.0902 37.2502 178.3600 87 T 3.8549 8.3784 116.8635 66.7833 68.6546 176.3008 88 A 3.8455 7.6702 121.9106 55.1999 18.3490 179.5661 89 E 3.7286 7.9993 117.1441 59.3642 29.3702 179.3082 90 Q 4.0472 8.5706 120.0331 59.1910 29.0584 178.4427 91 I 3.7138 7.8808 120.7530 64.3251 37.1961 178.3019 92 K 3.8842 7.9966 119.2591 59.9332 31.8478 178.7237 93 Y 4.0126 8.2003 119.4843 60.2578 38.6193 177.8035 94 W 3.9819 8.7629 129.7363 60.5582 30.6543 178.1962 95 R 4.1291 8.2996 116.8776 59.5745 29.6070 178.8575 96 Q 4.0398 8.0693 116.9934 58.2203 28.7295 177.8488 97 T 4.0443 7.1854 110.8722 62.7448 69.9948 175.4100 *98 R 3.6784 7.3778 124.4751 56.0957 30.0058 179.9897 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 K 8.30 4.29 0.00 1.76 1.81 0.00 1.71 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.34 1.44 7.81 3 T 8.05 4.06 4.36 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 1.21 0.00 0.00 4 P 0.00 4.25 0.00 2.17 2.16 0.00 3.60 0.00 0.00 3.77 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 5 E 8.04 4.03 0.00 1.91 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 2.31 2.46 0.00 6 D 7.71 4.56 0.00 2.78 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 7 C 7.25 4.42 0.00 3.15 2.87 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 0.00 0.00 0.00 8 T 8.80 4.26 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 9 G 7.26 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 0.00 0.00 0.00 10 L 8.35 4.06 0.00 1.70 1.73 0.92 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 11 A 8.00 3.97 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 D 8.14 4.33 0.00 2.86 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 13 I 7.38 3.75 2.01 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 1.52 0.64 0.91 0.00 0.00 14 R 8.42 3.94 0.00 1.81 1.98 0.00 3.12 0.00 0.00 3.16 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.81 0.00 15 E 8.34 4.00 0.00 2.00 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 2.50 2.47 0.00 16 A 8.15 4.02 1.38 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 0.00 0.00 0.00 17 I 7.95 3.65 2.01 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 1.53 0.65 0.91 0.00 0.00 18 D 7.99 4.36 0.00 2.94 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 19 R 8.02 3.95 0.00 1.94 2.10 0.00 3.15 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 1.63 1.72 0.00 20 I 8.07 3.74 2.01 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.49 0.93 0.00 0.00 21 D 8.59 4.38 0.00 2.84 2.72 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 22 L 8.44 3.98 0.00 1.79 1.89 0.93 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 23 D 8.25 4.39 0.00 2.96 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 24 I 7.81 3.73 2.01 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.82 0.90 0.00 0.00 25 V 7.76 3.61 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 1.13 0.00 0.00 0.98 0.00 0.00 26 Q 8.36 3.99 0.00 2.29 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.57 0.00 0.00 0.00 0.00 0.00 2.40 2.55 0.00 27 A 8.29 4.07 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.54 4.18 0.00 1.96 1.95 0.93 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 29 G 8.43 3.66 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 0.00 0.00 0.00 0.00 0.00 0.00 30 R 8.25 4.07 0.00 2.17 2.20 0.00 3.24 0.00 0.00 3.15 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.93 0.00 31 R 8.52 4.18 0.00 2.18 2.36 0.00 3.01 0.00 0.00 2.48 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.70 0.00 32 M 8.31 4.21 0.00 2.22 1.96 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.45 0.00 33 D 7.85 4.21 0.00 2.78 2.46 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 7.87 4.11 0.00 3.26 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 35 V 7.91 3.76 2.38 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 1.02 0.00 0.00 1.22 0.00 0.00 36 K 8.28 3.86 0.00 1.36 0.74 0.00 1.39 0.00 0.00 0.95 0.00 0.00 2.83 0.00 0.00 2.77 0.00 0.00 0.00 0.00 0.86 1.27 7.81 37 A 7.99 3.96 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 38 A 8.34 4.24 1.58 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 0.00 0.00 39 S 7.86 4.30 0.00 4.52 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 0.00 40 R 7.38 3.88 0.00 0.79 1.67 0.00 3.00 0.00 0.00 3.13 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.56 0.00 41 F 7.49 5.05 0.00 3.23 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 42 K 7.93 4.67 0.00 2.10 1.89 0.00 1.84 0.00 0.00 1.78 0.00 0.00 3.13 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.52 1.57 7.81 43 A 8.77 4.49 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 44 S 7.52 4.35 0.00 3.76 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 45 E 7.34 2.89 0.00 1.16 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 0.00 2.14 2.09 0.00 46 A 7.49 3.90 1.19 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 0.00 0.00 47 A 7.39 4.16 1.22 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 0.00 0.00 0.00 48 I 7.24 4.14 1.87 0.00 0.00 0.63 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 0.56 0.90 0.00 0.00 49 P 0.00 4.67 0.00 2.18 2.08 0.00 3.75 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 1.93 1.96 0.00 50 A 8.26 4.08 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 51 P 0.00 4.24 0.00 2.16 2.11 0.00 3.59 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 2.10 2.17 0.00 52 E 8.10 4.03 0.00 2.04 1.98 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 2.38 2.41 0.00 53 R 7.89 3.81 0.00 1.92 2.13 0.00 3.22 0.00 0.00 3.26 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.75 0.00 54 V 7.68 3.57 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 0.96 0.00 0.00 0.99 0.00 0.00 55 A 7.90 4.01 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 56 A 7.81 4.19 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 57 M 8.26 3.87 0.00 1.94 2.21 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 2.77 2.53 0.00 58 L 7.64 3.84 0.00 1.65 1.84 0.92 1.06 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 59 P 0.00 4.11 0.00 2.14 2.23 0.00 3.62 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.00 0.00 60 E 7.39 3.40 0.00 1.81 1.59 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 0.00 1.47 1.47 0.00 61 R 7.33 3.49 0.00 1.56 1.24 0.00 2.21 0.00 0.00 2.63 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.35 0.00 62 A 7.93 3.97 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 63 R 8.14 3.82 0.00 1.85 1.87 0.00 3.03 0.00 0.00 3.14 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.65 0.00 64 W 8.16 4.62 0.00 3.54 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 65 A 8.33 4.15 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 66 E 8.18 4.22 0.00 2.18 2.06 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 2.37 2.39 0.00 67 E 8.19 4.22 0.00 2.25 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 2.40 2.40 0.00 68 N 7.54 4.85 0.00 2.80 2.82 0.00 0.00 7.02 7.35 0.00 0.00 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 G 8.11 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 70 L 7.89 4.84 0.00 1.90 1.69 1.04 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 71 D 8.59 4.57 0.00 2.84 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 72 A 8.82 3.98 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.21 0.00 2.36 2.17 0.00 4.02 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.18 0.00 74 F 8.45 4.22 0.00 3.18 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 75 V 7.91 3.25 2.18 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 1.26 0.00 0.00 1.14 0.00 0.00 76 E 8.93 4.07 0.00 2.10 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 2.30 2.44 0.00 77 G 8.15 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.74 3.69 0.00 1.18 1.45 0.68 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 79 F 8.35 3.92 0.00 3.18 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 80 A 8.33 4.05 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 81 Q 8.04 4.01 0.00 2.25 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.73 0.00 0.00 0.00 0.00 0.00 2.38 2.53 0.00 82 I 7.67 3.76 1.81 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 1.34 0.57 0.46 0.00 0.00 83 I 8.18 3.73 2.00 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 1.46 0.83 0.97 0.00 0.00 84 H 8.48 4.19 0.00 3.43 3.65 0.00 5.78 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 W 8.68 4.14 0.00 3.64 3.39 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 86 Y 8.93 3.98 0.00 3.17 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 87 T 8.38 3.85 4.46 0.00 0.00 0.00 0.00 0.00 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 88 A 7.67 3.85 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 E 8.00 3.73 0.00 1.88 1.82 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 1.79 2.14 0.00 90 Q 8.57 4.05 0.00 2.26 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.81 0.00 0.00 0.00 0.00 0.00 2.47 2.61 0.00 91 I 7.88 3.71 1.97 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.45 0.87 0.00 0.00 92 K 8.00 3.88 0.00 1.98 1.87 0.00 1.58 0.00 0.00 1.51 0.00 0.00 2.72 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.41 1.52 7.81 93 Y 8.20 4.01 0.00 3.15 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 W 8.76 3.98 0.00 3.61 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 95 R 8.30 4.13 0.00 2.07 2.05 0.00 3.26 0.00 0.00 3.27 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 2.02 0.00 96 Q 8.07 4.04 0.00 1.96 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.79 0.00 0.00 0.00 0.00 0.00 2.34 2.44 0.00 97 T 7.19 4.04 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 0.38 0.00 0.00 *98 R 7.38 3.68 0.00 0.67 0.66 0.00 2.86 0.00 0.00 2.31 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 1.11 0.00 * Residues marked with a * may have inaccurate shift predictions.