NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -5 T 4.4322 8.1749 110.9490 61.3757 69.6947 175.3640 -4 E 5.4052 9.1859 112.6777 57.0132 31.8121 173.1767 -3 F 4.9528 9.0082 121.3644 56.2979 43.3908 173.9039 -2 K 4.1430 7.3115 124.8474 53.8073 35.8708 176.2069 -1 A 4.0542 7.4733 124.8902 51.7922 19.5587 177.0577 -4 G 5.0152 9.0959 101.2777 45.5132 0.0000 171.4767 -3 S 4.8028 9.0182 116.7644 56.8979 67.5908 172.7039 -2 A 4.1430 7.2614 128.2474 50.1073 21.8708 177.4069 -1 K 4.0542 7.5233 121.4902 55.4922 33.5586 175.8577 5 K 4.1630 8.1312 119.5651 59.4587 32.1269 178.8524 6 G 3.6884 8.1541 105.3310 47.7102 0.0000 175.2215 7 A 2.5800 7.8093 122.9087 54.6822 18.3421 179.5711 8 T 3.9572 7.6640 107.4083 64.2853 69.0837 177.0929 9 L 3.9334 7.8008 122.1871 57.5338 41.6177 178.8087 10 F 3.8907 8.3895 121.0037 61.3367 39.0222 177.2025 11 K 3.9340 7.7979 116.6013 59.8526 32.0116 179.1673 12 T 4.1025 7.8767 108.1074 63.6042 69.0010 175.9609 13 R 4.5317 8.1542 118.5426 55.8722 32.5621 176.0144 14 C 4.3015 7.9503 114.8072 59.3902 30.5252 175.9143 15 L 4.0951 7.3658 119.8769 57.2198 41.8587 177.4201 16 Q 4.0627 8.0293 118.5588 58.9043 28.8961 176.6479 17 C 4.8549 7.8641 111.5177 59.6084 30.4226 173.3239 18 H 5.3975 8.3881 115.4446 54.2815 33.3906 172.3064 19 T 4.9889 8.6108 109.2017 60.3571 71.7668 174.7299 20 V 4.2287 8.2039 113.9146 60.9327 34.0731 176.4575 21 E 4.1295 7.9054 118.5575 55.1479 30.3163 176.0694 22 K 3.7965 8.1563 122.9824 58.1614 32.3887 176.8762 23 G 3.8978 9.0679 114.3418 45.2478 0.0000 173.1765 24 G 3.9005 7.7217 108.5168 43.8327 0.0000 172.3523 25 P 4.5772 0.0000 0.0000 61.5367 32.8051 175.6312 26 H 4.7576 8.3096 116.3055 55.9744 30.3328 175.5031 27 K 4.6832 8.0825 122.6589 56.0322 32.3337 178.1306 28 V 3.7116 9.0346 126.0911 66.5085 31.3864 175.7556 29 G 4.0520 7.9361 106.4975 43.1081 0.0000 171.1855 30 P 4.2876 0.0000 0.0000 61.8106 32.1908 175.7430 31 N 4.5630 9.0019 119.9444 54.0199 39.6050 174.5256 32 L 4.3738 8.7762 124.3257 54.4680 42.2035 175.9861 33 H 4.0729 8.2880 119.8387 57.6298 29.9788 174.9706 34 G 3.9409 8.7713 114.6568 46.6025 0.0000 174.8887 35 I 3.6841 7.3154 122.3596 63.1018 38.1981 176.1775 36 F 4.6126 7.7782 119.2584 58.5016 39.1630 175.6716 37 G 3.9876 9.8098 115.3576 45.0932 0.0000 173.3497 38 R 4.4635 7.6134 119.8837 55.8694 31.8736 175.2689 39 H 5.6381 8.8271 120.5463 53.5654 30.6085 175.2227 40 S 4.3293 8.1976 114.9247 59.1558 63.7004 174.0174 41 G 2.0000 7.6639 107.7425 46.5570 0.0000 174.2463 42 Q 4.5166 7.9957 114.9501 54.9346 29.7500 175.5693 43 A 4.3581 8.3819 122.8876 51.6575 19.0485 177.8000 44 E 4.3602 8.7794 121.1240 56.8803 30.9320 176.8761 45 G 3.9577 8.9797 107.7538 45.9090 0.0000 172.3319 46 Y 4.3255 7.7105 120.3426 55.3204 40.7658 174.6223 47 S 4.5359 7.0862 121.9457 56.8608 61.5731 173.0236 48 Y 4.5882 8.2162 124.8904 57.2955 39.0820 176.4061 49 T 4.3611 8.3997 112.3325 61.3613 71.2865 175.4123 50 D 4.4425 8.6455 121.1051 57.3123 40.9464 178.6124 51 A 3.9788 8.1132 120.8801 55.3777 17.8046 178.7747 52 N 4.2547 8.0650 114.5514 57.2106 38.8651 176.8721 53 I 3.5611 7.0659 118.5236 64.4067 37.2845 178.1304 54 K 4.1444 7.6958 117.3181 58.3020 32.1119 178.9403 55 K 3.8612 7.7688 119.4139 57.7682 33.1191 176.3923 56 N 3.9234 7.5214 114.7574 54.3246 37.9584 174.2129 57 V 3.4591 7.1229 117.9964 62.8375 33.2764 175.0543 58 L 4.2924 7.9162 129.2696 53.1661 43.2826 175.7512 59 W 4.7333 8.6034 127.4798 56.7611 29.6884 175.0563 60 D 5.5259 8.8179 124.1432 50.5098 42.2473 176.4248 61 E 3.7211 8.9018 117.8546 59.8617 28.5047 179.1740 62 N 4.4353 8.1854 116.7170 55.8785 38.8226 177.0613 63 N 4.3948 9.6545 119.1462 56.5514 38.6948 176.9329 64 M 4.2721 8.5212 119.8761 58.9747 32.0399 178.2247 65 S 4.1548 7.5433 111.7238 61.4932 62.6214 175.7222 66 E 4.1027 7.8573 120.1332 59.3388 29.0441 178.4732 67 Y 4.0064 8.1007 119.9190 60.9090 38.9385 178.3966 68 L 3.9773 8.1671 119.4797 57.7904 41.1513 179.7449 69 T 4.3124 7.5365 117.2093 64.9840 68.9236 173.3093 70 N 4.4365 7.8065 118.1814 52.3475 40.5181 172.7260 71 P 3.8110 0.0000 0.0000 63.4077 31.5331 178.1407 *73 K 4.1115 8.0005 121.0582 56.6562 33.7638 176.4081 74 Y 4.2394 8.3040 118.8510 59.8732 39.0593 175.4843 75 I 4.5401 8.6945 122.0390 57.8519 37.6473 171.1302 76 P 4.4299 0.0000 0.0000 64.0612 31.6220 177.7461 77 G 4.0327 9.0214 111.3960 45.0854 0.0000 173.4584 78 T 4.0924 7.8846 115.1547 62.1065 67.7839 173.7980 79 K 4.3198 8.6377 126.0214 57.0455 33.0068 176.2622 80 M 4.1573 7.9459 119.8175 55.7245 32.2002 177.0296 81 A 4.4607 8.3888 134.7866 51.1570 17.7908 176.4253 82 F 4.8982 7.6510 122.7082 55.4035 42.3939 174.4205 83 G 3.3923 8.3260 117.8614 48.5810 0.0000 173.0487 84 G 4.0809 5.3800 105.5053 43.5463 0.0000 172.5223 85 C 4.7118 8.6901 119.2738 57.4505 28.5171 175.3782 86 K 3.9645 8.5271 124.7788 58.7718 32.2565 178.8705 87 K 4.3284 7.8610 118.9254 55.3375 33.5423 177.3593 88 E 4.0187 8.8785 125.0310 59.0250 29.6131 178.9473 89 K 3.9352 8.0268 118.4568 60.2680 32.5370 178.6248 90 D 4.3979 8.1219 120.0323 56.9855 40.8035 178.9563 91 R 4.0209 8.1019 118.4869 59.2578 30.0663 178.8345 92 N 4.6478 8.6588 116.6938 56.5023 38.5605 177.1149 93 D 4.3898 8.1196 120.1596 57.3257 40.9470 178.5706 94 L 4.0881 8.2893 120.9446 58.5410 42.1700 179.1624 95 I 3.9297 8.0952 119.5765 64.5425 36.4632 178.6688 96 T 3.9690 8.1800 116.8034 66.7116 68.2662 175.9875 97 Y 4.0842 8.0603 121.3348 60.7003 38.8140 178.0626 98 L 3.6582 8.3684 120.1826 57.7626 41.5905 179.2786 99 K 3.4179 8.1209 118.3363 59.4579 31.9586 178.3368 100 K 4.0421 7.3470 116.1597 58.6691 32.3242 178.5516 101 A 4.1085 7.5111 119.8180 53.6446 19.0765 178.5743 102 T 4.1769 7.7299 107.1038 62.1145 69.0700 174.9396 103 E 4.0899 7.8011 126.3899 56.8573 29.6960 176.2625 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 -5 T 8.17 4.43 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 1.37 0.00 0.00 -4 E 9.19 5.41 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 2.26 2.36 0.00 -3 F 9.01 4.95 0.00 3.00 3.12 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 -2 K 7.31 4.14 0.00 1.47 1.42 0.00 1.72 0.00 0.00 1.65 0.00 0.00 2.77 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.20 1.29 7.81 -1 A 7.47 4.05 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 -4 G 9.10 5.02 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 0.00 0.00 0.00 -3 S 9.02 4.80 0.00 3.75 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 -2 A 7.26 4.14 1.15 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 -1 K 7.52 4.05 0.00 1.58 1.50 0.00 0.61 0.00 0.00 1.78 0.00 0.00 2.13 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.50 1.32 7.81 5 K 8.13 4.16 0.00 1.83 1.92 0.00 1.73 0.00 0.00 1.83 0.00 0.00 2.95 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.52 1.51 7.81 6 G 8.15 3.69 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 0.00 0.00 0.00 7 A 7.81 2.58 1.09 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 8 T 7.66 3.96 4.21 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 1.17 0.00 0.00 9 L 7.80 3.93 0.00 1.94 1.77 0.99 0.87 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 10 F 8.39 3.89 0.00 2.99 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 11 K 7.80 3.93 0.00 1.76 1.86 0.00 1.76 0.00 0.00 1.77 0.00 0.00 3.18 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.57 1.70 7.81 12 T 7.88 4.10 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 1.22 0.00 0.00 13 R 8.15 4.53 0.00 1.57 1.87 0.00 3.40 0.00 0.00 3.29 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.79 0.00 14 C 7.95 4.30 0.00 1.23 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 0.00 0.00 0.00 15 L 7.37 4.10 0.00 1.50 1.71 1.20 0.85 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 16 Q 8.03 4.06 0.00 1.99 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.56 0.00 0.00 0.00 0.00 0.00 2.32 2.39 0.00 17 C 7.86 4.85 0.00 2.72 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 18 H 8.39 5.40 0.00 3.21 3.26 0.00 5.55 0.00 0.00 0.00 0.00 6.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 T 8.61 4.99 4.64 0.00 0.00 0.00 0.00 0.00 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 20 V 8.20 4.23 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 0.10 0.00 0.00 0.74 0.00 0.00 21 E 7.91 4.13 0.00 2.08 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 2.41 2.22 0.00 22 K 8.16 3.80 0.00 1.02 1.50 0.00 1.56 0.00 0.00 1.64 0.00 0.00 3.04 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.33 1.41 7.81 23 G 9.07 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 24 G 7.72 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 25 P 0.00 4.58 0.00 2.19 2.04 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 1.97 1.98 0.00 26 H 8.31 4.76 0.00 3.28 3.38 0.00 5.64 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 K 8.08 4.68 0.00 1.85 1.04 0.00 1.72 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.38 1.49 7.81 28 V 9.03 3.71 2.05 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 0.79 0.00 0.00 0.93 0.00 0.00 29 G 7.94 4.05 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 0.00 0.00 0.00 30 P 0.00 4.29 0.00 1.74 1.02 0.00 3.48 0.00 0.00 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.68 0.00 31 N 9.00 4.56 0.00 3.01 2.78 0.00 0.00 6.97 7.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 L 8.78 4.37 0.00 1.62 1.45 0.84 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 33 H 8.29 4.07 0.00 3.29 3.23 0.00 6.08 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 G 8.77 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 35 I 7.32 3.68 1.71 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.43 0.69 0.21 0.00 0.00 36 F 7.78 4.61 0.00 3.08 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 37 G 9.81 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 38 R 7.61 4.46 0.00 1.95 2.00 0.00 3.14 0.00 0.00 3.21 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.65 0.00 39 H 8.83 5.64 0.00 2.95 3.13 0.00 6.01 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 40 S 8.20 4.33 0.00 4.06 3.71 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 41 G 7.66 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 0.00 0.00 0.00 0.00 0.00 0.00 42 Q 8.00 4.52 0.00 2.06 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.88 0.00 0.00 0.00 0.00 0.00 2.42 2.33 0.00 43 A 8.38 4.36 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 44 E 8.78 4.36 0.00 2.17 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 2.32 2.37 0.00 45 G 8.98 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 46 Y 7.71 4.33 0.00 2.50 2.40 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 47 S 7.09 4.54 0.00 3.71 3.47 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 8.22 4.59 0.00 3.07 2.92 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 0.00 0.00 0.00 49 T 8.40 4.36 4.32 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 1.32 0.00 0.00 50 D 8.65 4.44 0.00 2.73 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 A 8.11 3.98 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 52 N 8.07 4.25 0.00 3.00 3.01 0.00 0.00 7.30 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 53 I 7.07 3.56 1.99 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 1.29 0.80 0.85 0.00 0.00 54 K 7.70 4.14 0.00 1.78 1.83 0.00 1.69 0.00 0.00 1.62 0.00 0.00 3.13 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.42 1.51 7.81 55 K 7.77 3.86 0.00 1.77 2.03 0.00 1.63 0.00 0.00 1.51 0.00 0.00 2.27 0.00 0.00 2.43 0.00 0.00 0.00 0.00 1.30 1.28 7.81 56 N 7.52 3.92 0.00 2.88 2.67 0.00 0.00 7.21 7.59 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 57 V 7.12 3.46 0.69 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 0.15 0.00 0.00 0.62 0.00 0.00 58 L 7.92 4.29 0.00 1.41 1.38 0.86 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 59 W 8.60 4.73 0.00 3.49 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 60 D 8.82 5.53 0.00 2.79 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 E 8.90 3.72 0.00 1.16 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 1.95 2.17 0.00 62 N 8.19 4.44 0.00 3.00 2.95 0.00 0.00 7.18 6.92 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 63 N 9.65 4.39 0.00 3.18 3.02 0.00 0.00 6.62 7.54 0.00 0.00 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 M 8.52 4.27 0.00 2.49 2.36 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.79 0.00 65 S 7.54 4.15 0.00 4.10 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 66 E 7.86 4.10 0.00 2.12 1.69 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 2.46 2.42 0.00 67 Y 8.10 4.01 0.00 2.82 3.24 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 0.00 68 L 8.17 3.98 0.00 1.78 1.80 0.95 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 69 T 7.54 4.31 4.37 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 1.23 0.00 0.00 70 N 7.81 4.44 0.00 2.61 2.69 0.00 0.00 7.25 7.94 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 71 P 0.00 3.81 0.00 2.18 1.50 0.00 3.78 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 1.82 0.00 *73 K 8.00 4.11 0.00 1.77 2.11 0.00 1.70 0.00 0.00 1.67 0.00 0.00 3.06 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.38 1.58 7.81 74 Y 8.30 4.24 0.00 3.25 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 75 I 8.69 4.54 2.18 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.14 0.99 0.00 0.00 76 P 0.00 4.43 0.00 2.17 2.10 0.00 3.45 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.09 0.00 77 G 9.02 4.03 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 0.00 0.00 0.00 78 T 7.88 4.09 4.45 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 1.50 0.00 0.00 79 K 8.64 4.32 0.00 1.96 1.95 0.00 1.67 0.00 0.00 1.67 0.00 0.00 3.02 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.50 1.53 7.81 80 M 7.95 4.16 0.00 2.23 2.21 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.62 0.00 81 A 8.39 4.46 1.30 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 0.00 0.00 82 F 7.65 4.90 0.00 2.86 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 83 G 8.33 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 0.00 0.00 0.00 84 G 5.38 4.08 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 C 8.69 4.71 0.00 3.20 2.95 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 86 K 8.53 3.96 0.00 1.73 1.87 0.00 1.73 0.00 0.00 1.68 0.00 0.00 2.93 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.40 1.38 7.81 87 K 7.86 4.33 0.00 1.99 1.75 0.00 1.68 0.00 0.00 1.75 0.00 0.00 2.89 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.51 1.49 7.81 88 E 8.88 4.02 0.00 2.06 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 2.40 2.42 0.00 89 K 8.03 3.94 0.00 2.02 2.06 0.00 1.57 0.00 0.00 1.82 0.00 0.00 2.95 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.50 1.55 7.81 90 D 8.12 4.40 0.00 2.94 2.81 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 0.00 0.00 0.00 91 R 8.10 4.02 0.00 2.14 2.10 0.00 3.25 0.00 0.00 3.34 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.97 0.00 92 N 8.66 4.65 0.00 2.83 2.90 0.00 0.00 7.05 7.62 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 93 D 8.12 4.39 0.00 2.93 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 L 8.29 4.09 0.00 1.91 1.78 1.20 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 95 I 8.10 3.93 2.14 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 1.61 0.56 0.33 0.00 0.00 96 T 8.18 3.97 4.48 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 1.26 0.00 0.00 97 Y 8.06 4.08 0.00 3.31 3.24 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 0.00 98 L 8.37 3.66 0.00 2.00 1.93 0.98 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 99 K 8.12 3.42 0.00 1.05 1.89 0.00 1.65 0.00 0.00 1.54 0.00 0.00 2.97 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.29 1.22 7.81 100 K 7.35 4.04 0.00 1.76 1.75 0.00 1.70 0.00 0.00 1.65 0.00 0.00 3.04 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.39 1.58 7.81 101 A 7.51 4.11 0.67 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 0.00 0.00 102 T 7.73 4.18 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 1.08 0.00 0.00 103 E 7.80 4.09 0.00 1.92 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 2.45 2.20 0.00 * Residues marked with a * may have inaccurate shift predictions.